Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
581707 | 2mts RC | 25181 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ALA 1 HT1 ALA 1 5.304 2.316 12.163
2 H2 ALA 1 HT2 ALA 1 4.850 3.798 11.468
3 H3 ALA 1 HT3 ALA 1 6.415 3.595 12.095
4 HA ALA 1 HA ALA 1 6.951 3.235 9.954
5 HB1 ALA 1 HB1 ALA 1 6.790 0.807 9.398
6 HB2 ALA 1 HB2 ALA 1 5.691 0.597 10.762
7 HB3 ALA 1 HB3 ALA 1 7.360 1.088 11.043
8 H LEU 2 HN LEU 2 3.609 2.791 10.711
9 HA LEU 2 HA LEU 2 2.677 2.307 8.046
10 HB2 LEU 2 HB2 LEU 2 1.064 3.530 10.284
11 HB3 LEU 2 HB1 LEU 2 0.494 2.538 8.942
12 HG LEU 2 HG LEU 2 2.202 1.646 11.278
13 HD11 LEU 2 HD11 LEU 2 -0.295 1.846 11.582
14 HD12 LEU 2 HD12 LEU 2 0.326 0.208 11.790
15 HD13 LEU 2 HD13 LEU 2 -0.489 0.659 10.292
16 HD21 LEU 2 HD21 LEU 2 3.102 0.479 9.417
17 HD22 LEU 2 HD22 LEU 2 1.520 0.307 8.656
18 HD23 LEU 2 HD23 LEU 2 1.914 -0.634 10.096
19 H GLU 3 HN GLU 3 1.753 3.742 6.587
20 HA GLU 3 HA GLU 3 2.469 6.575 7.023
21 HB2 GLU 3 HB2 GLU 3 2.096 4.993 4.471
22 HB3 GLU 3 HB1 GLU 3 2.373 6.734 4.528
23 HG2 GLU 3 HG2 GLU 3 4.231 4.662 5.729
24 HG3 GLU 3 HG1 GLU 3 4.473 5.429 4.160
25 H ASN 4 HN ASN 4 0.951 7.733 5.046
26 HA ASN 4 HA ASN 4 -1.586 7.968 6.324
27 HB2 ASN 4 HB2 ASN 4 -0.722 8.962 3.598
28 HB3 ASN 4 HB1 ASN 4 -2.125 9.514 4.510
29 HD21 ASN 4 HD21 ASN 4 -0.756 11.655 4.148
30 HD22 ASN 4 HD22 ASN 4 0.342 12.033 5.388
31 H LEU 5 HN LEU 5 -0.683 6.782 3.076
32 HA LEU 5 HA LEU 5 -3.199 5.947 2.248
33 HB2 LEU 5 HB2 LEU 5 -0.424 4.979 1.604
34 HB3 LEU 5 HB1 LEU 5 -1.842 4.217 0.884
35 HG LEU 5 HG LEU 5 -0.889 6.057 -0.526
36 HD11 LEU 5 HD11 LEU 5 -2.980 6.643 -1.255
37 HD12 LEU 5 HD12 LEU 5 -3.520 7.118 0.356
38 HD13 LEU 5 HD13 LEU 5 -3.484 5.413 -0.095
39 HD21 LEU 5 HD21 LEU 5 -0.261 7.426 1.560
40 HD22 LEU 5 HD22 LEU 5 -1.954 7.917 1.607
41 HD23 LEU 5 HD23 LEU 5 -0.957 8.321 0.209
42 H VAL 6 HN VAL 6 -1.498 4.836 4.889
43 HA VAL 6 HA VAL 6 -2.493 2.090 4.758
44 HB VAL 6 HB VAL 6 -0.932 3.477 6.949
45 HG11 VAL 6 HG11 VAL 6 -0.351 1.007 7.417
46 HG12 VAL 6 HG12 VAL 6 -1.733 0.619 6.393
47 HG13 VAL 6 HG13 VAL 6 -1.966 1.552 7.871
48 HG21 VAL 6 HG21 VAL 6 -0.031 1.744 4.625
49 HG22 VAL 6 HG22 VAL 6 1.003 2.238 5.967
50 HG23 VAL 6 HG23 VAL 6 0.349 3.449 4.867
51 H VAL 7 HN VAL 7 -2.771 4.907 6.931
52 HA VAL 7 HA VAL 7 -4.966 3.694 8.380
53 HB VAL 7 HB VAL 7 -3.302 5.172 9.489
54 HG11 VAL 7 HG11 VAL 7 -3.211 7.505 9.029
55 HG12 VAL 7 HG12 VAL 7 -4.680 7.449 8.055
56 HG13 VAL 7 HG13 VAL 7 -3.190 6.727 7.446
57 HG21 VAL 7 HG21 VAL 7 -4.903 6.312 10.859
58 HG22 VAL 7 HG22 VAL 7 -5.716 4.860 10.275
59 HG23 VAL 7 HG23 VAL 7 -6.059 6.423 9.532
60 H LEU 8 HN LEU 8 -4.555 5.801 5.668
61 HA LEU 8 HA LEU 8 -7.019 7.171 5.716
62 HB2 LEU 8 HB2 LEU 8 -4.872 7.375 4.155
63 HB3 LEU 8 HB1 LEU 8 -5.843 6.344 3.103
64 HG LEU 8 HG LEU 8 -6.309 8.670 2.563
65 HD11 LEU 8 HD11 LEU 8 -8.186 6.885 2.782
66 HD12 LEU 8 HD12 LEU 8 -8.662 8.578 2.661
67 HD13 LEU 8 HD13 LEU 8 -8.656 7.774 4.230
68 HD21 LEU 8 HD21 LEU 8 -6.505 10.310 4.123
69 HD22 LEU 8 HD22 LEU 8 -5.812 9.133 5.237
70 HD23 LEU 8 HD23 LEU 8 -7.562 9.333 5.142
71 H ASN 9 HN ASN 9 -6.078 4.101 4.181
72 HA ASN 9 HA ASN 9 -8.591 3.555 3.003
73 HB2 ASN 9 HB2 ASN 9 -6.253 1.824 3.790
74 HB3 ASN 9 HB1 ASN 9 -7.715 1.137 3.083
75 HD21 ASN 9 HD21 ASN 9 -5.012 3.371 2.436
76 HD22 ASN 9 HD22 ASN 9 -5.200 3.365 0.749
77 H ALA 10 HN ALA 10 -7.148 2.517 6.087
78 HA ALA 10 HA ALA 10 -9.430 1.014 6.918
79 HB1 ALA 10 HB1 ALA 10 -8.321 0.967 9.113
80 HB2 ALA 10 HB2 ALA 10 -7.171 2.185 8.559
81 HB3 ALA 10 HB3 ALA 10 -7.183 0.583 7.821
82 H ALA 11 HN ALA 11 -8.333 4.329 7.409
83 HA ALA 11 HA ALA 11 -10.072 5.126 9.438
84 HB1 ALA 11 HB1 ALA 11 -8.826 6.603 7.128
85 HB2 ALA 11 HB2 ALA 11 -8.397 6.668 8.838
86 HB3 ALA 11 HB3 ALA 11 -9.889 7.419 8.275
87 H SER 12 HN SER 12 -10.575 5.061 5.922
88 HA SER 12 HA SER 12 -13.148 6.216 5.910
89 HB2 SER 12 HB2 SER 12 -13.377 5.133 3.686
90 HB3 SER 12 HB1 SER 12 -11.849 5.991 3.865
91 HG SER 12 HG SER 12 -11.215 4.062 3.142
92 H VAL 13 HN VAL 13 -12.074 2.849 6.183
93 HA VAL 13 HA VAL 13 -14.687 1.713 6.160
94 HB VAL 13 HB VAL 13 -12.080 0.636 7.260
95 HG11 VAL 13 HG11 VAL 13 -13.898 -0.578 8.269
96 HG12 VAL 13 HG12 VAL 13 -13.278 -1.577 6.956
97 HG13 VAL 13 HG13 VAL 13 -14.768 -0.659 6.739
98 HG21 VAL 13 HG21 VAL 13 -11.909 1.042 4.888
99 HG22 VAL 13 HG22 VAL 13 -13.509 0.357 4.601
100 HG23 VAL 13 HG23 VAL 13 -12.179 -0.689 5.101
101 H ALA 14 HN ALA 14 -12.461 2.677 8.752
102 HA ALA 14 HA ALA 14 -13.894 1.714 10.943
103 HB1 ALA 14 HB1 ALA 14 -12.117 4.138 10.647
104 HB2 ALA 14 HB2 ALA 14 -11.683 2.554 11.289
105 HB3 ALA 14 HB3 ALA 14 -12.768 3.606 12.196
106 H GLY 15 HN GLY 15 -14.038 4.958 9.462
107 HA2 GLY 15 HA2 GLY 15 -16.356 5.822 9.086
108 HA3 GLY 15 HA1 GLY 15 -16.683 5.320 10.741
109 H ALA 16 HN ALA 16 -15.526 6.404 12.473
110 HA ALA 16 HA ALA 16 -15.643 9.150 12.424
111 HB1 ALA 16 HB1 ALA 16 -14.257 9.132 14.435
112 HB2 ALA 16 HB2 ALA 16 -13.718 7.493 14.070
113 HB3 ALA 16 HB3 ALA 16 -15.406 7.795 14.482
114 H HIS 17 HN HIS 17 -12.535 7.392 12.454
115 HA HIS 17 HA HIS 17 -10.905 9.515 11.738
116 HB2 HIS 17 HB2 HIS 17 -10.697 6.547 11.453
117 HB3 HIS 17 HB1 HIS 17 -9.507 7.558 10.632
118 HD2 HIS 17 HD2 HIS 17 -10.907 7.393 14.373
119 HE1 HIS 17 HE1 HIS 17 -6.812 8.414 14.446
120 HE2 HIS 17 HE2 HIS 17 -8.847 7.933 15.885
121 H GLY 18 HN GLY 18 -13.186 7.812 9.820
122 HA2 GLY 18 HA2 GLY 18 -12.009 8.331 7.255
123 HA3 GLY 18 HA1 GLY 18 -13.662 7.806 7.557
124 H ILE 19 HN ILE 19 -14.797 9.740 8.990
125 HA ILE 19 HA ILE 19 -15.222 11.808 7.077
126 HB ILE 19 HB ILE 19 -16.635 12.810 8.918
127 HG12 ILE 19 HG12 ILE 19 -15.890 10.260 10.379
128 HG13 ILE 19 HG11 ILE 19 -15.194 11.835 10.759
129 HG21 ILE 19 HG21 ILE 19 -17.483 11.159 7.241
130 HG22 ILE 19 HG22 ILE 19 -18.316 11.048 8.791
131 HG23 ILE 19 HG23 ILE 19 -17.083 9.861 8.366
132 HD11 ILE 19 HD11 ILE 19 -17.470 12.726 11.173
133 HD12 ILE 19 HD12 ILE 19 -17.096 11.373 12.241
134 HD13 ILE 19 HD13 ILE 19 -18.142 11.130 10.842
135 H LEU 20 HN LEU 20 -13.086 11.437 9.772
136 HA LEU 20 HA LEU 20 -12.598 14.198 10.293
137 HB2 LEU 20 HB2 LEU 20 -11.509 11.618 11.141
138 HB3 LEU 20 HB1 LEU 20 -10.279 12.876 11.003
139 HG LEU 20 HG LEU 20 -11.281 12.864 13.259
140 HD11 LEU 20 HD11 LEU 20 -11.127 15.120 13.344
141 HD12 LEU 20 HD12 LEU 20 -12.504 15.332 12.263
142 HD13 LEU 20 HD13 LEU 20 -10.895 15.053 11.597
143 HD21 LEU 20 HD21 LEU 20 -13.538 12.023 12.310
144 HD22 LEU 20 HD22 LEU 20 -13.874 13.721 11.967
145 HD23 LEU 20 HD23 LEU 20 -13.599 13.194 13.628
146 H SER 21 HN SER 21 -11.038 11.775 8.225
147 HA SER 21 HA SER 21 -8.887 13.393 7.357
148 HB2 SER 21 HB2 SER 21 -10.270 11.009 6.125
149 HB3 SER 21 HB1 SER 21 -8.875 11.788 5.381
150 HG SER 21 HG SER 21 -7.764 11.423 7.379
151 H PHE 22 HN PHE 22 -12.232 13.175 6.384
152 HA PHE 22 HA PHE 22 -12.030 14.439 3.861
153 HB2 PHE 22 HB2 PHE 22 -14.223 13.954 5.832
154 HB3 PHE 22 HB1 PHE 22 -14.500 15.120 4.538
155 HD1 PHE 22 HD1 PHE 22 -12.638 11.864 4.715
156 HD2 PHE 22 HD2 PHE 22 -15.742 14.150 2.821
157 HE1 PHE 22 HE1 PHE 22 -13.034 10.006 3.122
158 HE2 PHE 22 HE2 PHE 22 -16.139 12.292 1.227
159 HZ PHE 22 HZ PHE 22 -14.785 10.219 1.378
160 H LEU 23 HN LEU 23 -11.491 15.626 6.973
161 HA LEU 23 HA LEU 23 -12.476 18.149 7.146
162 HB2 LEU 23 HB2 LEU 23 -10.946 17.197 8.810
163 HB3 LEU 23 HB1 LEU 23 -9.605 17.347 7.675
164 HG LEU 23 HG LEU 23 -9.999 19.808 7.587
165 HD11 LEU 23 HD11 LEU 23 -11.425 20.579 9.677
166 HD12 LEU 23 HD12 LEU 23 -12.199 19.009 9.463
167 HD13 LEU 23 HD13 LEU 23 -12.222 20.189 8.154
168 HD21 LEU 23 HD21 LEU 23 -9.026 20.284 9.764
169 HD22 LEU 23 HD22 LEU 23 -8.375 18.749 9.189
170 HD23 LEU 23 HD23 LEU 23 -9.644 18.766 10.415
171 H VAL 24 HN VAL 24 -9.818 17.090 5.064
172 HA VAL 24 HA VAL 24 -9.187 19.698 4.079
173 HB VAL 24 HB VAL 24 -8.660 17.074 2.679
174 HG11 VAL 24 HG11 VAL 24 -7.137 19.696 2.783
175 HG12 VAL 24 HG12 VAL 24 -8.178 19.185 1.454
176 HG13 VAL 24 HG13 VAL 24 -6.708 18.281 1.821
177 HG21 VAL 24 HG21 VAL 24 -7.798 16.628 4.815
178 HG22 VAL 24 HG22 VAL 24 -7.390 18.319 5.108
179 HG23 VAL 24 HG23 VAL 24 -6.412 17.355 4.001
180 H PHE 25 HN PHE 25 -11.267 17.061 2.968
181 HA PHE 25 HA PHE 25 -11.944 18.335 0.484
182 HB2 PHE 25 HB2 PHE 25 -12.060 15.903 0.709
183 HB3 PHE 25 HB1 PHE 25 -13.280 16.062 1.973
184 HD1 PHE 25 HD2 PHE 25 -12.581 16.619 -1.628
185 HD2 PHE 25 HD1 PHE 25 -15.574 16.538 1.451
186 HE1 PHE 25 HE2 PHE 25 -14.358 16.728 -3.354
187 HE2 PHE 25 HE1 PHE 25 -17.352 16.647 -0.274
188 HZ PHE 25 HZ PHE 25 -16.744 16.742 -2.677
189 H PHE 26 HN PHE 26 -13.179 18.386 3.740
190 HA PHE 26 HA PHE 26 -15.774 19.402 3.153
191 HB2 PHE 26 HB2 PHE 26 -14.344 18.617 5.455
192 HB3 PHE 26 HB1 PHE 26 -14.803 20.301 5.712
193 HD1 PHE 26 HD2 PHE 26 -16.273 17.127 4.341
194 HD2 PHE 26 HD1 PHE 26 -16.915 20.727 6.594
195 HE1 PHE 26 HE2 PHE 26 -18.606 16.422 4.803
196 HE2 PHE 26 HE1 PHE 26 -19.247 20.023 7.055
197 HZ PHE 26 HZ PHE 26 -20.093 17.870 6.161
198 H SER 27 HN SER 27 -12.680 20.934 3.972
199 HA SER 27 HA SER 27 -13.408 23.554 4.311
200 HB2 SER 27 HB2 SER 27 -11.032 22.588 2.707
201 HB3 SER 27 HB1 SER 27 -11.202 24.170 3.463
202 HG SER 27 HG SER 27 -11.688 22.121 5.189
203 H ALA 28 HN ALA 28 -12.982 21.831 1.240
204 HA ALA 28 HA ALA 28 -13.583 24.146 -0.363
205 HB1 ALA 28 HB1 ALA 28 -13.610 22.524 -2.239
206 HB2 ALA 28 HB2 ALA 28 -13.459 21.206 -1.076
207 HB3 ALA 28 HB3 ALA 28 -12.154 22.379 -1.253
208 H ALA 29 HN ALA 29 -15.361 21.363 0.868
209 HA ALA 29 HA ALA 29 -17.695 21.595 -0.663
210 HB1 ALA 29 HB1 ALA 29 -18.753 20.251 1.001
211 HB2 ALA 29 HB2 ALA 29 -17.616 20.774 2.243
212 HB3 ALA 29 HB3 ALA 29 -17.072 19.723 0.934
213 H TRP 30 HN TRP 30 -16.714 23.229 2.317
214 HA TRP 30 HA TRP 30 -19.199 24.558 2.754
215 HB2 TRP 30 HB2 TRP 30 -16.411 24.841 3.805
216 HB3 TRP 30 HB1 TRP 30 -17.572 26.135 4.102
217 HD1 TRP 30 HD1 TRP 30 -17.219 22.325 4.599
218 HE1 TRP 30 HE1 TRP 30 -18.619 21.647 6.656
219 HE3 TRP 30 HE3 TRP 30 -19.382 26.815 5.713
220 HZ2 TRP 30 HZ2 TRP 30 -20.418 22.850 8.526
221 HZ3 TRP 30 HZ3 TRP 30 -20.934 27.020 7.636
222 HH2 TRP 30 HH2 TRP 30 -21.454 25.045 9.042
223 H TYR 31 HN TYR 31 -16.300 25.310 0.920
224 HA TYR 31 HA TYR 31 -16.743 28.057 0.503
225 HB2 TYR 31 HB2 TYR 31 -14.614 26.958 -0.034
226 HB3 TYR 31 HB1 TYR 31 -15.401 26.045 -1.322
227 HD1 TYR 31 HD1 TYR 31 -14.739 29.538 -0.155
228 HD2 TYR 31 HD2 TYR 31 -15.607 26.961 -3.480
229 HE1 TYR 31 HE1 TYR 31 -14.391 31.434 -1.714
230 HE2 TYR 31 HE2 TYR 31 -15.259 28.857 -5.039
231 HH TYR 31 HH TYR 31 -15.369 31.369 -4.931
232 H ILE 32 HN ILE 32 -18.307 25.268 -0.788
233 HA ILE 32 HA ILE 32 -19.208 26.046 -3.268
234 HB ILE 32 HB ILE 32 -19.696 23.865 -2.116
235 HG12 ILE 32 HG12 ILE 32 -21.995 23.662 -3.111
236 HG13 ILE 32 HG11 ILE 32 -22.000 25.411 -3.345
237 HG21 ILE 32 HG21 ILE 32 -20.559 25.162 -0.028
238 HG22 ILE 32 HG22 ILE 32 -21.408 23.693 -0.509
239 HG23 ILE 32 HG23 ILE 32 -22.077 25.273 -0.918
240 HD11 ILE 32 HD11 ILE 32 -20.495 25.321 -5.069
241 HD12 ILE 32 HD12 ILE 32 -21.132 23.685 -5.236
242 HD13 ILE 32 HD13 ILE 32 -19.619 23.958 -4.371
243 H LYS 33 HN LYS 33 -20.721 26.804 -0.128
244 HA LYS 33 HA LYS 33 -22.810 28.392 -1.189
245 HB2 LYS 33 HB2 LYS 33 -22.499 27.376 1.195
246 HB3 LYS 33 HB1 LYS 33 -21.640 28.879 1.533
247 HG2 LYS 33 HG2 LYS 33 -23.814 29.487 2.091
248 HG3 LYS 33 HG1 LYS 33 -23.755 29.982 0.399
249 HD2 LYS 33 HD2 LYS 33 -25.720 28.747 0.400
250 HD3 LYS 33 HD1 LYS 33 -24.555 27.490 -0.019
251 HE2 LYS 33 HE2 LYS 33 -24.391 26.864 2.375
252 HE3 LYS 33 HE1 LYS 33 -25.598 28.089 2.766
253 HZ1 LYS 33 HZ1 LYS 33 -27.059 26.457 2.429
254 HZ2 LYS 33 HZ2 LYS 33 -25.939 25.477 1.609
255 HZ3 LYS 33 HZ3 LYS 33 -26.775 26.698 0.775
256 H GLY 34 HN GLY 34 -19.694 29.306 0.289
257 HA2 GLY 34 HA2 GLY 34 -18.281 31.054 -0.349
258 HA3 GLY 34 HA1 GLY 34 -19.514 31.609 -1.477
259 H ARG 35 HN ARG 35 -19.788 30.980 2.007
260 HA ARG 35 HA ARG 35 -20.025 33.851 2.538
261 HB2 ARG 35 HB2 ARG 35 -22.161 33.651 3.630
262 HB3 ARG 35 HB1 ARG 35 -22.322 32.975 2.009
263 HG2 ARG 35 HG2 ARG 35 -22.045 30.708 2.894
264 HG3 ARG 35 HG1 ARG 35 -21.802 31.353 4.518
265 HD2 ARG 35 HD2 ARG 35 -24.310 31.784 2.874
266 HD3 ARG 35 HD1 ARG 35 -24.139 30.542 4.112
267 HE ARG 35 HE ARG 35 -23.472 33.105 5.166
268 HH11 ARG 35 HH21 ARG 35 -26.111 31.115 4.141
269 HH12 ARG 35 HH22 ARG 35 -27.264 31.858 5.200
270 HH21 ARG 35 HH11 ARG 35 -24.978 34.085 6.557
271 HH22 ARG 35 HH12 ARG 35 -26.622 33.539 6.567
272 H LEU 36 HN LEU 36 -18.895 30.839 3.344
273 HA LEU 36 HA LEU 36 -18.786 29.994 5.710
274 HB2 LEU 36 HB2 LEU 36 -16.748 29.981 4.249
275 HB3 LEU 36 HB1 LEU 36 -16.331 31.566 4.901
276 HG LEU 36 HG LEU 36 -16.398 30.569 7.205
277 HD11 LEU 36 HD11 LEU 36 -17.680 28.645 7.148
278 HD12 LEU 36 HD12 LEU 36 -16.076 27.930 6.984
279 HD13 LEU 36 HD13 LEU 36 -17.084 28.169 5.558
280 HD21 LEU 36 HD21 LEU 36 -14.268 29.231 6.891
281 HD22 LEU 36 HD22 LEU 36 -14.245 30.828 6.145
282 HD23 LEU 36 HD23 LEU 36 -14.502 29.395 5.150
283 H ALA 37 HN ALA 37 -20.401 31.568 6.673
284 HA ALA 37 HA ALA 37 -20.303 33.960 7.686
285 HB1 ALA 37 HB1 ALA 37 -20.430 31.652 9.636
286 HB2 ALA 37 HB2 ALA 37 -21.758 32.097 8.564
287 HB3 ALA 37 HB3 ALA 37 -21.200 33.231 9.792
288 HA PRO 38 HA PRO 38 -15.853 34.137 8.778
289 HB2 PRO 38 HB2 PRO 38 -16.662 37.005 8.886
290 HB3 PRO 38 HB1 PRO 38 -15.265 36.255 8.093
291 HG2 PRO 38 HG2 PRO 38 -17.344 37.115 6.684
292 HG3 PRO 38 HG1 PRO 38 -16.476 35.635 6.240
293 HD2 PRO 38 HD2 PRO 38 -19.147 35.918 7.563
294 HD3 PRO 38 HD1 PRO 38 -18.585 34.685 6.413
295 H GLY 39 HN GLY 39 -14.814 34.592 10.752
296 HA2 GLY 39 HA2 GLY 39 -15.034 35.874 12.922
297 HA3 GLY 39 HA1 GLY 39 -16.642 35.162 13.009
298 H ALA 40 HN ALA 40 -16.742 32.757 13.009
299 HA ALA 40 HA ALA 40 -14.717 31.702 14.820
300 HB1 ALA 40 HB1 ALA 40 -16.258 29.761 14.989
301 HB2 ALA 40 HB2 ALA 40 -17.307 30.519 13.791
302 HB3 ALA 40 HB3 ALA 40 -17.057 31.289 15.357
303 H ALA 41 HN ALA 41 -16.394 30.161 12.081
304 HA ALA 41 HA ALA 41 -14.522 28.229 11.503
305 HB1 ALA 41 HB1 ALA 41 -16.284 29.762 9.577
306 HB2 ALA 41 HB2 ALA 41 -16.686 28.259 10.409
307 HB3 ALA 41 HB3 ALA 41 -15.423 28.274 9.177
308 H TYR 42 HN TYR 42 -14.139 31.584 11.230
309 HA TYR 42 HA TYR 42 -12.132 31.481 9.123
310 HB2 TYR 42 HB2 TYR 42 -13.767 33.417 9.532
311 HB3 TYR 42 HB1 TYR 42 -12.736 33.840 10.899
312 HD1 TYR 42 HD1 TYR 42 -12.838 33.408 7.216
313 HD2 TYR 42 HD2 TYR 42 -10.558 34.805 10.578
314 HE1 TYR 42 HE1 TYR 42 -11.250 34.527 5.675
315 HE2 TYR 42 HE2 TYR 42 -8.970 35.924 9.036
316 HH TYR 42 HH TYR 42 -9.610 36.186 5.614
317 H ALA 43 HN ALA 43 -12.242 32.253 12.601
318 HA ALA 43 HA ALA 43 -9.438 32.576 12.896
319 HB1 ALA 43 HB1 ALA 43 -11.567 31.883 14.933
320 HB2 ALA 43 HB2 ALA 43 -10.981 33.498 14.535
321 HB3 ALA 43 HB3 ALA 43 -9.909 32.342 15.326
322 H PHE 44 HN PHE 44 -11.599 29.806 13.158
323 HA PHE 44 HA PHE 44 -10.091 27.935 14.459
324 HB2 PHE 44 HB2 PHE 44 -11.994 27.774 12.162
325 HB3 PHE 44 HB1 PHE 44 -11.074 26.333 12.592
326 HD1 PHE 44 HD2 PHE 44 -12.511 29.092 14.684
327 HD2 PHE 44 HD1 PHE 44 -12.479 24.891 13.785
328 HE1 PHE 44 HE2 PHE 44 -14.049 28.672 16.584
329 HE2 PHE 44 HE1 PHE 44 -14.017 24.472 15.685
330 HZ PHE 44 HZ PHE 44 -14.802 26.363 17.085
331 H TYR 45 HN TYR 45 -9.709 29.029 11.115
332 HA TYR 45 HA TYR 45 -7.878 27.217 10.140
333 HB2 TYR 45 HB2 TYR 45 -8.281 30.153 9.692
334 HB3 TYR 45 HB1 TYR 45 -6.899 29.343 8.954
335 HD1 TYR 45 HD1 TYR 45 -7.356 27.192 7.601
336 HD2 TYR 45 HD2 TYR 45 -10.419 29.990 8.717
337 HE1 TYR 45 HE1 TYR 45 -8.833 26.281 5.829
338 HE2 TYR 45 HE2 TYR 45 -11.895 29.079 6.945
339 HH TYR 45 HH TYR 45 -12.192 27.272 5.549
340 H GLY 46 HN GLY 46 -7.521 29.163 12.860
341 HA2 GLY 46 HA2 GLY 46 -4.777 29.821 12.799
342 HA3 GLY 46 HA1 GLY 46 -5.752 29.641 14.254
343 H VAL 47 HN VAL 47 -6.496 26.895 13.755
344 HA VAL 47 HA VAL 47 -3.970 25.423 13.731
345 HB VAL 47 HB VAL 47 -4.592 24.311 15.914
346 HG11 VAL 47 HG11 VAL 47 -2.850 26.113 15.662
347 HG12 VAL 47 HG12 VAL 47 -3.594 26.060 17.259
348 HG13 VAL 47 HG13 VAL 47 -4.085 27.293 16.098
349 HG21 VAL 47 HG21 VAL 47 -6.368 26.748 16.231
350 HG22 VAL 47 HG22 VAL 47 -6.170 25.415 17.368
351 HG23 VAL 47 HG23 VAL 47 -6.984 25.145 15.826
352 H TRP 48 HN TRP 48 -6.567 25.615 12.203
353 HA TRP 48 HA TRP 48 -7.893 23.086 12.680
354 HB2 TRP 48 HB2 TRP 48 -8.587 25.465 11.412
355 HB3 TRP 48 HB1 TRP 48 -8.413 24.310 10.090
356 HD1 TRP 48 HD1 TRP 48 -9.745 23.752 13.678
357 HE1 TRP 48 HE1 TRP 48 -12.091 22.697 13.507
358 HE3 TRP 48 HE3 TRP 48 -10.345 23.752 8.607
359 HZ2 TRP 48 HZ2 TRP 48 -13.973 21.952 11.487
360 HZ3 TRP 48 HZ3 TRP 48 -12.422 22.865 7.587
361 HH2 TRP 48 HH2 TRP 48 -14.235 21.965 9.018
362 HA PRO 49 HA PRO 49 -5.542 22.118 8.546
363 HB2 PRO 49 HB2 PRO 49 -3.204 23.899 8.721
364 HB3 PRO 49 HB1 PRO 49 -4.318 23.634 7.367
365 HG2 PRO 49 HG2 PRO 49 -4.303 25.914 8.761
366 HG3 PRO 49 HG1 PRO 49 -5.791 25.228 8.087
367 HD2 PRO 49 HD2 PRO 49 -4.814 25.153 10.936
368 HD3 PRO 49 HD1 PRO 49 -6.452 25.427 10.303
369 H LEU 50 HN LEU 50 -4.221 22.743 11.650
370 HA LEU 50 HA LEU 50 -1.763 21.370 11.502
371 HB2 LEU 50 HB2 LEU 50 -3.050 22.798 13.433
372 HB3 LEU 50 HB1 LEU 50 -3.238 21.155 14.047
373 HG LEU 50 HG LEU 50 -1.153 22.102 14.899
374 HD11 LEU 50 HD11 LEU 50 -0.330 20.223 12.690
375 HD12 LEU 50 HD12 LEU 50 -1.352 19.661 14.013
376 HD13 LEU 50 HD13 LEU 50 0.258 20.298 14.352
377 HD21 LEU 50 HD21 LEU 50 0.230 23.384 13.641
378 HD22 LEU 50 HD22 LEU 50 -1.070 23.409 12.450
379 HD23 LEU 50 HD23 LEU 50 0.225 22.221 12.314
380 H LEU 51 HN LEU 51 -5.065 20.265 11.981
381 HA LEU 51 HA LEU 51 -4.513 17.658 12.900
382 HB2 LEU 51 HB2 LEU 51 -6.769 18.943 12.753
383 HB3 LEU 51 HB1 LEU 51 -6.852 18.281 11.119
384 HG LEU 51 HG LEU 51 -6.229 16.023 12.368
385 HD11 LEU 51 HD11 LEU 51 -7.025 15.879 14.606
386 HD12 LEU 51 HD12 LEU 51 -7.815 17.453 14.506
387 HD13 LEU 51 HD13 LEU 51 -6.055 17.350 14.561
388 HD21 LEU 51 HD21 LEU 51 -8.730 15.660 12.684
389 HD22 LEU 51 HD22 LEU 51 -8.251 16.240 11.089
390 HD23 LEU 51 HD23 LEU 51 -8.946 17.358 12.262
391 H LEU 52 HN LEU 52 -3.726 19.074 9.982
392 HA LEU 52 HA LEU 52 -4.244 17.020 8.115
393 HB2 LEU 52 HB2 LEU 52 -2.214 19.247 8.218
394 HB3 LEU 52 HB1 LEU 52 -2.276 18.106 6.875
395 HG LEU 52 HG LEU 52 -4.692 19.665 7.819
396 HD11 LEU 52 HD11 LEU 52 -2.785 21.128 6.998
397 HD12 LEU 52 HD12 LEU 52 -4.276 21.255 6.065
398 HD13 LEU 52 HD13 LEU 52 -2.926 20.306 5.443
399 HD21 LEU 52 HD21 LEU 52 -5.525 17.938 6.522
400 HD22 LEU 52 HD22 LEU 52 -4.038 17.782 5.588
401 HD23 LEU 52 HD23 LEU 52 -5.159 19.100 5.248
402 H LEU 53 HN LEU 53 -1.330 17.754 10.032
403 HA LEU 53 HA LEU 53 -0.031 15.314 9.129
404 HB2 LEU 53 HB2 LEU 53 1.486 16.353 11.206
405 HB3 LEU 53 HB1 LEU 53 1.726 16.672 9.487
406 HG LEU 53 HG LEU 53 -0.264 18.272 11.090
407 HD11 LEU 53 HD11 LEU 53 1.737 18.614 12.337
408 HD12 LEU 53 HD12 LEU 53 1.642 19.985 11.232
409 HD13 LEU 53 HD13 LEU 53 2.730 18.643 10.880
410 HD21 LEU 53 HD21 LEU 53 -0.216 19.725 9.275
411 HD22 LEU 53 HD22 LEU 53 0.074 18.188 8.460
412 HD23 LEU 53 HD23 LEU 53 1.424 19.264 8.818
413 H LEU 54 HN LEU 54 -2.146 16.240 11.620
414 HA LEU 54 HA LEU 54 -1.228 14.384 13.623
415 HB2 LEU 54 HB2 LEU 54 -2.715 16.566 13.837
416 HB3 LEU 54 HB1 LEU 54 -4.031 15.418 13.583
417 HG LEU 54 HG LEU 54 -3.618 15.616 15.973
418 HD11 LEU 54 HD11 LEU 54 -4.039 13.334 14.849
419 HD12 LEU 54 HD12 LEU 54 -3.393 13.311 16.490
420 HD13 LEU 54 HD13 LEU 54 -2.323 13.025 15.118
421 HD21 LEU 54 HD21 LEU 54 -0.997 16.062 15.230
422 HD22 LEU 54 HD22 LEU 54 -0.922 14.437 15.912
423 HD23 LEU 54 HD23 LEU 54 -1.542 15.774 16.883
424 H LEU 55 HN LEU 55 -4.161 14.508 11.583
425 HA LEU 55 HA LEU 55 -4.860 11.790 12.209
426 HB2 LEU 55 HB2 LEU 55 -6.321 13.893 11.403
427 HB3 LEU 55 HB1 LEU 55 -6.044 13.130 9.836
428 HG LEU 55 HG LEU 55 -8.088 12.222 10.795
429 HD11 LEU 55 HD11 LEU 55 -6.005 10.098 11.279
430 HD12 LEU 55 HD12 LEU 55 -6.289 10.725 9.655
431 HD13 LEU 55 HD13 LEU 55 -7.596 9.934 10.536
432 HD21 LEU 55 HD21 LEU 55 -8.332 11.700 12.997
433 HD22 LEU 55 HD22 LEU 55 -6.865 12.654 13.220
434 HD23 LEU 55 HD23 LEU 55 -6.763 10.899 13.074
435 H ALA 56 HN ALA 56 -3.339 13.462 9.497
436 HA ALA 56 HA ALA 56 -3.410 11.780 7.419
437 HB1 ALA 56 HB1 ALA 56 -1.958 13.502 6.991
438 HB2 ALA 56 HB2 ALA 56 -0.778 12.230 7.306
439 HB3 ALA 56 HB3 ALA 56 -1.186 13.387 8.573
440 H LEU 57 HN LEU 57 -1.154 11.316 10.147
441 HA LEU 57 HA LEU 57 -0.930 8.475 9.359
442 HB2 LEU 57 HB2 LEU 57 1.131 8.687 10.990
443 HB3 LEU 57 HB1 LEU 57 1.256 9.235 9.317
444 HG LEU 57 HG LEU 57 2.120 10.889 11.023
445 HD11 LEU 57 HD11 LEU 57 0.566 11.285 8.719
446 HD12 LEU 57 HD12 LEU 57 1.630 12.463 9.486
447 HD13 LEU 57 HD13 LEU 57 -0.082 12.418 9.905
448 HD21 LEU 57 HD21 LEU 57 0.197 10.295 12.638
449 HD22 LEU 57 HD22 LEU 57 -0.801 11.355 11.644
450 HD23 LEU 57 HD23 LEU 57 0.609 12.003 12.482
451 HA PRO 58 HA PRO 58 -2.808 7.391 13.206
452 HB2 PRO 58 HB2 PRO 58 -1.808 4.890 13.572
453 HB3 PRO 58 HB1 PRO 58 -2.996 5.269 12.311
454 HG2 PRO 58 HG2 PRO 58 -0.070 4.838 12.086
455 HG3 PRO 58 HG1 PRO 58 -1.368 4.409 10.960
456 HD2 PRO 58 HD2 PRO 58 0.305 6.651 10.676
457 HD3 PRO 58 HD1 PRO 58 -1.281 6.457 9.899
458 HA PRO 59 HA PRO 59 -0.365 8.249 16.772
459 HB2 PRO 59 HB2 PRO 59 -1.208 5.595 17.862
460 HB3 PRO 59 HB1 PRO 59 -1.310 7.204 18.604
461 HG2 PRO 59 HG2 PRO 59 -3.457 5.989 17.591
462 HG3 PRO 59 HG1 PRO 59 -3.239 7.744 17.492
463 HD2 PRO 59 HD2 PRO 59 -3.008 5.703 15.321
464 HD3 PRO 59 HD1 PRO 59 -3.438 7.423 15.225
465 H ARG 60 HN ARG 60 -0.158 4.861 15.693
466 HA ARG 60 HA ARG 60 2.422 4.366 16.787
467 HB2 ARG 60 HB2 ARG 60 1.091 2.982 14.448
468 HB3 ARG 60 HB1 ARG 60 2.396 2.346 15.448
469 HG2 ARG 60 HG2 ARG 60 0.952 2.329 17.408
470 HG3 ARG 60 HG1 ARG 60 -0.347 3.098 16.495
471 HD2 ARG 60 HD2 ARG 60 -0.401 1.141 14.967
472 HD3 ARG 60 HD1 ARG 60 0.843 0.365 15.943
473 HE ARG 60 HE ARG 60 -1.098 0.916 17.764
474 HH11 ARG 60 HH21 ARG 60 -1.061 -0.588 14.648
475 HH12 ARG 60 HH22 ARG 60 -2.387 -1.648 14.991
476 HH21 ARG 60 HH11 ARG 60 -2.837 -0.471 18.221
477 HH22 ARG 60 HH12 ARG 60 -3.392 -1.582 17.014
478 H ALA 61 HN ALA 61 2.513 6.836 15.490
479 HA ALA 61 HA ALA 61 4.340 6.250 13.238
480 HB1 ALA 61 HB1 ALA 61 2.447 8.591 13.557
481 HB2 ALA 61 HB2 ALA 61 2.322 7.293 12.369
482 HB3 ALA 61 HB3 ALA 61 3.657 8.443 12.281
483 H TYR 62 HN TYR 62 6.348 7.032 13.432
484 HA TYR 62 HA TYR 62 7.198 8.290 15.841
485 HB2 TYR 62 HB2 TYR 62 9.398 8.403 14.749
486 HB3 TYR 62 HB1 TYR 62 8.670 6.811 14.538
487 HD1 TYR 62 HD2 TYR 62 7.800 6.092 12.367
488 HD2 TYR 62 HD1 TYR 62 9.589 9.964 12.877
489 HE1 TYR 62 HE2 TYR 62 7.950 6.347 9.905
490 HE2 TYR 62 HE1 TYR 62 9.738 10.219 10.415
491 HH TYR 62 HH TYR 62 8.721 9.350 8.413
492 H ALA 63 HN ALA 63 5.564 9.542 13.254
493 HA ALA 63 HA ALA 63 6.892 11.996 12.774
494 HB1 ALA 63 HB1 ALA 63 3.915 11.498 12.598
495 HB2 ALA 63 HB2 ALA 63 5.063 10.988 11.359
496 HB3 ALA 63 HB3 ALA 63 4.855 12.702 11.718
Start of MODEL 2
1 H1 ALA 1 HT1 ALA 1 -3.484 -0.210 9.549
2 H2 ALA 1 HT2 ALA 1 -3.522 -0.605 11.201
3 H3 ALA 1 HT3 ALA 1 -2.035 -0.357 10.417
4 HA ALA 1 HA ALA 1 -3.414 1.956 9.954
5 HB1 ALA 1 HB1 ALA 1 -5.070 1.333 11.633
6 HB2 ALA 1 HB2 ALA 1 -4.066 2.637 12.267
7 HB3 ALA 1 HB3 ALA 1 -3.797 0.978 12.799
8 H LEU 2 HN LEU 2 -0.962 1.418 9.427
9 HA LEU 2 HA LEU 2 0.850 2.008 11.635
10 HB2 LEU 2 HB2 LEU 2 1.322 1.488 8.690
11 HB3 LEU 2 HB1 LEU 2 2.604 1.814 9.854
12 HG LEU 2 HG LEU 2 1.387 -0.176 11.200
13 HD11 LEU 2 HD11 LEU 2 0.609 -1.908 9.617
14 HD12 LEU 2 HD12 LEU 2 0.779 -0.760 8.288
15 HD13 LEU 2 HD13 LEU 2 -0.412 -0.472 9.555
16 HD21 LEU 2 HD21 LEU 2 3.710 -0.296 10.591
17 HD22 LEU 2 HD22 LEU 2 3.318 -0.460 8.880
18 HD23 LEU 2 HD23 LEU 2 2.948 -1.772 9.998
19 H GLU 3 HN GLU 3 1.637 3.327 8.538
20 HA GLU 3 HA GLU 3 1.964 5.943 9.689
21 HB2 GLU 3 HB2 GLU 3 3.369 4.751 7.821
22 HB3 GLU 3 HB1 GLU 3 2.138 5.393 6.734
23 HG2 GLU 3 HG2 GLU 3 3.840 7.061 6.798
24 HG3 GLU 3 HG1 GLU 3 2.566 7.669 7.850
25 H ASN 4 HN ASN 4 1.217 7.035 6.891
26 HA ASN 4 HA ASN 4 -1.666 7.441 7.482
27 HB2 ASN 4 HB2 ASN 4 0.251 9.262 5.999
28 HB3 ASN 4 HB1 ASN 4 -1.440 9.596 6.368
29 HD21 ASN 4 HD21 ASN 4 1.601 10.333 7.441
30 HD22 ASN 4 HD22 ASN 4 1.268 10.586 9.087
31 H LEU 5 HN LEU 5 0.706 6.767 4.949
32 HA LEU 5 HA LEU 5 -0.798 6.976 2.665
33 HB2 LEU 5 HB2 LEU 5 1.374 5.055 3.470
34 HB3 LEU 5 HB1 LEU 5 0.612 4.921 1.888
35 HG LEU 5 HG LEU 5 2.686 6.330 1.875
36 HD11 LEU 5 HD11 LEU 5 0.367 6.747 0.486
37 HD12 LEU 5 HD12 LEU 5 1.832 7.688 0.240
38 HD13 LEU 5 HD13 LEU 5 0.548 8.316 1.270
39 HD21 LEU 5 HD21 LEU 5 1.043 8.333 3.441
40 HD22 LEU 5 HD22 LEU 5 2.753 8.433 3.023
41 HD23 LEU 5 HD23 LEU 5 2.205 7.254 4.212
42 H VAL 6 HN VAL 6 -0.169 3.636 3.064
43 HA VAL 6 HA VAL 6 -2.566 2.683 2.172
44 HB VAL 6 HB VAL 6 -0.803 1.415 4.280
45 HG11 VAL 6 HG11 VAL 6 -1.802 -0.703 3.226
46 HG12 VAL 6 HG12 VAL 6 -3.029 0.356 2.530
47 HG13 VAL 6 HG13 VAL 6 -2.866 0.226 4.282
48 HG21 VAL 6 HG21 VAL 6 0.254 0.297 2.379
49 HG22 VAL 6 HG22 VAL 6 0.334 2.044 2.145
50 HG23 VAL 6 HG23 VAL 6 -0.858 1.088 1.263
51 H VAL 7 HN VAL 7 -1.814 3.817 5.383
52 HA VAL 7 HA VAL 7 -4.033 2.751 6.751
53 HB VAL 7 HB VAL 7 -2.477 5.295 7.252
54 HG11 VAL 7 HG11 VAL 7 -3.357 4.887 9.628
55 HG12 VAL 7 HG12 VAL 7 -4.525 3.793 8.888
56 HG13 VAL 7 HG13 VAL 7 -4.521 5.503 8.453
57 HG21 VAL 7 HG21 VAL 7 -0.916 3.565 7.487
58 HG22 VAL 7 HG22 VAL 7 -2.124 2.409 8.047
59 HG23 VAL 7 HG23 VAL 7 -1.556 3.685 9.122
60 H LEU 8 HN LEU 8 -3.602 5.801 4.972
61 HA LEU 8 HA LEU 8 -6.117 6.922 5.631
62 HB2 LEU 8 HB2 LEU 8 -4.265 8.226 4.602
63 HB3 LEU 8 HB1 LEU 8 -4.478 7.336 3.102
64 HG LEU 8 HG LEU 8 -6.937 8.168 3.179
65 HD11 LEU 8 HD11 LEU 8 -7.124 8.987 5.402
66 HD12 LEU 8 HD12 LEU 8 -7.064 10.421 4.378
67 HD13 LEU 8 HD13 LEU 8 -5.630 9.912 5.263
68 HD21 LEU 8 HD21 LEU 8 -6.212 10.446 2.298
69 HD22 LEU 8 HD22 LEU 8 -5.472 9.050 1.516
70 HD23 LEU 8 HD23 LEU 8 -4.561 9.980 2.705
71 H ASN 9 HN ASN 9 -5.064 4.853 2.943
72 HA ASN 9 HA ASN 9 -7.653 4.812 1.693
73 HB2 ASN 9 HB2 ASN 9 -5.112 3.233 1.292
74 HB3 ASN 9 HB1 ASN 9 -6.588 2.869 0.399
75 HD21 ASN 9 HD21 ASN 9 -4.074 5.329 0.875
76 HD22 ASN 9 HD22 ASN 9 -4.464 6.236 -0.505
77 H ALA 10 HN ALA 10 -5.917 2.768 3.964
78 HA ALA 10 HA ALA 10 -7.759 0.574 3.847
79 HB1 ALA 10 HB1 ALA 10 -6.573 -0.254 5.811
80 HB2 ALA 10 HB2 ALA 10 -5.812 1.319 6.046
81 HB3 ALA 10 HB3 ALA 10 -5.410 0.348 4.629
82 H ALA 11 HN ALA 11 -7.051 2.462 6.780
83 HA ALA 11 HA ALA 11 -9.330 2.015 8.160
84 HB1 ALA 11 HB1 ALA 11 -8.974 4.195 9.268
85 HB2 ALA 11 HB2 ALA 11 -7.846 4.642 7.988
86 HB3 ALA 11 HB3 ALA 11 -7.467 3.302 9.069
87 H SER 12 HN SER 12 -9.157 3.690 5.202
88 HA SER 12 HA SER 12 -11.263 5.535 5.394
89 HB2 SER 12 HB2 SER 12 -10.818 5.837 3.175
90 HB3 SER 12 HB1 SER 12 -9.571 4.615 3.376
91 HG SER 12 HG SER 12 -12.186 4.376 2.381
92 H VAL 13 HN VAL 13 -11.286 2.062 4.734
93 HA VAL 13 HA VAL 13 -14.221 2.059 4.518
94 HB VAL 13 HB VAL 13 -13.191 0.735 2.834
95 HG11 VAL 13 HG11 VAL 13 -11.614 -1.155 3.520
96 HG12 VAL 13 HG12 VAL 13 -11.517 -0.377 5.096
97 HG13 VAL 13 HG13 VAL 13 -10.963 0.478 3.660
98 HG21 VAL 13 HG21 VAL 13 -13.878 -1.303 4.961
99 HG22 VAL 13 HG22 VAL 13 -14.164 -1.404 3.224
100 HG23 VAL 13 HG23 VAL 13 -15.114 -0.294 4.214
101 H ALA 14 HN ALA 14 -11.622 0.852 6.575
102 HA ALA 14 HA ALA 14 -12.932 -0.871 8.253
103 HB1 ALA 14 HB1 ALA 14 -11.107 1.228 9.406
104 HB2 ALA 14 HB2 ALA 14 -10.482 -0.022 8.330
105 HB3 ALA 14 HB3 ALA 14 -11.257 -0.473 9.848
106 H GLY 15 HN GLY 15 -13.085 2.661 8.279
107 HA2 GLY 15 HA2 GLY 15 -15.161 3.751 8.918
108 HA3 GLY 15 HA1 GLY 15 -15.397 2.498 10.133
109 H ALA 16 HN ALA 16 -12.398 2.699 10.702
110 HA ALA 16 HA ALA 16 -12.539 4.298 12.987
111 HB1 ALA 16 HB1 ALA 16 -10.092 3.550 11.367
112 HB2 ALA 16 HB2 ALA 16 -10.808 2.586 12.656
113 HB3 ALA 16 HB3 ALA 16 -10.080 4.148 13.027
114 H HIS 17 HN HIS 17 -11.079 5.049 9.813
115 HA HIS 17 HA HIS 17 -10.947 7.899 10.567
116 HB2 HIS 17 HB2 HIS 17 -9.606 6.273 8.398
117 HB3 HIS 17 HB1 HIS 17 -9.606 8.034 8.391
118 HD2 HIS 17 HD2 HIS 17 -7.756 9.200 10.123
119 HE1 HIS 17 HE1 HIS 17 -6.554 5.666 12.095
120 HE2 HIS 17 HE2 HIS 17 -6.092 8.150 11.840
121 H GLY 18 HN GLY 18 -13.265 6.056 9.517
122 HA2 GLY 18 HA2 GLY 18 -14.025 7.115 6.974
123 HA3 GLY 18 HA1 GLY 18 -15.086 6.261 8.092
124 H ILE 19 HN ILE 19 -15.039 7.832 10.303
125 HA ILE 19 HA ILE 19 -16.798 9.943 9.605
126 HB ILE 19 HB ILE 19 -17.096 8.857 11.712
127 HG12 ILE 19 HG12 ILE 19 -15.925 11.574 12.353
128 HG13 ILE 19 HG11 ILE 19 -17.451 11.387 11.488
129 HG21 ILE 19 HG21 ILE 19 -14.230 8.897 11.810
130 HG22 ILE 19 HG22 ILE 19 -15.328 8.116 12.939
131 HG23 ILE 19 HG23 ILE 19 -14.805 9.769 13.230
132 HD11 ILE 19 HD11 ILE 19 -17.842 11.662 13.908
133 HD12 ILE 19 HD12 ILE 19 -16.818 10.263 14.237
134 HD13 ILE 19 HD13 ILE 19 -18.345 10.058 13.377
135 H LEU 20 HN LEU 20 -13.375 9.765 10.341
136 HA LEU 20 HA LEU 20 -13.028 12.628 10.479
137 HB2 LEU 20 HB2 LEU 20 -11.230 10.243 10.655
138 HB3 LEU 20 HB1 LEU 20 -10.494 11.784 10.225
139 HG LEU 20 HG LEU 20 -10.435 11.391 12.665
140 HD11 LEU 20 HD11 LEU 20 -12.435 13.590 12.510
141 HD12 LEU 20 HD12 LEU 20 -11.081 13.728 11.398
142 HD13 LEU 20 HD13 LEU 20 -10.783 13.599 13.131
143 HD21 LEU 20 HD21 LEU 20 -12.508 10.038 12.792
144 HD22 LEU 20 HD22 LEU 20 -13.456 11.489 12.465
145 HD23 LEU 20 HD23 LEU 20 -12.520 11.362 13.953
146 H SER 21 HN SER 21 -12.967 10.204 8.015
147 HA SER 21 HA SER 21 -11.374 11.457 6.078
148 HB2 SER 21 HB2 SER 21 -12.155 9.153 5.833
149 HB3 SER 21 HB1 SER 21 -13.817 9.714 5.686
150 HG SER 21 HG SER 21 -13.204 10.812 3.798
151 H PHE 22 HN PHE 22 -14.847 11.803 6.763
152 HA PHE 22 HA PHE 22 -15.452 13.505 4.597
153 HB2 PHE 22 HB2 PHE 22 -16.763 13.379 7.320
154 HB3 PHE 22 HB1 PHE 22 -17.462 14.105 5.874
155 HD1 PHE 22 HD1 PHE 22 -17.293 12.433 3.704
156 HD2 PHE 22 HD2 PHE 22 -17.498 11.229 7.822
157 HE1 PHE 22 HE1 PHE 22 -18.142 10.211 3.013
158 HE2 PHE 22 HE2 PHE 22 -18.348 9.006 7.131
159 HZ PHE 22 HZ PHE 22 -18.672 8.497 4.725
160 H LEU 23 HN LEU 23 -14.047 14.150 7.754
161 HA LEU 23 HA LEU 23 -14.501 16.842 8.071
162 HB2 LEU 23 HB2 LEU 23 -12.987 15.048 9.396
163 HB3 LEU 23 HB1 LEU 23 -11.699 15.889 8.545
164 HG LEU 23 HG LEU 23 -13.787 17.175 10.331
165 HD11 LEU 23 HD11 LEU 23 -12.036 15.926 11.549
166 HD12 LEU 23 HD12 LEU 23 -11.864 17.665 11.788
167 HD13 LEU 23 HD13 LEU 23 -10.792 16.819 10.673
168 HD21 LEU 23 HD21 LEU 23 -13.321 18.831 8.736
169 HD22 LEU 23 HD22 LEU 23 -11.655 18.298 8.514
170 HD23 LEU 23 HD23 LEU 23 -12.115 19.172 9.975
171 H VAL 24 HN VAL 24 -12.133 15.281 5.937
172 HA VAL 24 HA VAL 24 -10.802 17.637 5.120
173 HB VAL 24 HB VAL 24 -10.180 15.121 4.746
174 HG11 VAL 24 HG11 VAL 24 -12.357 14.834 3.357
175 HG12 VAL 24 HG12 VAL 24 -10.881 14.107 2.728
176 HG13 VAL 24 HG13 VAL 24 -11.470 15.630 2.063
177 HG21 VAL 24 HG21 VAL 24 -8.882 15.794 2.661
178 HG22 VAL 24 HG22 VAL 24 -8.680 16.865 4.049
179 HG23 VAL 24 HG23 VAL 24 -9.744 17.331 2.722
180 H PHE 25 HN PHE 25 -13.762 16.090 4.062
181 HA PHE 25 HA PHE 25 -14.120 17.493 1.641
182 HB2 PHE 25 HB2 PHE 25 -15.398 15.461 2.245
183 HB3 PHE 25 HB1 PHE 25 -16.255 16.386 3.475
184 HD1 PHE 25 HD2 PHE 25 -15.601 16.153 -0.181
185 HD2 PHE 25 HD1 PHE 25 -18.068 17.820 2.914
186 HE1 PHE 25 HE2 PHE 25 -17.204 16.957 -1.893
187 HE2 PHE 25 HE1 PHE 25 -19.671 18.626 1.202
188 HZ PHE 25 HZ PHE 25 -19.239 18.194 -1.201
189 H PHE 26 HN PHE 26 -14.989 18.273 4.990
190 HA PHE 26 HA PHE 26 -16.687 20.430 4.512
191 HB2 PHE 26 HB2 PHE 26 -15.072 19.426 6.770
192 HB3 PHE 26 HB1 PHE 26 -15.329 21.165 6.827
193 HD1 PHE 26 HD1 PHE 26 -17.601 22.101 6.924
194 HD2 PHE 26 HD2 PHE 26 -16.923 17.862 7.062
195 HE1 PHE 26 HE1 PHE 26 -19.916 21.757 7.745
196 HE2 PHE 26 HE2 PHE 26 -19.238 17.519 7.883
197 HZ PHE 26 HZ PHE 26 -20.734 19.465 8.226
198 H SER 27 HN SER 27 -13.138 20.365 4.765
199 HA SER 27 HA SER 27 -12.505 23.018 4.751
200 HB2 SER 27 HB2 SER 27 -10.715 21.465 4.748
201 HB3 SER 27 HB1 SER 27 -11.260 20.721 3.248
202 HG SER 27 HG SER 27 -10.836 22.802 2.259
203 H ALA 28 HN ALA 28 -13.425 21.073 1.913
204 HA ALA 28 HA ALA 28 -13.341 23.382 0.154
205 HB1 ALA 28 HB1 ALA 28 -12.710 21.296 -0.824
206 HB2 ALA 28 HB2 ALA 28 -14.272 21.732 -1.517
207 HB3 ALA 28 HB3 ALA 28 -14.180 20.508 -0.250
208 H ALA 29 HN ALA 29 -15.813 21.383 1.730
209 HA ALA 29 HA ALA 29 -18.103 22.265 0.477
210 HB1 ALA 29 HB1 ALA 29 -18.064 21.985 3.466
211 HB2 ALA 29 HB2 ALA 29 -17.768 20.581 2.443
212 HB3 ALA 29 HB3 ALA 29 -19.292 21.457 2.315
213 H TRP 30 HN TRP 30 -16.200 23.933 2.935
214 HA TRP 30 HA TRP 30 -18.002 25.989 3.571
215 HB2 TRP 30 HB2 TRP 30 -14.984 25.895 3.549
216 HB3 TRP 30 HB1 TRP 30 -15.887 27.294 4.127
217 HD1 TRP 30 HD1 TRP 30 -14.402 24.224 5.353
218 HE1 TRP 30 HE1 TRP 30 -15.385 23.533 7.633
219 HE3 TRP 30 HE3 TRP 30 -18.515 27.245 5.487
220 HZ2 TRP 30 HZ2 TRP 30 -17.624 24.178 9.294
221 HZ3 TRP 30 HZ3 TRP 30 -20.054 27.188 7.427
222 HH2 TRP 30 HH2 TRP 30 -19.614 25.660 9.330
223 H TYR 31 HN TYR 31 -15.818 25.606 0.842
224 HA TYR 31 HA TYR 31 -15.955 28.288 -0.098
225 HB2 TYR 31 HB2 TYR 31 -15.302 25.675 -1.467
226 HB3 TYR 31 HB1 TYR 31 -15.236 27.229 -2.292
227 HD1 TYR 31 HD2 TYR 31 -14.036 25.580 0.861
228 HD2 TYR 31 HD1 TYR 31 -13.240 28.451 -2.233
229 HE1 TYR 31 HE2 TYR 31 -11.792 25.993 1.826
230 HE2 TYR 31 HE1 TYR 31 -10.992 28.863 -1.269
231 HH TYR 31 HH TYR 31 -9.996 28.563 1.262
232 H ILE 32 HN ILE 32 -17.802 25.349 -0.904
233 HA ILE 32 HA ILE 32 -19.395 26.434 -2.936
234 HB ILE 32 HB ILE 32 -20.177 24.315 -0.925
235 HG12 ILE 32 HG12 ILE 32 -18.859 23.980 -3.637
236 HG13 ILE 32 HG11 ILE 32 -17.977 23.930 -2.109
237 HG21 ILE 32 HG21 ILE 32 -22.086 25.052 -2.204
238 HG22 ILE 32 HG22 ILE 32 -21.557 23.515 -2.888
239 HG23 ILE 32 HG23 ILE 32 -21.157 25.028 -3.702
240 HD11 ILE 32 HD11 ILE 32 -19.522 22.085 -1.367
241 HD12 ILE 32 HD12 ILE 32 -18.507 21.652 -2.739
242 HD13 ILE 32 HD13 ILE 32 -20.201 22.069 -2.992
243 H LYS 33 HN LYS 33 -19.956 26.296 0.587
244 HA LYS 33 HA LYS 33 -22.528 27.527 0.476
245 HB2 LYS 33 HB2 LYS 33 -21.840 26.157 2.379
246 HB3 LYS 33 HB1 LYS 33 -20.539 27.293 2.742
247 HG2 LYS 33 HG2 LYS 33 -22.099 29.043 3.263
248 HG3 LYS 33 HG1 LYS 33 -23.459 28.092 2.666
249 HD2 LYS 33 HD2 LYS 33 -23.070 26.429 4.451
250 HD3 LYS 33 HD1 LYS 33 -21.719 27.392 5.055
251 HE2 LYS 33 HE2 LYS 33 -23.236 29.271 5.498
252 HE3 LYS 33 HE1 LYS 33 -24.591 28.350 4.846
253 HZ1 LYS 33 HZ1 LYS 33 -24.716 27.065 6.677
254 HZ2 LYS 33 HZ2 LYS 33 -23.968 28.397 7.420
255 HZ3 LYS 33 HZ3 LYS 33 -23.041 27.058 6.938
256 H GLY 34 HN GLY 34 -19.421 28.801 1.657
257 HA2 GLY 34 HA2 GLY 34 -18.598 30.959 1.785
258 HA3 GLY 34 HA1 GLY 34 -19.471 31.230 0.282
259 H ARG 35 HN ARG 35 -21.949 30.383 2.091
260 HA ARG 35 HA ARG 35 -22.850 33.048 2.559
261 HB2 ARG 35 HB2 ARG 35 -24.005 30.360 3.339
262 HB3 ARG 35 HB1 ARG 35 -24.838 31.898 3.549
263 HG2 ARG 35 HG2 ARG 35 -23.782 31.538 0.802
264 HG3 ARG 35 HG1 ARG 35 -24.958 30.306 1.252
265 HD2 ARG 35 HD2 ARG 35 -26.084 32.227 0.223
266 HD3 ARG 35 HD1 ARG 35 -26.554 32.074 1.914
267 HE ARG 35 HE ARG 35 -24.309 33.835 1.556
268 HH11 ARG 35 HH21 ARG 35 -27.751 33.524 1.387
269 HH12 ARG 35 HH22 ARG 35 -28.055 35.206 1.672
270 HH21 ARG 35 HH11 ARG 35 -24.700 36.041 1.931
271 HH22 ARG 35 HH12 ARG 35 -26.328 36.630 1.981
272 H LEU 36 HN LEU 36 -20.469 31.917 4.085
273 HA LEU 36 HA LEU 36 -21.369 32.792 6.764
274 HB2 LEU 36 HB2 LEU 36 -21.090 30.314 6.724
275 HB3 LEU 36 HB1 LEU 36 -19.409 30.536 6.241
276 HG LEU 36 HG LEU 36 -19.004 31.840 8.317
277 HD11 LEU 36 HD11 LEU 36 -20.962 31.371 10.092
278 HD12 LEU 36 HD12 LEU 36 -21.952 31.387 8.633
279 HD13 LEU 36 HD13 LEU 36 -20.979 32.795 9.052
280 HD21 LEU 36 HD21 LEU 36 -18.633 29.364 8.222
281 HD22 LEU 36 HD22 LEU 36 -20.264 29.129 8.851
282 HD23 LEU 36 HD23 LEU 36 -19.046 29.933 9.838
283 H ALA 37 HN ALA 37 -20.273 34.488 7.448
284 HA ALA 37 HA ALA 37 -18.099 35.571 5.987
285 HB1 ALA 37 HB1 ALA 37 -18.043 36.772 8.536
286 HB2 ALA 37 HB2 ALA 37 -19.727 36.320 8.295
287 HB3 ALA 37 HB3 ALA 37 -18.926 37.364 7.127
288 HA PRO 38 HA PRO 38 -14.600 33.572 7.739
289 HB2 PRO 38 HB2 PRO 38 -12.821 35.668 8.097
290 HB3 PRO 38 HB1 PRO 38 -13.202 34.957 6.516
291 HG2 PRO 38 HG2 PRO 38 -14.290 37.438 7.780
292 HG3 PRO 38 HG1 PRO 38 -13.799 37.153 6.099
293 HD2 PRO 38 HD2 PRO 38 -16.407 37.134 6.851
294 HD3 PRO 38 HD1 PRO 38 -15.793 36.079 5.556
295 H GLY 39 HN GLY 39 -13.807 36.497 9.437
296 HA2 GLY 39 HA2 GLY 39 -13.485 36.930 11.683
297 HA3 GLY 39 HA1 GLY 39 -15.108 36.276 11.868
298 H ALA 40 HN ALA 40 -15.305 33.933 12.118
299 HA ALA 40 HA ALA 40 -13.490 32.914 14.073
300 HB1 ALA 40 HB1 ALA 40 -15.929 32.343 13.961
301 HB2 ALA 40 HB2 ALA 40 -14.871 30.935 14.070
302 HB3 ALA 40 HB3 ALA 40 -15.588 31.382 12.523
303 H ALA 41 HN ALA 41 -13.712 32.696 10.628
304 HA ALA 41 HA ALA 41 -12.107 30.333 10.322
305 HB1 ALA 41 HB1 ALA 41 -12.031 30.923 7.965
306 HB2 ALA 41 HB2 ALA 41 -12.623 32.541 8.325
307 HB3 ALA 41 HB3 ALA 41 -13.674 31.146 8.569
308 H TYR 42 HN TYR 42 -11.423 33.487 11.253
309 HA TYR 42 HA TYR 42 -8.922 33.931 10.012
310 HB2 TYR 42 HB2 TYR 42 -10.152 35.732 11.121
311 HB3 TYR 42 HB1 TYR 42 -9.966 34.920 12.676
312 HD1 TYR 42 HD1 TYR 42 -8.080 36.486 9.870
313 HD2 TYR 42 HD2 TYR 42 -7.964 35.131 13.944
314 HE1 TYR 42 HE1 TYR 42 -5.864 37.557 10.162
315 HE2 TYR 42 HE2 TYR 42 -5.747 36.203 14.237
316 HH TYR 42 HH TYR 42 -4.102 37.794 11.513
317 H ALA 43 HN ALA 43 -9.419 33.200 13.462
318 HA ALA 43 HA ALA 43 -6.768 32.068 13.664
319 HB1 ALA 43 HB1 ALA 43 -7.544 33.309 15.550
320 HB2 ALA 43 HB2 ALA 43 -7.493 31.618 16.048
321 HB3 ALA 43 HB3 ALA 43 -9.035 32.371 15.639
322 H PHE 44 HN PHE 44 -9.768 30.617 14.931
323 HA PHE 44 HA PHE 44 -9.317 28.073 15.232
324 HB2 PHE 44 HB2 PHE 44 -11.606 29.015 15.161
325 HB3 PHE 44 HB1 PHE 44 -11.553 28.950 13.403
326 HD1 PHE 44 HD1 PHE 44 -11.156 26.807 16.435
327 HD2 PHE 44 HD2 PHE 44 -12.160 26.976 12.262
328 HE1 PHE 44 HE1 PHE 44 -11.847 24.428 16.507
329 HE2 PHE 44 HE2 PHE 44 -12.853 24.595 12.334
330 HZ PHE 44 HZ PHE 44 -12.696 23.321 14.455
331 H TYR 45 HN TYR 45 -10.687 28.373 12.009
332 HA TYR 45 HA TYR 45 -9.349 26.180 10.954
333 HB2 TYR 45 HB2 TYR 45 -11.136 28.223 9.990
334 HB3 TYR 45 HB1 TYR 45 -9.840 28.050 8.813
335 HD1 TYR 45 HD1 TYR 45 -9.218 25.632 8.103
336 HD2 TYR 45 HD2 TYR 45 -12.925 26.672 10.007
337 HE1 TYR 45 HE1 TYR 45 -10.238 23.534 7.258
338 HE2 TYR 45 HE2 TYR 45 -13.945 24.575 9.163
339 HH TYR 45 HH TYR 45 -12.201 22.017 8.008
340 H GLY 46 HN GLY 46 -8.281 29.490 11.299
341 HA2 GLY 46 HA2 GLY 46 -6.258 29.757 9.482
342 HA3 GLY 46 HA1 GLY 46 -6.149 30.369 11.129
343 H VAL 47 HN VAL 47 -6.492 27.341 11.878
344 HA VAL 47 HA VAL 47 -3.594 26.754 11.807
345 HB VAL 47 HB VAL 47 -3.973 25.364 13.717
346 HG11 VAL 47 HG11 VAL 47 -4.975 27.014 15.298
347 HG12 VAL 47 HG12 VAL 47 -5.514 27.963 13.914
348 HG13 VAL 47 HG13 VAL 47 -3.789 27.733 14.209
349 HG21 VAL 47 HG21 VAL 47 -6.632 25.604 14.499
350 HG22 VAL 47 HG22 VAL 47 -5.944 24.192 13.713
351 HG23 VAL 47 HG23 VAL 47 -6.773 25.406 12.753
352 H TRP 48 HN TRP 48 -4.427 26.222 9.416
353 HA TRP 48 HA TRP 48 -5.711 23.719 9.009
354 HB2 TRP 48 HB2 TRP 48 -4.540 25.814 7.363
355 HB3 TRP 48 HB1 TRP 48 -4.022 24.244 6.767
356 HD1 TRP 48 HD1 TRP 48 -6.082 22.425 6.351
357 HE1 TRP 48 HE1 TRP 48 -8.432 22.859 5.383
358 HE3 TRP 48 HE3 TRP 48 -6.421 27.467 7.086
359 HZ2 TRP 48 HZ2 TRP 48 -10.218 25.055 4.973
360 HZ3 TRP 48 HZ3 TRP 48 -8.455 28.703 6.399
361 HH2 TRP 48 HH2 TRP 48 -10.353 27.506 5.344
362 HA PRO 49 HA PRO 49 -1.223 21.967 8.273
363 HB2 PRO 49 HB2 PRO 49 0.821 23.414 9.500
364 HB3 PRO 49 HB1 PRO 49 0.365 23.576 7.792
365 HG2 PRO 49 HG2 PRO 49 -0.403 25.273 10.123
366 HG3 PRO 49 HG1 PRO 49 0.049 25.759 8.478
367 HD2 PRO 49 HD2 PRO 49 -2.503 25.723 9.264
368 HD3 PRO 49 HD1 PRO 49 -2.061 25.273 7.608
369 H LEU 50 HN LEU 50 -2.435 23.381 11.171
370 HA LEU 50 HA LEU 50 -0.982 21.485 12.898
371 HB2 LEU 50 HB2 LEU 50 -1.622 24.098 13.337
372 HB3 LEU 50 HB1 LEU 50 -3.006 23.318 14.089
373 HG LEU 50 HG LEU 50 -0.105 22.683 14.707
374 HD11 LEU 50 HD11 LEU 50 -2.158 24.033 16.475
375 HD12 LEU 50 HD12 LEU 50 -1.008 24.936 15.489
376 HD13 LEU 50 HD13 LEU 50 -0.426 23.864 16.763
377 HD21 LEU 50 HD21 LEU 50 -2.753 21.614 15.705
378 HD22 LEU 50 HD22 LEU 50 -1.288 21.494 16.679
379 HD23 LEU 50 HD23 LEU 50 -1.365 20.711 15.103
380 H LEU 51 HN LEU 51 -4.311 22.403 12.024
381 HA LEU 51 HA LEU 51 -5.628 20.495 13.602
382 HB2 LEU 51 HB2 LEU 51 -6.699 22.447 12.408
383 HB3 LEU 51 HB1 LEU 51 -6.578 21.523 10.918
384 HG LEU 51 HG LEU 51 -7.874 19.683 12.028
385 HD11 LEU 51 HD11 LEU 51 -7.849 21.690 14.267
386 HD12 LEU 51 HD12 LEU 51 -7.711 19.937 14.339
387 HD13 LEU 51 HD13 LEU 51 -9.277 20.679 14.059
388 HD21 LEU 51 HD21 LEU 51 -10.064 20.965 11.985
389 HD22 LEU 51 HD22 LEU 51 -9.066 21.156 10.545
390 HD23 LEU 51 HD23 LEU 51 -9.116 22.434 11.760
391 H LEU 52 HN LEU 52 -3.897 20.201 10.638
392 HA LEU 52 HA LEU 52 -5.076 17.766 9.736
393 HB2 LEU 52 HB2 LEU 52 -2.835 19.498 8.944
394 HB3 LEU 52 HB1 LEU 52 -2.490 17.795 8.674
395 HG LEU 52 HG LEU 52 -3.583 18.907 6.715
396 HD11 LEU 52 HD11 LEU 52 -4.014 16.380 7.690
397 HD12 LEU 52 HD12 LEU 52 -4.663 16.963 6.162
398 HD13 LEU 52 HD13 LEU 52 -5.671 16.980 7.606
399 HD21 LEU 52 HD21 LEU 52 -5.171 20.174 8.587
400 HD22 LEU 52 HD22 LEU 52 -6.259 18.914 8.017
401 HD23 LEU 52 HD23 LEU 52 -5.560 20.058 6.873
402 H LEU 53 HN LEU 53 -3.556 18.258 12.562
403 HA LEU 53 HA LEU 53 -1.629 16.164 12.659
404 HB2 LEU 53 HB2 LEU 53 -1.576 16.554 15.002
405 HB3 LEU 53 HB1 LEU 53 -1.848 18.123 14.260
406 HG LEU 53 HG LEU 53 -4.407 17.493 14.563
407 HD11 LEU 53 HD11 LEU 53 -3.161 15.272 15.893
408 HD12 LEU 53 HD12 LEU 53 -4.870 15.654 15.778
409 HD13 LEU 53 HD13 LEU 53 -3.927 16.268 17.129
410 HD21 LEU 53 HD21 LEU 53 -2.475 18.532 16.639
411 HD22 LEU 53 HD22 LEU 53 -4.204 18.460 16.968
412 HD23 LEU 53 HD23 LEU 53 -3.603 19.439 15.631
413 H LEU 54 HN LEU 54 -5.092 16.349 13.258
414 HA LEU 54 HA LEU 54 -5.365 13.772 14.443
415 HB2 LEU 54 HB2 LEU 54 -7.778 14.081 13.943
416 HB3 LEU 54 HB1 LEU 54 -7.063 15.449 14.793
417 HG LEU 54 HG LEU 54 -6.647 16.197 12.164
418 HD11 LEU 54 HD11 LEU 54 -9.451 15.141 12.130
419 HD12 LEU 54 HD12 LEU 54 -8.124 14.106 11.618
420 HD13 LEU 54 HD13 LEU 54 -8.433 15.629 10.780
421 HD21 LEU 54 HD21 LEU 54 -8.750 17.608 12.494
422 HD22 LEU 54 HD22 LEU 54 -7.537 17.730 13.767
423 HD23 LEU 54 HD23 LEU 54 -8.976 16.745 14.016
424 H LEU 55 HN LEU 55 -4.416 14.574 11.396
425 HA LEU 55 HA LEU 55 -5.488 12.044 10.278
426 HB2 LEU 55 HB2 LEU 55 -6.119 14.629 9.358
427 HB3 LEU 55 HB1 LEU 55 -4.883 14.075 8.237
428 HG LEU 55 HG LEU 55 -7.344 12.449 8.962
429 HD11 LEU 55 HD11 LEU 55 -6.802 14.246 6.579
430 HD12 LEU 55 HD12 LEU 55 -8.058 14.464 7.800
431 HD13 LEU 55 HD13 LEU 55 -8.137 13.098 6.689
432 HD21 LEU 55 HD21 LEU 55 -5.217 11.314 8.112
433 HD22 LEU 55 HD22 LEU 55 -5.475 12.188 6.603
434 HD23 LEU 55 HD23 LEU 55 -6.680 11.032 7.174
435 H ALA 56 HN ALA 56 -2.983 14.541 9.699
436 HA ALA 56 HA ALA 56 -1.216 12.613 8.478
437 HB1 ALA 56 HB1 ALA 56 0.234 14.444 8.094
438 HB2 ALA 56 HB2 ALA 56 -0.476 15.384 9.407
439 HB3 ALA 56 HB3 ALA 56 -1.392 15.106 7.926
440 H LEU 57 HN LEU 57 -1.818 13.726 11.683
441 HA LEU 57 HA LEU 57 0.674 12.408 12.626
442 HB2 LEU 57 HB2 LEU 57 0.363 14.966 12.973
443 HB3 LEU 57 HB1 LEU 57 -0.794 14.498 14.213
444 HG LEU 57 HG LEU 57 1.172 12.891 15.008
445 HD11 LEU 57 HD11 LEU 57 3.360 13.599 14.498
446 HD12 LEU 57 HD12 LEU 57 2.818 15.165 13.894
447 HD13 LEU 57 HD13 LEU 57 2.539 13.711 12.944
448 HD21 LEU 57 HD21 LEU 57 0.271 14.634 16.431
449 HD22 LEU 57 HD22 LEU 57 1.063 15.889 15.477
450 HD23 LEU 57 HD23 LEU 57 2.029 14.779 16.449
451 HA PRO 58 HA PRO 58 -3.163 10.138 14.176
452 HB2 PRO 58 HB2 PRO 58 -2.187 7.611 13.525
453 HB3 PRO 58 HB1 PRO 58 -3.216 8.592 12.459
454 HG2 PRO 58 HG2 PRO 58 -0.254 8.254 12.450
455 HG3 PRO 58 HG1 PRO 58 -1.381 8.322 11.084
456 HD2 PRO 58 HD2 PRO 58 0.143 10.432 11.773
457 HD3 PRO 58 HD1 PRO 58 -1.498 10.653 11.131
458 HA PRO 59 HA PRO 59 -1.436 9.078 18.095
459 HB2 PRO 59 HB2 PRO 59 -2.621 6.588 18.611
460 HB3 PRO 59 HB1 PRO 59 -3.403 8.159 18.870
461 HG2 PRO 59 HG2 PRO 59 -3.641 6.290 16.551
462 HG3 PRO 59 HG1 PRO 59 -4.899 7.243 17.364
463 HD2 PRO 59 HD2 PRO 59 -3.892 8.038 15.014
464 HD3 PRO 59 HD1 PRO 59 -4.285 9.225 16.277
465 H ARG 60 HN ARG 60 -1.662 5.969 16.308
466 HA ARG 60 HA ARG 60 0.605 4.785 17.420
467 HB2 ARG 60 HB2 ARG 60 -1.290 3.832 15.835
468 HB3 ARG 60 HB1 ARG 60 -0.133 4.198 14.562
469 HG2 ARG 60 HG2 ARG 60 0.380 2.444 16.986
470 HG3 ARG 60 HG1 ARG 60 0.161 1.884 15.328
471 HD2 ARG 60 HD2 ARG 60 2.147 3.418 14.739
472 HD3 ARG 60 HD1 ARG 60 2.442 3.496 16.474
473 HE ARG 60 HE ARG 60 2.815 1.166 14.749
474 HH11 ARG 60 HH21 ARG 60 2.587 2.487 17.941
475 HH12 ARG 60 HH22 ARG 60 3.425 1.171 18.692
476 HH21 ARG 60 HH11 ARG 60 3.914 -0.560 15.728
477 HH22 ARG 60 HH12 ARG 60 4.176 -0.553 17.440
478 H ALA 61 HN ALA 61 0.524 5.783 14.010
479 HA ALA 61 HA ALA 61 3.373 6.154 13.966
480 HB1 ALA 61 HB1 ALA 61 1.164 6.505 11.960
481 HB2 ALA 61 HB2 ALA 61 2.514 5.383 11.924
482 HB3 ALA 61 HB3 ALA 61 2.785 7.096 11.607
483 H TYR 62 HN TYR 62 4.006 8.321 12.630
484 HA TYR 62 HA TYR 62 2.656 10.700 13.520
485 HB2 TYR 62 HB2 TYR 62 4.451 11.556 14.939
486 HB3 TYR 62 HB1 TYR 62 3.839 10.037 15.595
487 HD1 TYR 62 HD1 TYR 62 5.119 7.924 15.278
488 HD2 TYR 62 HD2 TYR 62 6.690 11.738 14.078
489 HE1 TYR 62 HE1 TYR 62 7.392 6.943 15.137
490 HE2 TYR 62 HE2 TYR 62 8.964 10.757 13.936
491 HH TYR 62 HH TYR 62 10.172 8.760 15.006
492 H ALA 63 HN ALA 63 2.918 12.109 11.916
493 HA ALA 63 HA ALA 63 4.962 11.707 9.913
494 HB1 ALA 63 HB1 ALA 63 3.908 13.664 8.816
495 HB2 ALA 63 HB2 ALA 63 2.867 13.872 10.225
496 HB3 ALA 63 HB3 ALA 63 2.728 12.419 9.234
Start of MODEL 3
1 H1 ALA 1 HT1 ALA 1 3.715 -0.808 14.241
2 H2 ALA 1 HT2 ALA 1 4.660 0.314 13.385
3 H3 ALA 1 HT3 ALA 1 5.390 -0.746 14.493
4 HA ALA 1 HA ALA 1 5.894 -1.774 12.525
5 HB1 ALA 1 HB1 ALA 1 4.153 -3.631 12.258
6 HB2 ALA 1 HB2 ALA 1 3.238 -2.816 13.527
7 HB3 ALA 1 HB3 ALA 1 4.851 -3.445 13.867
8 H LEU 2 HN LEU 2 2.352 -1.417 12.210
9 HA LEU 2 HA LEU 2 2.655 -0.904 9.349
10 HB2 LEU 2 HB2 LEU 2 0.301 -1.387 11.171
11 HB3 LEU 2 HB1 LEU 2 0.077 -0.835 9.512
12 HG LEU 2 HG LEU 2 -0.038 -3.331 9.766
13 HD11 LEU 2 HD11 LEU 2 0.918 -3.694 7.711
14 HD12 LEU 2 HD12 LEU 2 2.428 -2.890 8.133
15 HD13 LEU 2 HD13 LEU 2 1.012 -1.937 7.700
16 HD21 LEU 2 HD21 LEU 2 1.851 -4.602 10.417
17 HD22 LEU 2 HD22 LEU 2 1.794 -3.285 11.586
18 HD23 LEU 2 HD23 LEU 2 2.942 -3.228 10.248
19 H GLU 3 HN GLU 3 3.436 1.120 9.058
20 HA GLU 3 HA GLU 3 1.799 3.377 10.074
21 HB2 GLU 3 HB2 GLU 3 3.826 4.722 10.184
22 HB3 GLU 3 HB1 GLU 3 4.020 3.276 11.172
23 HG2 GLU 3 HG2 GLU 3 5.203 2.180 9.258
24 HG3 GLU 3 HG1 GLU 3 5.105 3.700 8.371
25 H ASN 4 HN ASN 4 2.102 5.365 8.689
26 HA ASN 4 HA ASN 4 2.202 6.462 6.661
27 HB2 ASN 4 HB2 ASN 4 4.105 4.790 6.157
28 HB3 ASN 4 HB1 ASN 4 2.898 3.885 5.256
29 HD21 ASN 4 HD21 ASN 4 3.670 4.315 3.145
30 HD22 ASN 4 HD22 ASN 4 3.723 5.875 2.479
31 H LEU 5 HN LEU 5 1.463 4.245 4.367
32 HA LEU 5 HA LEU 5 -1.129 5.126 3.913
33 HB2 LEU 5 HB2 LEU 5 0.548 3.784 2.413
34 HB3 LEU 5 HB1 LEU 5 -0.262 2.370 3.078
35 HG LEU 5 HG LEU 5 -2.463 3.752 2.407
36 HD11 LEU 5 HD11 LEU 5 -1.234 5.733 1.625
37 HD12 LEU 5 HD12 LEU 5 -2.099 4.973 0.289
38 HD13 LEU 5 HD13 LEU 5 -0.359 4.738 0.458
39 HD21 LEU 5 HD21 LEU 5 -2.403 2.585 0.182
40 HD22 LEU 5 HD22 LEU 5 -1.975 1.538 1.536
41 HD23 LEU 5 HD23 LEU 5 -0.712 2.183 0.487
42 H VAL 6 HN VAL 6 -0.373 3.564 6.632
43 HA VAL 6 HA VAL 6 -2.267 1.449 6.770
44 HB VAL 6 HB VAL 6 -0.260 1.840 8.296
45 HG11 VAL 6 HG11 VAL 6 -0.510 3.286 10.183
46 HG12 VAL 6 HG12 VAL 6 -2.205 3.586 9.823
47 HG13 VAL 6 HG13 VAL 6 -0.949 4.252 8.776
48 HG21 VAL 6 HG21 VAL 6 -1.992 0.125 8.724
49 HG22 VAL 6 HG22 VAL 6 -2.959 1.324 9.584
50 HG23 VAL 6 HG23 VAL 6 -1.395 0.826 10.227
51 H VAL 7 HN VAL 7 -2.361 4.830 7.841
52 HA VAL 7 HA VAL 7 -4.940 4.748 8.983
53 HB VAL 7 HB VAL 7 -3.269 6.519 9.426
54 HG11 VAL 7 HG11 VAL 7 -2.622 6.674 6.948
55 HG12 VAL 7 HG12 VAL 7 -2.773 8.201 7.817
56 HG13 VAL 7 HG13 VAL 7 -4.066 7.666 6.745
57 HG21 VAL 7 HG21 VAL 7 -5.768 6.811 9.779
58 HG22 VAL 7 HG22 VAL 7 -5.810 7.665 8.236
59 HG23 VAL 7 HG23 VAL 7 -4.866 8.313 9.577
60 H LEU 8 HN LEU 8 -3.859 5.594 5.706
61 HA LEU 8 HA LEU 8 -6.118 6.687 4.635
62 HB2 LEU 8 HB2 LEU 8 -3.962 6.260 3.422
63 HB3 LEU 8 HB1 LEU 8 -4.461 4.579 3.243
64 HG LEU 8 HG LEU 8 -6.545 5.375 2.084
65 HD11 LEU 8 HD11 LEU 8 -5.229 8.030 2.602
66 HD12 LEU 8 HD12 LEU 8 -6.935 7.591 2.677
67 HD13 LEU 8 HD13 LEU 8 -6.154 7.821 1.116
68 HD21 LEU 8 HD21 LEU 8 -3.935 6.284 0.828
69 HD22 LEU 8 HD22 LEU 8 -5.412 5.854 -0.034
70 HD23 LEU 8 HD23 LEU 8 -4.519 4.620 0.853
71 H ASN 9 HN ASN 9 -5.447 3.206 4.161
72 HA ASN 9 HA ASN 9 -8.134 2.597 3.499
73 HB2 ASN 9 HB2 ASN 9 -6.056 1.280 2.880
74 HB3 ASN 9 HB1 ASN 9 -6.083 0.638 4.522
75 HD21 ASN 9 HD21 ASN 9 -7.009 -1.414 4.478
76 HD22 ASN 9 HD22 ASN 9 -8.368 -1.847 3.559
77 H ALA 10 HN ALA 10 -6.263 2.069 6.486
78 HA ALA 10 HA ALA 10 -8.176 0.704 7.963
79 HB1 ALA 10 HB1 ALA 10 -7.019 1.509 9.951
80 HB2 ALA 10 HB2 ALA 10 -6.245 2.785 9.011
81 HB3 ALA 10 HB3 ALA 10 -5.843 1.094 8.702
82 H ALA 11 HN ALA 11 -7.704 4.224 7.704
83 HA ALA 11 HA ALA 11 -9.760 4.991 9.441
84 HB1 ALA 11 HB1 ALA 11 -9.672 7.161 8.307
85 HB2 ALA 11 HB2 ALA 11 -8.765 6.440 6.978
86 HB3 ALA 11 HB3 ALA 11 -8.043 6.545 8.585
87 H SER 12 HN SER 12 -9.813 4.355 5.947
88 HA SER 12 HA SER 12 -12.505 5.106 5.516
89 HB2 SER 12 HB2 SER 12 -10.811 3.088 4.026
90 HB3 SER 12 HB1 SER 12 -12.327 3.774 3.448
91 HG SER 12 HG SER 12 -10.636 5.707 4.280
92 H VAL 13 HN VAL 13 -11.000 1.990 6.286
93 HA VAL 13 HA VAL 13 -13.417 0.486 6.224
94 HB VAL 13 HB VAL 13 -10.772 -0.079 7.583
95 HG11 VAL 13 HG11 VAL 13 -11.636 -2.468 7.455
96 HG12 VAL 13 HG12 VAL 13 -13.222 -1.788 7.091
97 HG13 VAL 13 HG13 VAL 13 -12.447 -1.440 8.637
98 HG21 VAL 13 HG21 VAL 13 -10.334 -1.451 5.616
99 HG22 VAL 13 HG22 VAL 13 -10.739 0.182 5.088
100 HG23 VAL 13 HG23 VAL 13 -11.941 -1.104 4.977
101 H ALA 14 HN ALA 14 -11.563 2.032 8.803
102 HA ALA 14 HA ALA 14 -12.792 1.142 11.072
103 HB1 ALA 14 HB1 ALA 14 -12.477 3.547 11.941
104 HB2 ALA 14 HB2 ALA 14 -11.832 3.902 10.337
105 HB3 ALA 14 HB3 ALA 14 -11.043 2.699 11.357
106 H GLY 15 HN GLY 15 -13.921 3.980 9.198
107 HA2 GLY 15 HA2 GLY 15 -16.385 3.901 8.640
108 HA3 GLY 15 HA1 GLY 15 -16.631 3.571 10.351
109 H ALA 16 HN ALA 16 -16.302 5.228 11.874
110 HA ALA 16 HA ALA 16 -17.070 7.806 11.072
111 HB1 ALA 16 HB1 ALA 16 -15.583 7.154 13.619
112 HB2 ALA 16 HB2 ALA 16 -17.289 6.780 13.381
113 HB3 ALA 16 HB3 ALA 16 -16.742 8.456 13.345
114 H HIS 17 HN HIS 17 -13.868 6.466 11.803
115 HA HIS 17 HA HIS 17 -12.367 8.812 11.747
116 HB2 HIS 17 HB2 HIS 17 -11.604 6.429 12.302
117 HB3 HIS 17 HB1 HIS 17 -11.409 6.209 10.565
118 HD2 HIS 17 HD2 HIS 17 -8.526 6.136 11.080
119 HE1 HIS 17 HE1 HIS 17 -8.262 10.281 11.821
120 HE2 HIS 17 HE2 HIS 17 -6.921 8.176 11.361
121 H GLY 18 HN GLY 18 -14.308 7.681 9.325
122 HA2 GLY 18 HA2 GLY 18 -12.695 8.307 7.019
123 HA3 GLY 18 HA1 GLY 18 -14.432 8.008 7.025
124 H ILE 19 HN ILE 19 -15.441 9.898 8.636
125 HA ILE 19 HA ILE 19 -15.747 12.156 7.123
126 HB ILE 19 HB ILE 19 -17.033 11.505 9.228
127 HG12 ILE 19 HG12 ILE 19 -16.138 14.401 9.065
128 HG13 ILE 19 HG11 ILE 19 -17.298 13.671 7.955
129 HG21 ILE 19 HG21 ILE 19 -16.235 12.151 11.354
130 HG22 ILE 19 HG22 ILE 19 -15.008 13.221 10.672
131 HG23 ILE 19 HG23 ILE 19 -14.802 11.476 10.580
132 HD11 ILE 19 HD11 ILE 19 -18.547 14.772 9.705
133 HD12 ILE 19 HD12 ILE 19 -17.592 13.973 10.954
134 HD13 ILE 19 HD13 ILE 19 -18.696 13.032 9.950
135 H LEU 20 HN LEU 20 -12.981 11.252 8.894
136 HA LEU 20 HA LEU 20 -11.914 13.819 9.480
137 HB2 LEU 20 HB2 LEU 20 -11.175 11.328 10.190
138 HB3 LEU 20 HB1 LEU 20 -10.056 11.552 8.852
139 HG LEU 20 HG LEU 20 -8.960 12.295 10.877
140 HD11 LEU 20 HD11 LEU 20 -9.830 14.851 9.534
141 HD12 LEU 20 HD12 LEU 20 -8.824 13.672 8.690
142 HD13 LEU 20 HD13 LEU 20 -8.245 14.425 10.176
143 HD21 LEU 20 HD21 LEU 20 -10.814 14.546 11.463
144 HD22 LEU 20 HD22 LEU 20 -9.963 13.467 12.563
145 HD23 LEU 20 HD23 LEU 20 -11.468 12.946 11.817
146 H SER 21 HN SER 21 -11.604 11.632 6.713
147 HA SER 21 HA SER 21 -9.771 13.279 5.265
148 HB2 SER 21 HB2 SER 21 -10.332 11.818 3.352
149 HB3 SER 21 HB1 SER 21 -9.957 10.889 4.799
150 HG SER 21 HG SER 21 -12.088 10.675 3.367
151 H PHE 22 HN PHE 22 -13.283 12.862 5.232
152 HA PHE 22 HA PHE 22 -13.804 14.582 3.047
153 HB2 PHE 22 HB2 PHE 22 -15.527 13.684 5.358
154 HB3 PHE 22 HB1 PHE 22 -16.127 14.667 4.021
155 HD1 PHE 22 HD1 PHE 22 -16.130 13.780 1.703
156 HD2 PHE 22 HD2 PHE 22 -15.018 11.340 5.059
157 HE1 PHE 22 HE1 PHE 22 -16.407 11.744 0.315
158 HE2 PHE 22 HE2 PHE 22 -15.296 9.305 3.673
159 HZ PHE 22 HZ PHE 22 -15.988 9.506 1.300
160 H LEU 23 HN LEU 23 -12.834 15.189 6.234
161 HA LEU 23 HA LEU 23 -14.045 17.580 6.920
162 HB2 LEU 23 HB2 LEU 23 -12.280 16.198 8.215
163 HB3 LEU 23 HB1 LEU 23 -11.089 17.144 7.325
164 HG LEU 23 HG LEU 23 -12.557 19.201 8.159
165 HD11 LEU 23 HD11 LEU 23 -14.321 17.825 9.201
166 HD12 LEU 23 HD12 LEU 23 -13.488 18.796 10.411
167 HD13 LEU 23 HD13 LEU 23 -13.118 17.080 10.255
168 HD21 LEU 23 HD21 LEU 23 -10.683 17.661 9.984
169 HD22 LEU 23 HD22 LEU 23 -11.109 19.362 10.162
170 HD23 LEU 23 HD23 LEU 23 -10.197 18.826 8.751
171 H VAL 24 HN VAL 24 -11.431 17.004 4.616
172 HA VAL 24 HA VAL 24 -10.852 19.782 4.179
173 HB VAL 24 HB VAL 24 -9.383 19.046 2.462
174 HG11 VAL 24 HG11 VAL 24 -8.713 18.389 4.747
175 HG12 VAL 24 HG12 VAL 24 -8.147 17.218 3.554
176 HG13 VAL 24 HG13 VAL 24 -9.556 16.853 4.549
177 HG21 VAL 24 HG21 VAL 24 -9.528 16.566 1.726
178 HG22 VAL 24 HG22 VAL 24 -10.741 17.673 1.082
179 HG23 VAL 24 HG23 VAL 24 -11.149 16.598 2.415
180 H PHE 25 HN PHE 25 -12.867 17.351 2.602
181 HA PHE 25 HA PHE 25 -13.600 18.894 0.344
182 HB2 PHE 25 HB2 PHE 25 -14.749 16.481 1.716
183 HB3 PHE 25 HB1 PHE 25 -15.695 17.285 0.465
184 HD1 PHE 25 HD1 PHE 25 -14.929 17.362 -1.851
185 HD2 PHE 25 HD2 PHE 25 -12.650 15.330 1.167
186 HE1 PHE 25 HE1 PHE 25 -13.601 16.233 -3.615
187 HE2 PHE 25 HE2 PHE 25 -11.321 14.201 -0.592
188 HZ PHE 25 HZ PHE 25 -11.797 14.652 -2.984
189 H PHE 26 HN PHE 26 -15.163 18.475 3.527
190 HA PHE 26 HA PHE 26 -17.383 20.148 2.932
191 HB2 PHE 26 HB2 PHE 26 -16.153 19.126 5.487
192 HB3 PHE 26 HB1 PHE 26 -17.491 20.275 5.523
193 HD1 PHE 26 HD1 PHE 26 -19.553 19.690 4.030
194 HD2 PHE 26 HD2 PHE 26 -16.626 16.819 5.312
195 HE1 PHE 26 HE1 PHE 26 -21.175 17.856 3.630
196 HE2 PHE 26 HE2 PHE 26 -18.248 14.987 4.913
197 HZ PHE 26 HZ PHE 26 -20.522 15.505 4.071
198 H SER 27 HN SER 27 -14.242 20.734 4.483
199 HA SER 27 HA SER 27 -14.630 23.347 5.335
200 HB2 SER 27 HB2 SER 27 -12.108 22.167 4.150
201 HB3 SER 27 HB1 SER 27 -12.199 23.601 5.170
202 HG SER 27 HG SER 27 -12.635 22.374 6.880
203 H ALA 28 HN ALA 28 -13.629 22.160 2.134
204 HA ALA 28 HA ALA 28 -13.400 24.794 1.019
205 HB1 ALA 28 HB1 ALA 28 -12.146 22.844 0.134
206 HB2 ALA 28 HB2 ALA 28 -13.109 23.645 -1.108
207 HB3 ALA 28 HB3 ALA 28 -13.670 22.132 -0.396
208 H ALA 29 HN ALA 29 -15.862 22.247 1.021
209 HA ALA 29 HA ALA 29 -17.636 23.417 -0.819
210 HB1 ALA 29 HB1 ALA 29 -17.749 21.069 0.088
211 HB2 ALA 29 HB2 ALA 29 -19.294 21.918 0.059
212 HB3 ALA 29 HB3 ALA 29 -18.412 21.744 1.576
213 H TRP 30 HN TRP 30 -17.616 23.589 2.744
214 HA TRP 30 HA TRP 30 -19.818 25.245 3.100
215 HB2 TRP 30 HB2 TRP 30 -17.261 24.931 4.670
216 HB3 TRP 30 HB1 TRP 30 -18.505 26.074 5.178
217 HD1 TRP 30 HD1 TRP 30 -17.513 22.623 5.701
218 HE1 TRP 30 HE1 TRP 30 -19.463 21.200 6.603
219 HE3 TRP 30 HE3 TRP 30 -21.416 25.776 4.754
220 HZ2 TRP 30 HZ2 TRP 30 -22.304 21.376 6.890
221 HZ3 TRP 30 HZ3 TRP 30 -23.731 25.125 5.353
222 HH2 TRP 30 HH2 TRP 30 -24.180 22.932 6.419
223 H TYR 31 HN TYR 31 -16.648 26.023 1.912
224 HA TYR 31 HA TYR 31 -16.852 28.853 2.303
225 HB2 TYR 31 HB2 TYR 31 -14.888 26.970 1.285
226 HB3 TYR 31 HB1 TYR 31 -15.014 28.335 0.183
227 HD1 TYR 31 HD1 TYR 31 -15.246 30.704 1.482
228 HD2 TYR 31 HD2 TYR 31 -13.336 27.182 3.030
229 HE1 TYR 31 HE1 TYR 31 -13.925 32.106 3.043
230 HE2 TYR 31 HE2 TYR 31 -12.016 28.584 4.591
231 HH TYR 31 HH TYR 31 -12.741 31.524 5.478
232 H ILE 32 HN ILE 32 -18.222 26.681 0.044
233 HA ILE 32 HA ILE 32 -18.336 28.155 -2.304
234 HB ILE 32 HB ILE 32 -19.204 25.799 -1.916
235 HG12 ILE 32 HG12 ILE 32 -21.155 27.645 -3.321
236 HG13 ILE 32 HG11 ILE 32 -19.591 27.192 -4.001
237 HG21 ILE 32 HG21 ILE 32 -21.385 25.452 -1.069
238 HG22 ILE 32 HG22 ILE 32 -21.798 27.162 -1.184
239 HG23 ILE 32 HG23 ILE 32 -20.676 26.606 0.053
240 HD11 ILE 32 HD11 ILE 32 -21.731 25.219 -3.154
241 HD12 ILE 32 HD12 ILE 32 -20.204 24.832 -3.948
242 HD13 ILE 32 HD13 ILE 32 -21.446 25.735 -4.816
243 H LYS 33 HN LYS 33 -20.620 28.254 0.421
244 HA LYS 33 HA LYS 33 -22.287 30.257 -0.646
245 HB2 LYS 33 HB2 LYS 33 -22.796 30.638 1.911
246 HB3 LYS 33 HB1 LYS 33 -23.269 29.130 1.136
247 HG2 LYS 33 HG2 LYS 33 -21.284 28.009 1.984
248 HG3 LYS 33 HG1 LYS 33 -20.663 29.522 2.633
249 HD2 LYS 33 HD2 LYS 33 -21.635 28.416 4.498
250 HD3 LYS 33 HD1 LYS 33 -22.815 29.635 4.025
251 HE2 LYS 33 HE2 LYS 33 -23.769 27.330 4.508
252 HE3 LYS 33 HE1 LYS 33 -24.199 28.001 2.939
253 HZ1 LYS 33 HZ1 LYS 33 -22.967 26.480 1.851
254 HZ2 LYS 33 HZ2 LYS 33 -23.212 25.566 3.262
255 HZ3 LYS 33 HZ3 LYS 33 -21.761 26.421 3.042
256 H GLY 34 HN GLY 34 -19.512 30.480 1.596
257 HA2 GLY 34 HA2 GLY 34 -17.916 32.246 1.498
258 HA3 GLY 34 HA1 GLY 34 -19.123 33.280 0.740
259 H ARG 35 HN ARG 35 -20.396 31.463 3.297
260 HA ARG 35 HA ARG 35 -20.739 33.830 4.920
261 HB2 ARG 35 HB2 ARG 35 -22.550 32.180 4.698
262 HB3 ARG 35 HB1 ARG 35 -21.536 30.955 5.454
263 HG2 ARG 35 HG2 ARG 35 -21.884 33.538 6.946
264 HG3 ARG 35 HG1 ARG 35 -23.283 32.476 6.866
265 HD2 ARG 35 HD2 ARG 35 -20.749 31.100 7.590
266 HD3 ARG 35 HD1 ARG 35 -21.326 32.267 8.766
267 HE ARG 35 HE ARG 35 -23.275 30.976 9.082
268 HH11 ARG 35 HH21 ARG 35 -21.161 29.648 6.686
269 HH12 ARG 35 HH22 ARG 35 -21.909 28.088 6.701
270 HH21 ARG 35 HH11 ARG 35 -24.253 28.941 9.110
271 HH22 ARG 35 HH12 ARG 35 -23.661 27.687 8.071
272 H LEU 36 HN LEU 36 -18.431 31.349 4.657
273 HA LEU 36 HA LEU 36 -17.636 31.228 7.408
274 HB2 LEU 36 HB2 LEU 36 -17.169 29.536 5.451
275 HB3 LEU 36 HB1 LEU 36 -15.782 30.572 5.126
276 HG LEU 36 HG LEU 36 -15.402 30.317 7.764
277 HD11 LEU 36 HD11 LEU 36 -17.525 28.970 7.996
278 HD12 LEU 36 HD12 LEU 36 -16.084 28.168 8.622
279 HD13 LEU 36 HD13 LEU 36 -16.748 27.696 7.056
280 HD21 LEU 36 HD21 LEU 36 -14.042 28.203 7.231
281 HD22 LEU 36 HD22 LEU 36 -13.695 29.627 6.249
282 HD23 LEU 36 HD23 LEU 36 -14.690 28.326 5.595
283 H ALA 37 HN ALA 37 -17.730 33.838 5.677
284 HA ALA 37 HA ALA 37 -15.258 34.951 5.318
285 HB1 ALA 37 HB1 ALA 37 -16.440 36.884 5.005
286 HB2 ALA 37 HB2 ALA 37 -17.149 36.817 6.618
287 HB3 ALA 37 HB3 ALA 37 -17.861 35.885 5.304
288 HA PRO 38 HA PRO 38 -13.246 35.782 9.147
289 HB2 PRO 38 HB2 PRO 38 -13.738 38.728 9.077
290 HB3 PRO 38 HB1 PRO 38 -12.198 37.845 9.114
291 HG2 PRO 38 HG2 PRO 38 -13.039 39.042 6.890
292 HG3 PRO 38 HG1 PRO 38 -12.206 37.477 6.829
293 HD2 PRO 38 HD2 PRO 38 -15.148 38.050 6.569
294 HD3 PRO 38 HD1 PRO 38 -14.139 36.898 5.665
295 H GLY 39 HN GLY 39 -13.636 35.965 11.384
296 HA2 GLY 39 HA2 GLY 39 -15.302 37.372 12.893
297 HA3 GLY 39 HA1 GLY 39 -16.450 36.276 12.129
298 H ALA 40 HN ALA 40 -16.989 34.740 13.542
299 HA ALA 40 HA ALA 40 -14.990 33.706 15.442
300 HB1 ALA 40 HB1 ALA 40 -17.933 33.037 15.328
301 HB2 ALA 40 HB2 ALA 40 -17.306 34.453 16.174
302 HB3 ALA 40 HB3 ALA 40 -16.823 32.834 16.683
303 H ALA 41 HN ALA 41 -16.297 32.941 12.427
304 HA ALA 41 HA ALA 41 -16.242 30.056 12.733
305 HB1 ALA 41 HB1 ALA 41 -16.704 30.049 10.297
306 HB2 ALA 41 HB2 ALA 41 -16.538 31.805 10.281
307 HB3 ALA 41 HB3 ALA 41 -17.845 31.051 11.194
308 H TYR 42 HN TYR 42 -14.585 32.089 10.320
309 HA TYR 42 HA TYR 42 -12.602 30.327 9.616
310 HB2 TYR 42 HB2 TYR 42 -11.654 32.096 8.471
311 HB3 TYR 42 HB1 TYR 42 -13.199 32.848 8.863
312 HD1 TYR 42 HD1 TYR 42 -13.314 34.105 11.175
313 HD2 TYR 42 HD2 TYR 42 -9.663 33.157 9.121
314 HE1 TYR 42 HE1 TYR 42 -12.124 35.843 12.485
315 HE2 TYR 42 HE2 TYR 42 -8.474 34.894 10.433
316 HH TYR 42 HH TYR 42 -9.682 36.249 13.206
317 H ALA 43 HN ALA 43 -12.963 31.990 12.597
318 HA ALA 43 HA ALA 43 -10.321 32.158 13.506
319 HB1 ALA 43 HB1 ALA 43 -11.310 32.075 15.782
320 HB2 ALA 43 HB2 ALA 43 -12.855 31.609 15.069
321 HB3 ALA 43 HB3 ALA 43 -12.162 33.192 14.716
322 H PHE 44 HN PHE 44 -12.393 29.845 15.156
323 HA PHE 44 HA PHE 44 -10.280 28.020 15.598
324 HB2 PHE 44 HB2 PHE 44 -12.193 28.149 17.099
325 HB3 PHE 44 HB1 PHE 44 -13.274 27.628 15.807
326 HD1 PHE 44 HD2 PHE 44 -10.295 26.579 17.802
327 HD2 PHE 44 HD1 PHE 44 -13.587 25.327 15.342
328 HE1 PHE 44 HE2 PHE 44 -9.804 24.210 18.349
329 HE2 PHE 44 HE1 PHE 44 -13.097 22.959 15.889
330 HZ PHE 44 HZ PHE 44 -11.203 22.400 17.392
331 H TYR 45 HN TYR 45 -13.013 27.978 13.328
332 HA TYR 45 HA TYR 45 -12.552 25.446 12.226
333 HB2 TYR 45 HB2 TYR 45 -14.548 27.090 11.889
334 HB3 TYR 45 HB1 TYR 45 -13.582 27.746 10.568
335 HD1 TYR 45 HD1 TYR 45 -13.009 26.340 8.605
336 HD2 TYR 45 HD2 TYR 45 -15.498 24.873 11.782
337 HE1 TYR 45 HE1 TYR 45 -13.731 24.453 7.166
338 HE2 TYR 45 HE2 TYR 45 -16.221 22.985 10.345
339 HH TYR 45 HH TYR 45 -16.235 22.807 7.418
340 H GLY 46 HN GLY 46 -10.726 28.306 11.977
341 HA2 GLY 46 HA2 GLY 46 -9.584 27.895 9.383
342 HA3 GLY 46 HA1 GLY 46 -8.959 28.958 10.641
343 H VAL 47 HN VAL 47 -9.538 25.672 11.510
344 HA VAL 47 HA VAL 47 -6.632 25.208 11.720
345 HB VAL 47 HB VAL 47 -8.050 24.977 13.749
346 HG11 VAL 47 HG11 VAL 47 -9.904 23.772 12.103
347 HG12 VAL 47 HG12 VAL 47 -9.901 23.622 13.857
348 HG13 VAL 47 HG13 VAL 47 -9.172 22.361 12.869
349 HG21 VAL 47 HG21 VAL 47 -7.075 22.834 14.450
350 HG22 VAL 47 HG22 VAL 47 -5.917 23.736 13.474
351 HG23 VAL 47 HG23 VAL 47 -6.801 22.386 12.767
352 H TRP 48 HN TRP 48 -6.691 24.901 9.289
353 HA TRP 48 HA TRP 48 -7.663 22.240 8.486
354 HB2 TRP 48 HB2 TRP 48 -6.509 24.393 6.714
355 HB3 TRP 48 HB1 TRP 48 -7.460 22.989 6.237
356 HD1 TRP 48 HD1 TRP 48 -9.915 23.027 7.961
357 HE1 TRP 48 HE1 TRP 48 -11.603 24.975 7.955
358 HE3 TRP 48 HE3 TRP 48 -6.951 26.755 6.118
359 HZ2 TRP 48 HZ2 TRP 48 -11.684 27.749 7.260
360 HZ3 TRP 48 HZ3 TRP 48 -7.859 29.038 5.796
361 HH2 TRP 48 HH2 TRP 48 -10.219 29.539 6.364
362 HA PRO 49 HA PRO 49 -2.987 22.154 7.475
363 HB2 PRO 49 HB2 PRO 49 -1.302 23.782 8.881
364 HB3 PRO 49 HB1 PRO 49 -2.078 24.275 7.364
365 HG2 PRO 49 HG2 PRO 49 -2.743 25.023 10.158
366 HG3 PRO 49 HG1 PRO 49 -2.906 25.967 8.668
367 HD2 PRO 49 HD2 PRO 49 -4.988 24.633 9.992
368 HD3 PRO 49 HD1 PRO 49 -5.059 25.224 8.319
369 H LEU 50 HN LEU 50 -4.092 22.608 10.760
370 HA LEU 50 HA LEU 50 -2.020 21.016 11.965
371 HB2 LEU 50 HB2 LEU 50 -3.695 22.837 12.995
372 HB3 LEU 50 HB1 LEU 50 -4.664 21.408 13.330
373 HG LEU 50 HG LEU 50 -3.252 21.851 15.255
374 HD11 LEU 50 HD11 LEU 50 -3.587 19.458 14.336
375 HD12 LEU 50 HD12 LEU 50 -2.313 19.704 15.530
376 HD13 LEU 50 HD13 LEU 50 -1.902 19.566 13.822
377 HD21 LEU 50 HD21 LEU 50 -1.426 22.915 13.492
378 HD22 LEU 50 HD22 LEU 50 -0.665 21.370 13.858
379 HD23 LEU 50 HD23 LEU 50 -1.055 22.491 15.160
380 H LEU 51 HN LEU 51 -5.410 20.447 11.055
381 HA LEU 51 HA LEU 51 -5.443 17.730 11.905
382 HB2 LEU 51 HB2 LEU 51 -7.228 19.559 10.428
383 HB3 LEU 51 HB1 LEU 51 -7.417 17.871 9.971
384 HG LEU 51 HG LEU 51 -8.917 18.579 11.853
385 HD11 LEU 51 HD11 LEU 51 -8.831 16.483 12.742
386 HD12 LEU 51 HD12 LEU 51 -7.138 16.624 13.207
387 HD13 LEU 51 HD13 LEU 51 -7.564 16.199 11.553
388 HD21 LEU 51 HD21 LEU 51 -6.806 20.018 12.802
389 HD22 LEU 51 HD22 LEU 51 -6.641 18.568 13.791
390 HD23 LEU 51 HD23 LEU 51 -8.145 19.488 13.818
391 H LEU 52 HN LEU 52 -4.960 19.214 8.689
392 HA LEU 52 HA LEU 52 -4.762 16.924 7.165
393 HB2 LEU 52 HB2 LEU 52 -3.347 19.575 6.965
394 HB3 LEU 52 HB1 LEU 52 -3.126 18.317 5.754
395 HG LEU 52 HG LEU 52 -5.854 19.354 6.576
396 HD11 LEU 52 HD11 LEU 52 -4.324 21.126 5.562
397 HD12 LEU 52 HD12 LEU 52 -5.826 20.829 4.690
398 HD13 LEU 52 HD13 LEU 52 -4.313 20.148 4.095
399 HD21 LEU 52 HD21 LEU 52 -6.231 18.437 4.097
400 HD22 LEU 52 HD22 LEU 52 -6.278 17.347 5.476
401 HD23 LEU 52 HD23 LEU 52 -4.824 17.448 4.487
402 H LEU 53 HN LEU 53 -2.414 18.248 9.418
403 HA LEU 53 HA LEU 53 -0.179 16.748 8.485
404 HB2 LEU 53 HB2 LEU 53 -0.038 18.755 9.993
405 HB3 LEU 53 HB1 LEU 53 -0.694 17.765 11.291
406 HG LEU 53 HG LEU 53 1.238 16.144 10.878
407 HD11 LEU 53 HD11 LEU 53 2.051 18.438 9.093
408 HD12 LEU 53 HD12 LEU 53 2.096 16.709 8.756
409 HD13 LEU 53 HD13 LEU 53 3.269 17.422 9.857
410 HD21 LEU 53 HD21 LEU 53 1.186 17.693 12.784
411 HD22 LEU 53 HD22 LEU 53 1.859 18.975 11.779
412 HD23 LEU 53 HD23 LEU 53 2.829 17.552 12.158
413 H LEU 54 HN LEU 54 -2.620 16.222 10.984
414 HA LEU 54 HA LEU 54 -1.597 13.794 11.981
415 HB2 LEU 54 HB2 LEU 54 -3.323 15.134 13.146
416 HB3 LEU 54 HB1 LEU 54 -4.486 14.704 11.894
417 HG LEU 54 HG LEU 54 -4.195 12.303 12.463
418 HD11 LEU 54 HD11 LEU 54 -2.074 12.001 13.373
419 HD12 LEU 54 HD12 LEU 54 -3.044 12.014 14.842
420 HD13 LEU 54 HD13 LEU 54 -2.165 13.464 14.355
421 HD21 LEU 54 HD21 LEU 54 -4.857 14.045 14.859
422 HD22 LEU 54 HD22 LEU 54 -5.392 12.385 14.600
423 HD23 LEU 54 HD23 LEU 54 -5.966 13.672 13.540
424 H LEU 55 HN LEU 55 -3.998 14.430 9.423
425 HA LEU 55 HA LEU 55 -4.486 11.679 8.880
426 HB2 LEU 55 HB2 LEU 55 -6.069 13.497 8.285
427 HB3 LEU 55 HB1 LEU 55 -4.918 14.081 7.086
428 HG LEU 55 HG LEU 55 -5.022 11.844 5.959
429 HD11 LEU 55 HD11 LEU 55 -5.718 10.269 7.533
430 HD12 LEU 55 HD12 LEU 55 -7.222 10.550 6.663
431 HD13 LEU 55 HD13 LEU 55 -6.944 11.334 8.218
432 HD21 LEU 55 HD21 LEU 55 -7.384 12.170 5.102
433 HD22 LEU 55 HD22 LEU 55 -6.376 13.616 5.063
434 HD23 LEU 55 HD23 LEU 55 -7.582 13.419 6.333
435 H ALA 56 HN ALA 56 -2.279 14.093 7.573
436 HA ALA 56 HA ALA 56 -1.387 12.770 5.296
437 HB1 ALA 56 HB1 ALA 56 0.137 14.569 7.189
438 HB2 ALA 56 HB2 ALA 56 -0.745 15.056 5.741
439 HB3 ALA 56 HB3 ALA 56 0.715 14.081 5.596
440 H LEU 57 HN LEU 57 -0.581 12.199 8.666
441 HA LEU 57 HA LEU 57 0.676 9.688 7.922
442 HB2 LEU 57 HB2 LEU 57 2.701 10.286 9.418
443 HB3 LEU 57 HB1 LEU 57 2.665 10.909 7.771
444 HG LEU 57 HG LEU 57 1.308 12.715 9.694
445 HD11 LEU 57 HD11 LEU 57 2.964 12.010 11.274
446 HD12 LEU 57 HD12 LEU 57 3.499 13.562 10.629
447 HD13 LEU 57 HD13 LEU 57 4.239 12.068 10.055
448 HD21 LEU 57 HD21 LEU 57 2.057 13.174 7.281
449 HD22 LEU 57 HD22 LEU 57 3.695 13.274 7.921
450 HD23 LEU 57 HD23 LEU 57 2.462 14.407 8.475
451 HA PRO 58 HA PRO 58 -1.239 8.499 11.714
452 HB2 PRO 58 HB2 PRO 58 0.366 6.360 12.461
453 HB3 PRO 58 HB1 PRO 58 -0.880 6.276 11.204
454 HG2 PRO 58 HG2 PRO 58 2.073 6.624 10.929
455 HG3 PRO 58 HG1 PRO 58 0.954 5.657 9.951
456 HD2 PRO 58 HD2 PRO 58 1.887 8.074 9.115
457 HD3 PRO 58 HD1 PRO 58 0.264 7.484 8.687
458 HA PRO 59 HA PRO 59 0.806 10.200 15.296
459 HB2 PRO 59 HB2 PRO 59 0.420 7.669 16.844
460 HB3 PRO 59 HB1 PRO 59 -0.134 9.313 17.216
461 HG2 PRO 59 HG2 PRO 59 -1.832 7.447 16.379
462 HG3 PRO 59 HG1 PRO 59 -1.992 9.135 15.858
463 HD2 PRO 59 HD2 PRO 59 -0.904 6.785 14.335
464 HD3 PRO 59 HD1 PRO 59 -1.909 8.134 13.769
465 H ARG 60 HN ARG 60 1.898 7.187 14.020
466 HA ARG 60 HA ARG 60 3.896 6.020 14.160
467 HB2 ARG 60 HB2 ARG 60 4.878 8.889 14.250
468 HB3 ARG 60 HB1 ARG 60 5.876 7.483 13.874
469 HG2 ARG 60 HG2 ARG 60 4.738 7.051 11.859
470 HG3 ARG 60 HG1 ARG 60 3.349 8.033 12.323
471 HD2 ARG 60 HD2 ARG 60 6.132 9.118 11.784
472 HD3 ARG 60 HD1 ARG 60 4.799 9.153 10.630
473 HE ARG 60 HE ARG 60 3.641 10.398 12.656
474 HH11 ARG 60 HH21 ARG 60 6.876 10.691 11.464
475 HH12 ARG 60 HH22 ARG 60 7.054 12.337 11.969
476 HH21 ARG 60 HH11 ARG 60 3.870 12.549 13.320
477 HH22 ARG 60 HH12 ARG 60 5.353 13.390 13.018
478 H ALA 61 HN ALA 61 5.260 8.663 15.974
479 HA ALA 61 HA ALA 61 6.722 7.670 17.872
480 HB1 ALA 61 HB1 ALA 61 6.025 9.340 19.471
481 HB2 ALA 61 HB2 ALA 61 4.451 9.488 18.690
482 HB3 ALA 61 HB3 ALA 61 5.904 10.030 17.852
483 H TYR 62 HN TYR 62 6.344 5.488 18.328
484 HA TYR 62 HA TYR 62 3.916 4.738 19.789
485 HB2 TYR 62 HB2 TYR 62 6.215 3.199 18.584
486 HB3 TYR 62 HB1 TYR 62 5.089 2.426 19.701
487 HD1 TYR 62 HD2 TYR 62 2.596 2.527 19.182
488 HD2 TYR 62 HD1 TYR 62 5.622 3.537 16.305
489 HE1 TYR 62 HE2 TYR 62 0.948 2.247 17.351
490 HE2 TYR 62 HE1 TYR 62 3.973 3.258 14.473
491 HH TYR 62 HH TYR 62 1.007 1.727 14.891
492 H ALA 63 HN ALA 63 4.298 5.919 21.720
493 HA ALA 63 HA ALA 63 6.652 5.463 23.311
494 HB1 ALA 63 HB1 ALA 63 5.367 7.555 23.484
495 HB2 ALA 63 HB2 ALA 63 5.444 6.725 25.039
496 HB3 ALA 63 HB3 ALA 63 3.973 6.650 24.071
Start of MODEL 4
1 H1 ALA 1 HT1 ALA 1 5.971 2.965 10.721
2 H2 ALA 1 HT2 ALA 1 4.561 3.082 9.779
3 H3 ALA 1 HT3 ALA 1 5.001 4.352 10.819
4 HA ALA 1 HA ALA 1 6.231 5.303 9.266
5 HB1 ALA 1 HB1 ALA 1 8.126 4.099 8.271
6 HB2 ALA 1 HB2 ALA 1 7.459 2.565 8.826
7 HB3 ALA 1 HB3 ALA 1 8.026 3.754 9.997
8 H LEU 2 HN LEU 2 3.927 3.073 8.677
9 HA LEU 2 HA LEU 2 4.106 3.268 5.721
10 HB2 LEU 2 HB2 LEU 2 2.090 1.485 6.121
11 HB3 LEU 2 HB1 LEU 2 3.781 1.009 5.997
12 HG LEU 2 HG LEU 2 2.696 1.791 8.697
13 HD11 LEU 2 HD11 LEU 2 2.246 -0.856 7.298
14 HD12 LEU 2 HD12 LEU 2 1.024 0.226 7.968
15 HD13 LEU 2 HD13 LEU 2 2.117 -0.643 9.043
16 HD21 LEU 2 HD21 LEU 2 4.578 -0.486 8.076
17 HD22 LEU 2 HD22 LEU 2 4.492 0.525 9.517
18 HD23 LEU 2 HD23 LEU 2 5.178 1.170 8.029
19 H GLU 3 HN GLU 3 3.300 5.426 5.640
20 HA GLU 3 HA GLU 3 0.504 5.821 6.519
21 HB2 GLU 3 HB2 GLU 3 1.017 8.243 5.957
22 HB3 GLU 3 HB1 GLU 3 1.929 7.569 7.305
23 HG2 GLU 3 HG2 GLU 3 3.869 7.216 5.909
24 HG3 GLU 3 HG1 GLU 3 2.966 7.660 4.461
25 H ASN 4 HN ASN 4 -0.248 7.809 4.779
26 HA ASN 4 HA ASN 4 -1.060 8.240 2.672
27 HB2 ASN 4 HB2 ASN 4 0.639 6.037 1.520
28 HB3 ASN 4 HB1 ASN 4 0.118 7.544 0.773
29 HD21 ASN 4 HD21 ASN 4 0.873 9.511 2.507
30 HD22 ASN 4 HD22 ASN 4 2.544 9.456 2.808
31 H LEU 5 HN LEU 5 -0.408 4.731 2.842
32 HA LEU 5 HA LEU 5 -2.877 4.033 1.590
33 HB2 LEU 5 HB2 LEU 5 -2.285 1.718 2.257
34 HB3 LEU 5 HB1 LEU 5 -0.977 2.551 1.424
35 HG LEU 5 HG LEU 5 -0.418 3.210 4.053
36 HD11 LEU 5 HD11 LEU 5 -1.251 0.304 4.150
37 HD12 LEU 5 HD12 LEU 5 -2.310 1.598 4.705
38 HD13 LEU 5 HD13 LEU 5 -0.751 1.342 5.486
39 HD21 LEU 5 HD21 LEU 5 1.273 2.405 2.542
40 HD22 LEU 5 HD22 LEU 5 0.500 0.824 2.424
41 HD23 LEU 5 HD23 LEU 5 1.269 1.319 3.932
42 H VAL 6 HN VAL 6 -1.844 4.513 4.894
43 HA VAL 6 HA VAL 6 -3.847 3.148 6.276
44 HB VAL 6 HB VAL 6 -3.440 4.817 8.094
45 HG11 VAL 6 HG11 VAL 6 -0.903 4.364 8.167
46 HG12 VAL 6 HG12 VAL 6 -1.135 3.527 6.631
47 HG13 VAL 6 HG13 VAL 6 -1.967 2.961 8.079
48 HG21 VAL 6 HG21 VAL 6 -1.512 6.443 7.569
49 HG22 VAL 6 HG22 VAL 6 -3.094 6.857 6.914
50 HG23 VAL 6 HG23 VAL 6 -1.868 6.140 5.870
51 H VAL 7 HN VAL 7 -3.846 6.497 5.042
52 HA VAL 7 HA VAL 7 -6.230 7.424 6.011
53 HB VAL 7 HB VAL 7 -5.323 7.807 3.152
54 HG11 VAL 7 HG11 VAL 7 -6.341 10.092 3.593
55 HG12 VAL 7 HG12 VAL 7 -6.999 9.426 5.087
56 HG13 VAL 7 HG13 VAL 7 -7.497 8.761 3.531
57 HG21 VAL 7 HG21 VAL 7 -4.365 9.022 5.750
58 HG22 VAL 7 HG22 VAL 7 -4.148 9.838 4.201
59 HG23 VAL 7 HG23 VAL 7 -3.401 8.267 4.482
60 H LEU 8 HN LEU 8 -5.722 4.996 3.544
61 HA LEU 8 HA LEU 8 -8.583 4.922 2.888
62 HB2 LEU 8 HB2 LEU 8 -6.797 4.752 1.104
63 HB3 LEU 8 HB1 LEU 8 -6.366 3.189 1.785
64 HG LEU 8 HG LEU 8 -8.842 2.548 1.493
65 HD11 LEU 8 HD11 LEU 8 -8.731 5.128 -0.085
66 HD12 LEU 8 HD12 LEU 8 -9.940 4.615 1.090
67 HD13 LEU 8 HD13 LEU 8 -9.876 3.851 -0.490
68 HD21 LEU 8 HD21 LEU 8 -7.067 1.660 0.057
69 HD22 LEU 8 HD22 LEU 8 -7.121 3.114 -0.941
70 HD23 LEU 8 HD23 LEU 8 -8.499 2.012 -0.912
71 H ASN 9 HN ASN 9 -6.062 2.589 3.893
72 HA ASN 9 HA ASN 9 -7.901 0.537 4.541
73 HB2 ASN 9 HB2 ASN 9 -5.449 0.235 4.077
74 HB3 ASN 9 HB1 ASN 9 -5.124 0.905 5.674
75 HD21 ASN 9 HD21 ASN 9 -8.050 -0.945 5.481
76 HD22 ASN 9 HD22 ASN 9 -7.449 -2.355 6.206
77 H ALA 10 HN ALA 10 -6.013 2.680 6.706
78 HA ALA 10 HA ALA 10 -7.134 1.831 9.114
79 HB1 ALA 10 HB1 ALA 10 -6.256 3.821 10.077
80 HB2 ALA 10 HB2 ALA 10 -6.334 4.684 8.541
81 HB3 ALA 10 HB3 ALA 10 -5.156 3.392 8.768
82 H ALA 11 HN ALA 11 -8.093 4.652 7.142
83 HA ALA 11 HA ALA 11 -10.278 5.462 8.648
84 HB1 ALA 11 HB1 ALA 11 -9.314 6.691 6.698
85 HB2 ALA 11 HB2 ALA 11 -11.072 6.574 6.653
86 HB3 ALA 11 HB3 ALA 11 -10.094 5.524 5.631
87 H SER 12 HN SER 12 -10.102 3.008 6.102
88 HA SER 12 HA SER 12 -12.875 2.445 5.982
89 HB2 SER 12 HB2 SER 12 -11.298 1.711 4.243
90 HB3 SER 12 HB1 SER 12 -10.528 0.623 5.394
91 HG SER 12 HG SER 12 -13.154 0.543 4.341
92 H VAL 13 HN VAL 13 -10.231 0.966 7.848
93 HA VAL 13 HA VAL 13 -11.937 -0.937 9.147
94 HB VAL 13 HB VAL 13 -9.161 0.038 9.853
95 HG11 VAL 13 HG11 VAL 13 -10.876 -2.233 10.879
96 HG12 VAL 13 HG12 VAL 13 -10.072 -0.971 11.812
97 HG13 VAL 13 HG13 VAL 13 -9.119 -2.237 11.038
98 HG21 VAL 13 HG21 VAL 13 -10.005 -2.529 8.485
99 HG22 VAL 13 HG22 VAL 13 -8.373 -1.881 8.650
100 HG23 VAL 13 HG23 VAL 13 -9.535 -1.082 7.591
101 H ALA 14 HN ALA 14 -10.193 1.927 10.420
102 HA ALA 14 HA ALA 14 -11.464 1.920 12.934
103 HB1 ALA 14 HB1 ALA 14 -9.425 3.151 12.650
104 HB2 ALA 14 HB2 ALA 14 -10.691 4.324 13.018
105 HB3 ALA 14 HB3 ALA 14 -10.126 4.125 11.359
106 H GLY 15 HN GLY 15 -12.044 4.083 10.150
107 HA2 GLY 15 HA2 GLY 15 -14.191 4.663 9.305
108 HA3 GLY 15 HA1 GLY 15 -14.908 4.183 10.841
109 H ALA 16 HN ALA 16 -12.902 5.617 12.434
110 HA ALA 16 HA ALA 16 -14.209 8.154 12.565
111 HB1 ALA 16 HB1 ALA 16 -11.672 7.166 13.891
112 HB2 ALA 16 HB2 ALA 16 -13.298 7.110 14.572
113 HB3 ALA 16 HB3 ALA 16 -12.508 8.663 14.299
114 H HIS 17 HN HIS 17 -10.817 7.298 11.846
115 HA HIS 17 HA HIS 17 -9.899 9.782 11.083
116 HB2 HIS 17 HB2 HIS 17 -9.170 7.072 9.949
117 HB3 HIS 17 HB1 HIS 17 -8.251 8.551 9.665
118 HD2 HIS 17 HD2 HIS 17 -6.718 9.442 11.882
119 HE1 HIS 17 HE1 HIS 17 -7.711 6.236 14.442
120 HE2 HIS 17 HE2 HIS 17 -6.208 8.262 14.154
121 H GLY 18 HN GLY 18 -12.396 8.081 9.638
122 HA2 GLY 18 HA2 GLY 18 -12.015 8.692 6.889
123 HA3 GLY 18 HA1 GLY 18 -13.554 8.305 7.653
124 H ILE 19 HN ILE 19 -14.164 10.234 9.299
125 HA ILE 19 HA ILE 19 -14.954 12.392 7.714
126 HB ILE 19 HB ILE 19 -15.231 13.568 10.029
127 HG12 ILE 19 HG12 ILE 19 -14.803 10.750 11.033
128 HG13 ILE 19 HG11 ILE 19 -13.480 11.917 11.018
129 HG21 ILE 19 HG21 ILE 19 -17.156 12.030 10.575
130 HG22 ILE 19 HG22 ILE 19 -16.576 10.950 9.307
131 HG23 ILE 19 HG23 ILE 19 -17.117 12.577 8.898
132 HD11 ILE 19 HD11 ILE 19 -16.164 12.418 12.336
133 HD12 ILE 19 HD12 ILE 19 -14.727 13.434 12.438
134 HD13 ILE 19 HD13 ILE 19 -14.735 11.842 13.193
135 H LEU 20 HN LEU 20 -11.950 11.797 9.324
136 HA LEU 20 HA LEU 20 -11.061 14.530 9.345
137 HB2 LEU 20 HB2 LEU 20 -9.978 11.895 10.088
138 HB3 LEU 20 HB1 LEU 20 -8.755 12.937 9.372
139 HG LEU 20 HG LEU 20 -8.823 13.199 11.818
140 HD11 LEU 20 HD11 LEU 20 -9.986 15.817 11.087
141 HD12 LEU 20 HD12 LEU 20 -8.753 15.253 9.960
142 HD13 LEU 20 HD13 LEU 20 -8.373 15.416 11.672
143 HD21 LEU 20 HD21 LEU 20 -11.397 12.684 11.825
144 HD22 LEU 20 HD22 LEU 20 -11.570 14.425 11.600
145 HD23 LEU 20 HD23 LEU 20 -10.745 13.800 13.025
146 H SER 21 HN SER 21 -10.703 11.773 7.161
147 HA SER 21 HA SER 21 -8.901 13.012 5.359
148 HB2 SER 21 HB2 SER 21 -9.510 10.531 5.517
149 HB3 SER 21 HB1 SER 21 -10.949 10.936 4.585
150 HG SER 21 HG SER 21 -9.717 11.455 2.886
151 H PHE 22 HN PHE 22 -12.441 12.804 5.444
152 HA PHE 22 HA PHE 22 -12.757 14.332 3.016
153 HB2 PHE 22 HB2 PHE 22 -14.698 13.326 5.099
154 HB3 PHE 22 HB1 PHE 22 -15.203 14.334 3.743
155 HD1 PHE 22 HD2 PHE 22 -15.027 13.518 1.423
156 HD2 PHE 22 HD1 PHE 22 -13.975 11.032 4.760
157 HE1 PHE 22 HE2 PHE 22 -15.078 11.521 -0.048
158 HE2 PHE 22 HE1 PHE 22 -14.024 9.036 3.294
159 HZ PHE 22 HZ PHE 22 -14.575 9.280 0.889
160 H LEU 23 HN LEU 23 -12.292 15.071 6.341
161 HA LEU 23 HA LEU 23 -13.711 17.396 6.749
162 HB2 LEU 23 HB2 LEU 23 -12.253 16.382 8.465
163 HB3 LEU 23 HB1 LEU 23 -10.833 16.873 7.549
164 HG LEU 23 HG LEU 23 -11.461 19.241 7.822
165 HD11 LEU 23 HD11 LEU 23 -13.896 18.014 9.095
166 HD12 LEU 23 HD12 LEU 23 -13.786 19.371 7.975
167 HD13 LEU 23 HD13 LEU 23 -13.331 19.586 9.663
168 HD21 LEU 23 HD21 LEU 23 -10.888 19.428 10.146
169 HD22 LEU 23 HD22 LEU 23 -10.090 17.974 9.545
170 HD23 LEU 23 HD23 LEU 23 -11.563 17.839 10.504
171 H VAL 24 HN VAL 24 -10.859 16.863 4.792
172 HA VAL 24 HA VAL 24 -10.419 19.668 4.252
173 HB VAL 24 HB VAL 24 -9.312 17.255 2.792
174 HG11 VAL 24 HG11 VAL 24 -8.500 20.172 2.944
175 HG12 VAL 24 HG12 VAL 24 -9.080 19.310 1.520
176 HG13 VAL 24 HG13 VAL 24 -7.508 18.908 2.214
177 HG21 VAL 24 HG21 VAL 24 -7.378 17.471 4.262
178 HG22 VAL 24 HG22 VAL 24 -8.823 17.276 5.255
179 HG23 VAL 24 HG23 VAL 24 -8.098 18.871 5.057
180 H PHE 25 HN PHE 25 -11.998 16.934 2.726
181 HA PHE 25 HA PHE 25 -12.493 18.081 0.197
182 HB2 PHE 25 HB2 PHE 25 -12.808 15.671 0.722
183 HB3 PHE 25 HB1 PHE 25 -14.222 16.091 1.689
184 HD1 PHE 25 HD2 PHE 25 -12.793 16.137 -1.736
185 HD2 PHE 25 HD1 PHE 25 -16.317 16.651 0.665
186 HE1 PHE 25 HE2 PHE 25 -14.186 16.163 -3.787
187 HE2 PHE 25 HE1 PHE 25 -17.711 16.678 -1.387
188 HZ PHE 25 HZ PHE 25 -16.645 16.435 -3.613
189 H PHE 26 HN PHE 26 -14.459 18.010 3.163
190 HA PHE 26 HA PHE 26 -16.666 19.436 2.176
191 HB2 PHE 26 HB2 PHE 26 -15.539 19.190 4.968
192 HB3 PHE 26 HB1 PHE 26 -17.035 20.052 4.609
193 HD1 PHE 26 HD2 PHE 26 -18.802 18.763 3.183
194 HD2 PHE 26 HD1 PHE 26 -15.619 16.865 5.354
195 HE1 PHE 26 HE2 PHE 26 -20.058 16.623 3.155
196 HE2 PHE 26 HE1 PHE 26 -16.875 14.726 5.327
197 HZ PHE 26 HZ PHE 26 -19.093 14.605 4.225
198 H SER 27 HN SER 27 -13.510 20.494 3.187
199 HA SER 27 HA SER 27 -13.932 23.149 3.834
200 HB2 SER 27 HB2 SER 27 -11.727 21.812 3.752
201 HB3 SER 27 HB1 SER 27 -11.653 22.286 2.057
202 HG SER 27 HG SER 27 -11.093 24.211 2.671
203 H ALA 28 HN ALA 28 -13.686 21.652 0.627
204 HA ALA 28 HA ALA 28 -14.006 24.154 -0.766
205 HB1 ALA 28 HB1 ALA 28 -14.123 22.770 -2.778
206 HB2 ALA 28 HB2 ALA 28 -14.262 21.315 -1.790
207 HB3 ALA 28 HB3 ALA 28 -12.771 22.259 -1.765
208 H ALA 29 HN ALA 29 -16.077 21.448 0.180
209 HA ALA 29 HA ALA 29 -18.360 22.115 -1.300
210 HB1 ALA 29 HB1 ALA 29 -19.565 20.688 0.182
211 HB2 ALA 29 HB2 ALA 29 -18.394 20.932 1.477
212 HB3 ALA 29 HB3 ALA 29 -17.945 20.003 0.046
213 H TRP 30 HN TRP 30 -17.599 22.954 2.089
214 HA TRP 30 HA TRP 30 -19.839 24.561 2.556
215 HB2 TRP 30 HB2 TRP 30 -17.065 24.648 3.747
216 HB3 TRP 30 HB1 TRP 30 -18.385 25.660 4.328
217 HD1 TRP 30 HD1 TRP 30 -20.787 23.720 4.392
218 HE1 TRP 30 HE1 TRP 30 -20.830 21.681 5.954
219 HE3 TRP 30 HE3 TRP 30 -15.782 23.171 5.267
220 HZ2 TRP 30 HZ2 TRP 30 -18.992 20.031 7.396
221 HZ3 TRP 30 HZ3 TRP 30 -14.960 21.359 6.742
222 HH2 TRP 30 HH2 TRP 30 -16.556 19.789 7.807
223 H TYR 31 HN TYR 31 -17.007 25.201 0.724
224 HA TYR 31 HA TYR 31 -17.181 28.068 0.787
225 HB2 TYR 31 HB2 TYR 31 -15.100 26.754 0.212
226 HB3 TYR 31 HB1 TYR 31 -15.852 26.381 -1.339
227 HD1 TYR 31 HD2 TYR 31 -16.331 28.161 -2.979
228 HD2 TYR 31 HD1 TYR 31 -14.316 28.987 0.724
229 HE1 TYR 31 HE2 TYR 31 -15.606 30.362 -3.863
230 HE2 TYR 31 HE1 TYR 31 -13.591 31.188 -0.160
231 HH TYR 31 HH TYR 31 -14.905 32.554 -2.983
232 H ILE 32 HN ILE 32 -18.959 25.629 -0.792
233 HA ILE 32 HA ILE 32 -19.587 26.873 -3.239
234 HB ILE 32 HB ILE 32 -20.084 24.467 -2.501
235 HG12 ILE 32 HG12 ILE 32 -22.370 25.997 -3.787
236 HG13 ILE 32 HG11 ILE 32 -20.890 25.542 -4.634
237 HG21 ILE 32 HG21 ILE 32 -22.104 24.006 -1.334
238 HG22 ILE 32 HG22 ILE 32 -22.684 25.661 -1.521
239 HG23 ILE 32 HG23 ILE 32 -21.358 25.314 -0.419
240 HD11 ILE 32 HD11 ILE 32 -22.980 23.711 -3.444
241 HD12 ILE 32 HD12 ILE 32 -21.381 23.137 -3.916
242 HD13 ILE 32 HD13 ILE 32 -22.466 23.818 -5.128
243 H LYS 33 HN LYS 33 -21.214 27.039 -0.077
244 HA LYS 33 HA LYS 33 -23.300 28.747 -1.011
245 HB2 LYS 33 HB2 LYS 33 -22.811 27.273 1.312
246 HB3 LYS 33 HB1 LYS 33 -22.718 28.935 1.880
247 HG2 LYS 33 HG2 LYS 33 -25.005 28.443 2.100
248 HG3 LYS 33 HG1 LYS 33 -24.945 29.267 0.544
249 HD2 LYS 33 HD2 LYS 33 -24.733 26.973 -0.537
250 HD3 LYS 33 HD1 LYS 33 -25.094 26.284 1.045
251 HE2 LYS 33 HE2 LYS 33 -26.875 28.282 -0.372
252 HE3 LYS 33 HE1 LYS 33 -27.116 26.537 -0.423
253 HZ1 LYS 33 HZ1 LYS 33 -27.766 28.391 1.641
254 HZ2 LYS 33 HZ2 LYS 33 -26.795 27.129 2.231
255 HZ3 LYS 33 HZ3 LYS 33 -28.261 26.781 1.447
256 H GLY 34 HN GLY 34 -20.482 29.408 1.095
257 HA2 GLY 34 HA2 GLY 34 -19.052 31.330 0.507
258 HA3 GLY 34 HA1 GLY 34 -20.525 32.221 0.134
259 H ARG 35 HN ARG 35 -20.450 30.052 2.864
260 HA ARG 35 HA ARG 35 -21.025 32.234 4.670
261 HB2 ARG 35 HB2 ARG 35 -21.036 30.313 6.370
262 HB3 ARG 35 HB1 ARG 35 -22.248 30.245 5.091
263 HG2 ARG 35 HG2 ARG 35 -20.976 28.639 3.846
264 HG3 ARG 35 HG1 ARG 35 -19.563 28.865 4.877
265 HD2 ARG 35 HD2 ARG 35 -22.222 27.806 5.868
266 HD3 ARG 35 HD1 ARG 35 -20.876 26.777 5.383
267 HE ARG 35 HE ARG 35 -19.951 28.653 7.279
268 HH11 ARG 35 HH21 ARG 35 -22.037 25.909 6.978
269 HH12 ARG 35 HH22 ARG 35 -21.819 25.390 8.617
270 HH21 ARG 35 HH11 ARG 35 -19.661 27.980 9.429
271 HH22 ARG 35 HH12 ARG 35 -20.473 26.563 10.004
272 H LEU 36 HN LEU 36 -18.708 33.023 3.898
273 HA LEU 36 HA LEU 36 -16.829 32.274 6.056
274 HB2 LEU 36 HB2 LEU 36 -16.199 32.600 3.115
275 HB3 LEU 36 HB1 LEU 36 -14.971 32.575 4.377
276 HG LEU 36 HG LEU 36 -17.001 30.352 4.027
277 HD11 LEU 36 HD11 LEU 36 -14.288 30.746 2.754
278 HD12 LEU 36 HD12 LEU 36 -15.815 30.335 1.972
279 HD13 LEU 36 HD13 LEU 36 -14.987 29.142 2.972
280 HD21 LEU 36 HD21 LEU 36 -16.041 30.121 6.166
281 HD22 LEU 36 HD22 LEU 36 -14.474 30.737 5.643
282 HD23 LEU 36 HD23 LEU 36 -14.982 29.116 5.181
283 H ALA 37 HN ALA 37 -16.245 33.978 7.191
284 HA ALA 37 HA ALA 37 -15.621 36.488 5.970
285 HB1 ALA 37 HB1 ALA 37 -18.333 36.084 6.681
286 HB2 ALA 37 HB2 ALA 37 -17.584 37.610 6.214
287 HB3 ALA 37 HB3 ALA 37 -17.680 37.158 7.915
288 HA PRO 38 HA PRO 38 -13.092 37.256 9.484
289 HB2 PRO 38 HB2 PRO 38 -14.834 39.563 10.295
290 HB3 PRO 38 HB1 PRO 38 -13.073 39.505 10.075
291 HG2 PRO 38 HG2 PRO 38 -14.674 40.627 8.251
292 HG3 PRO 38 HG1 PRO 38 -13.218 39.727 7.786
293 HD2 PRO 38 HD2 PRO 38 -16.083 38.925 7.527
294 HD3 PRO 38 HD1 PRO 38 -14.678 38.449 6.548
295 H GLY 39 HN GLY 39 -13.392 35.590 10.922
296 HA2 GLY 39 HA2 GLY 39 -14.079 35.523 13.388
297 HA3 GLY 39 HA1 GLY 39 -15.716 35.703 12.766
298 H ALA 40 HN ALA 40 -15.735 34.033 10.592
299 HA ALA 40 HA ALA 40 -15.912 31.459 11.853
300 HB1 ALA 40 HB1 ALA 40 -16.890 30.714 9.829
301 HB2 ALA 40 HB2 ALA 40 -16.122 31.995 8.892
302 HB3 ALA 40 HB3 ALA 40 -17.430 32.382 10.010
303 H ALA 41 HN ALA 41 -14.101 32.561 8.978
304 HA ALA 41 HA ALA 41 -12.437 30.262 8.872
305 HB1 ALA 41 HB1 ALA 41 -11.252 31.399 7.146
306 HB2 ALA 41 HB2 ALA 41 -11.769 32.978 7.734
307 HB3 ALA 41 HB3 ALA 41 -12.936 31.893 6.981
308 H TYR 42 HN TYR 42 -12.515 32.743 11.071
309 HA TYR 42 HA TYR 42 -9.695 33.131 11.483
310 HB2 TYR 42 HB2 TYR 42 -12.209 33.901 12.922
311 HB3 TYR 42 HB1 TYR 42 -10.700 33.944 13.832
312 HD1 TYR 42 HD1 TYR 42 -11.383 34.696 10.220
313 HD2 TYR 42 HD2 TYR 42 -10.110 36.211 14.032
314 HE1 TYR 42 HE1 TYR 42 -10.799 36.858 9.163
315 HE2 TYR 42 HE2 TYR 42 -9.528 38.376 12.974
316 HH TYR 42 HH TYR 42 -10.519 39.579 10.582
317 H ALA 43 HN ALA 43 -12.159 31.525 13.519
318 HA ALA 43 HA ALA 43 -10.312 30.225 15.194
319 HB1 ALA 43 HB1 ALA 43 -13.090 29.240 14.525
320 HB2 ALA 43 HB2 ALA 43 -12.769 30.564 15.645
321 HB3 ALA 43 HB3 ALA 43 -12.170 28.944 16.000
322 H PHE 44 HN PHE 44 -11.882 29.162 12.187
323 HA PHE 44 HA PHE 44 -10.986 26.480 12.272
324 HB2 PHE 44 HB2 PHE 44 -12.088 28.330 10.212
325 HB3 PHE 44 HB1 PHE 44 -11.184 26.953 9.592
326 HD1 PHE 44 HD1 PHE 44 -13.720 27.654 12.285
327 HD2 PHE 44 HD2 PHE 44 -12.429 25.034 9.134
328 HE1 PHE 44 HE1 PHE 44 -15.684 26.195 12.692
329 HE2 PHE 44 HE2 PHE 44 -14.392 23.576 9.542
330 HZ PHE 44 HZ PHE 44 -16.020 24.157 11.321
331 H TYR 45 HN TYR 45 -9.823 28.670 9.749
332 HA TYR 45 HA TYR 45 -7.379 27.399 9.376
333 HB2 TYR 45 HB2 TYR 45 -8.201 30.261 8.870
334 HB3 TYR 45 HB1 TYR 45 -6.645 29.607 8.367
335 HD1 TYR 45 HD1 TYR 45 -10.315 29.352 7.925
336 HD2 TYR 45 HD2 TYR 45 -6.463 28.054 6.535
337 HE1 TYR 45 HE1 TYR 45 -11.374 28.366 5.910
338 HE2 TYR 45 HE2 TYR 45 -7.522 27.070 4.520
339 HH TYR 45 HH TYR 45 -10.430 26.232 4.197
340 H GLY 46 HN GLY 46 -8.373 29.132 12.073
341 HA2 GLY 46 HA2 GLY 46 -5.968 30.443 12.823
342 HA3 GLY 46 HA1 GLY 46 -7.269 29.973 13.916
343 H VAL 47 HN VAL 47 -7.348 27.290 13.833
344 HA VAL 47 HA VAL 47 -4.600 26.313 14.316
345 HB VAL 47 HB VAL 47 -5.424 25.168 16.366
346 HG11 VAL 47 HG11 VAL 47 -4.219 27.338 16.456
347 HG12 VAL 47 HG12 VAL 47 -5.389 27.186 17.768
348 HG13 VAL 47 HG13 VAL 47 -5.763 28.182 16.362
349 HG21 VAL 47 HG21 VAL 47 -7.823 25.148 15.846
350 HG22 VAL 47 HG22 VAL 47 -7.864 26.910 15.884
351 HG23 VAL 47 HG23 VAL 47 -7.547 26.004 17.362
352 H TRP 48 HN TRP 48 -7.098 25.983 12.414
353 HA TRP 48 HA TRP 48 -7.906 23.289 12.596
354 HB2 TRP 48 HB2 TRP 48 -9.238 24.696 11.234
355 HB3 TRP 48 HB1 TRP 48 -7.848 25.262 10.311
356 HD1 TRP 48 HD1 TRP 48 -8.895 21.635 11.143
357 HE1 TRP 48 HE1 TRP 48 -9.070 20.320 8.931
358 HE3 TRP 48 HE3 TRP 48 -7.976 25.392 7.809
359 HZ2 TRP 48 HZ2 TRP 48 -8.849 20.800 6.121
360 HZ3 TRP 48 HZ3 TRP 48 -7.964 24.935 5.374
361 HH2 TRP 48 HH2 TRP 48 -8.398 22.646 4.525
362 HA PRO 49 HA PRO 49 -4.398 22.433 9.243
363 HB2 PRO 49 HB2 PRO 49 -2.119 23.995 9.831
364 HB3 PRO 49 HB1 PRO 49 -3.221 24.243 8.464
365 HG2 PRO 49 HG2 PRO 49 -3.188 25.584 11.132
366 HG3 PRO 49 HG1 PRO 49 -3.498 26.274 9.526
367 HD2 PRO 49 HD2 PRO 49 -5.520 25.818 11.164
368 HD3 PRO 49 HD1 PRO 49 -5.692 25.426 9.446
369 H LEU 50 HN LEU 50 -4.231 23.118 12.624
370 HA LEU 50 HA LEU 50 -1.926 21.485 13.183
371 HB2 LEU 50 HB2 LEU 50 -2.677 23.356 14.671
372 HB3 LEU 50 HB1 LEU 50 -4.100 22.402 15.083
373 HG LEU 50 HG LEU 50 -2.594 20.576 15.895
374 HD11 LEU 50 HD11 LEU 50 -0.518 20.768 14.878
375 HD12 LEU 50 HD12 LEU 50 -0.163 21.571 16.403
376 HD13 LEU 50 HD13 LEU 50 -0.511 22.528 14.965
377 HD21 LEU 50 HD21 LEU 50 -3.537 22.260 17.444
378 HD22 LEU 50 HD22 LEU 50 -2.134 23.292 17.171
379 HD23 LEU 50 HD23 LEU 50 -1.938 21.732 17.968
380 H LEU 51 HN LEU 51 -5.398 21.061 13.031
381 HA LEU 51 HA LEU 51 -5.396 18.436 14.221
382 HB2 LEU 51 HB2 LEU 51 -7.528 19.786 12.548
383 HB3 LEU 51 HB1 LEU 51 -7.747 18.386 13.596
384 HG LEU 51 HG LEU 51 -6.889 21.144 14.517
385 HD11 LEU 51 HD11 LEU 51 -9.222 21.146 13.847
386 HD12 LEU 51 HD12 LEU 51 -9.150 21.136 15.608
387 HD13 LEU 51 HD13 LEU 51 -9.520 19.651 14.731
388 HD21 LEU 51 HD21 LEU 51 -7.546 19.984 16.793
389 HD22 LEU 51 HD22 LEU 51 -5.957 19.684 16.100
390 HD23 LEU 51 HD23 LEU 51 -7.239 18.490 15.908
391 H LEU 52 HN LEU 52 -4.145 19.473 11.414
392 HA LEU 52 HA LEU 52 -5.140 17.353 9.669
393 HB2 LEU 52 HB2 LEU 52 -4.617 19.580 8.740
394 HB3 LEU 52 HB1 LEU 52 -2.934 19.381 9.220
395 HG LEU 52 HG LEU 52 -4.011 17.106 7.622
396 HD11 LEU 52 HD11 LEU 52 -3.835 18.335 5.468
397 HD12 LEU 52 HD12 LEU 52 -3.686 19.847 6.364
398 HD13 LEU 52 HD13 LEU 52 -5.175 18.907 6.462
399 HD21 LEU 52 HD21 LEU 52 -1.845 17.312 6.502
400 HD22 LEU 52 HD22 LEU 52 -1.609 17.395 8.249
401 HD23 LEU 52 HD23 LEU 52 -1.562 18.869 7.280
402 H LEU 53 HN LEU 53 -2.383 18.114 11.663
403 HA LEU 53 HA LEU 53 -0.587 16.148 10.721
404 HB2 LEU 53 HB2 LEU 53 -0.874 17.655 13.317
405 HB3 LEU 53 HB1 LEU 53 0.338 16.387 13.149
406 HG LEU 53 HG LEU 53 1.293 17.535 11.193
407 HD11 LEU 53 HD11 LEU 53 -1.004 19.433 11.710
408 HD12 LEU 53 HD12 LEU 53 -0.551 18.644 10.199
409 HD13 LEU 53 HD13 LEU 53 0.440 19.953 10.840
410 HD21 LEU 53 HD21 LEU 53 2.094 18.095 13.483
411 HD22 LEU 53 HD22 LEU 53 0.914 19.401 13.559
412 HD23 LEU 53 HD23 LEU 53 2.228 19.469 12.385
413 H LEU 54 HN LEU 54 -3.262 16.031 12.996
414 HA LEU 54 HA LEU 54 -2.708 13.654 14.332
415 HB2 LEU 54 HB2 LEU 54 -4.655 15.244 14.743
416 HB3 LEU 54 HB1 LEU 54 -5.456 14.473 13.378
417 HG LEU 54 HG LEU 54 -4.929 12.233 14.660
418 HD11 LEU 54 HD11 LEU 54 -4.750 14.315 16.861
419 HD12 LEU 54 HD12 LEU 54 -3.524 13.126 16.424
420 HD13 LEU 54 HD13 LEU 54 -5.037 12.600 17.154
421 HD21 LEU 54 HD21 LEU 54 -7.197 13.035 14.270
422 HD22 LEU 54 HD22 LEU 54 -7.041 14.209 15.576
423 HD23 LEU 54 HD23 LEU 54 -7.063 12.484 15.941
424 H LEU 55 HN LEU 55 -4.385 14.136 11.216
425 HA LEU 55 HA LEU 55 -4.911 11.411 10.718
426 HB2 LEU 55 HB2 LEU 55 -6.052 13.159 9.484
427 HB3 LEU 55 HB1 LEU 55 -4.528 13.736 8.816
428 HG LEU 55 HG LEU 55 -5.038 10.836 8.339
429 HD11 LEU 55 HD11 LEU 55 -7.326 11.591 8.062
430 HD12 LEU 55 HD12 LEU 55 -6.633 11.297 6.469
431 HD13 LEU 55 HD13 LEU 55 -6.802 12.949 7.065
432 HD21 LEU 55 HD21 LEU 55 -3.196 12.360 7.352
433 HD22 LEU 55 HD22 LEU 55 -4.464 13.018 6.319
434 HD23 LEU 55 HD23 LEU 55 -4.051 11.306 6.227
435 H ALA 56 HN ALA 56 -2.157 13.489 9.965
436 HA ALA 56 HA ALA 56 -0.760 11.472 8.464
437 HB1 ALA 56 HB1 ALA 56 -0.368 13.856 8.041
438 HB2 ALA 56 HB2 ALA 56 1.124 13.059 8.539
439 HB3 ALA 56 HB3 ALA 56 0.234 14.058 9.687
440 H LEU 57 HN LEU 57 -1.304 11.990 11.760
441 HA LEU 57 HA LEU 57 0.897 10.143 12.471
442 HB2 LEU 57 HB2 LEU 57 0.183 12.772 13.759
443 HB3 LEU 57 HB1 LEU 57 0.997 11.505 14.677
444 HG LEU 57 HG LEU 57 2.119 12.293 11.989
445 HD11 LEU 57 HD11 LEU 57 3.563 13.969 13.237
446 HD12 LEU 57 HD12 LEU 57 2.414 13.848 14.570
447 HD13 LEU 57 HD13 LEU 57 1.884 14.455 13.001
448 HD21 LEU 57 HD21 LEU 57 4.233 11.667 13.085
449 HD22 LEU 57 HD22 LEU 57 3.056 10.367 13.260
450 HD23 LEU 57 HD23 LEU 57 3.389 11.442 14.616
451 HA PRO 58 HA PRO 58 -3.233 8.888 14.202
452 HB2 PRO 58 HB2 PRO 58 -3.477 6.484 12.912
453 HB3 PRO 58 HB1 PRO 58 -4.012 8.020 12.202
454 HG2 PRO 58 HG2 PRO 58 -1.563 6.425 11.646
455 HG3 PRO 58 HG1 PRO 58 -2.552 7.396 10.543
456 HD2 PRO 58 HD2 PRO 58 -0.124 8.224 11.656
457 HD3 PRO 58 HD1 PRO 58 -1.349 9.313 10.978
458 HA PRO 59 HA PRO 59 -1.808 6.331 17.541
459 HB2 PRO 59 HB2 PRO 59 -3.763 4.231 16.651
460 HB3 PRO 59 HB1 PRO 59 -3.510 4.922 18.266
461 HG2 PRO 59 HG2 PRO 59 -5.574 5.645 16.694
462 HG3 PRO 59 HG1 PRO 59 -4.800 6.766 17.828
463 HD2 PRO 59 HD2 PRO 59 -4.684 6.744 14.865
464 HD3 PRO 59 HD1 PRO 59 -4.344 8.069 15.997
465 H ARG 60 HN ARG 60 -1.740 5.285 14.310
466 HA ARG 60 HA ARG 60 -0.497 2.728 14.672
467 HB2 ARG 60 HB2 ARG 60 -1.682 3.451 12.581
468 HB3 ARG 60 HB1 ARG 60 -0.336 4.536 12.248
469 HG2 ARG 60 HG2 ARG 60 0.463 1.718 12.835
470 HG3 ARG 60 HG1 ARG 60 -0.466 1.928 11.356
471 HD2 ARG 60 HD2 ARG 60 2.023 3.511 12.061
472 HD3 ARG 60 HD1 ARG 60 1.986 2.117 10.981
473 HE ARG 60 HE ARG 60 0.104 3.797 9.934
474 HH11 ARG 60 HH21 ARG 60 3.421 4.103 10.871
475 HH12 ARG 60 HH22 ARG 60 3.789 5.306 9.680
476 HH21 ARG 60 HH11 ARG 60 0.580 5.373 8.369
477 HH22 ARG 60 HH12 ARG 60 2.182 6.021 8.262
478 H ALA 61 HN ALA 61 0.832 5.821 13.481
479 HA ALA 61 HA ALA 61 3.547 4.934 14.095
480 HB1 ALA 61 HB1 ALA 61 2.837 6.253 12.001
481 HB2 ALA 61 HB2 ALA 61 4.282 6.798 12.853
482 HB3 ALA 61 HB3 ALA 61 2.755 7.656 13.068
483 H TYR 62 HN TYR 62 5.008 6.508 15.234
484 HA TYR 62 HA TYR 62 3.739 8.279 17.159
485 HB2 TYR 62 HB2 TYR 62 4.052 5.628 17.924
486 HB3 TYR 62 HB1 TYR 62 5.517 6.365 18.565
487 HD1 TYR 62 HD2 TYR 62 5.382 8.160 20.269
488 HD2 TYR 62 HD1 TYR 62 1.857 6.247 18.730
489 HE1 TYR 62 HE2 TYR 62 4.049 9.119 22.128
490 HE2 TYR 62 HE1 TYR 62 0.525 7.205 20.588
491 HH TYR 62 HH TYR 62 1.936 9.515 22.857
492 H ALA 63 HN ALA 63 5.076 9.906 17.764
493 HA ALA 63 HA ALA 63 6.895 11.312 17.631
494 HB1 ALA 63 HB1 ALA 63 9.010 10.351 18.370
495 HB2 ALA 63 HB2 ALA 63 8.410 8.724 18.049
496 HB3 ALA 63 HB3 ALA 63 7.689 9.692 19.337
Start of MODEL 5
1 H1 ALA 1 HT1 ALA 1 4.577 9.699 11.082
2 H2 ALA 1 HT2 ALA 1 4.760 8.168 11.795
3 H3 ALA 1 HT3 ALA 1 4.063 8.311 10.254
4 HA ALA 1 HA ALA 1 6.226 9.290 9.481
5 HB1 ALA 1 HB1 ALA 1 7.163 8.045 12.083
6 HB2 ALA 1 HB2 ALA 1 7.033 9.780 11.797
7 HB3 ALA 1 HB3 ALA 1 8.177 8.815 10.864
8 H LEU 2 HN LEU 2 5.059 6.423 11.105
9 HA LEU 2 HA LEU 2 6.701 4.572 9.641
10 HB2 LEU 2 HB2 LEU 2 4.294 4.288 11.437
11 HB3 LEU 2 HB1 LEU 2 4.950 2.906 10.559
12 HG LEU 2 HG LEU 2 7.158 3.290 11.592
13 HD11 LEU 2 HD11 LEU 2 5.698 5.620 12.846
14 HD12 LEU 2 HD12 LEU 2 7.239 5.623 11.984
15 HD13 LEU 2 HD13 LEU 2 7.134 4.923 13.597
16 HD21 LEU 2 HD21 LEU 2 4.884 3.180 13.601
17 HD22 LEU 2 HD22 LEU 2 6.537 2.636 13.890
18 HD23 LEU 2 HD23 LEU 2 5.528 1.801 12.708
19 H GLU 3 HN GLU 3 5.601 2.800 8.342
20 HA GLU 3 HA GLU 3 4.690 3.660 5.932
21 HB2 GLU 3 HB2 GLU 3 3.885 1.134 7.392
22 HB3 GLU 3 HB1 GLU 3 3.577 1.425 5.680
23 HG2 GLU 3 HG2 GLU 3 5.974 1.671 5.258
24 HG3 GLU 3 HG1 GLU 3 6.318 1.480 6.975
25 H ASN 4 HN ASN 4 3.128 5.129 5.598
26 HA ASN 4 HA ASN 4 0.559 4.870 7.049
27 HB2 ASN 4 HB2 ASN 4 1.905 7.043 7.125
28 HB3 ASN 4 HB1 ASN 4 1.476 7.243 5.426
29 HD21 ASN 4 HD21 ASN 4 0.001 9.015 5.708
30 HD22 ASN 4 HD22 ASN 4 -1.454 8.864 6.570
31 H LEU 5 HN LEU 5 1.145 3.114 4.875
32 HA LEU 5 HA LEU 5 -0.695 4.114 2.774
33 HB2 LEU 5 HB2 LEU 5 1.498 3.610 1.860
34 HB3 LEU 5 HB1 LEU 5 1.487 2.017 2.616
35 HG LEU 5 HG LEU 5 -0.402 1.325 1.219
36 HD11 LEU 5 HD11 LEU 5 -0.355 4.226 0.391
37 HD12 LEU 5 HD12 LEU 5 -1.729 3.239 0.889
38 HD13 LEU 5 HD13 LEU 5 -1.005 3.002 -0.698
39 HD21 LEU 5 HD21 LEU 5 1.691 2.703 -0.488
40 HD22 LEU 5 HD22 LEU 5 0.716 1.303 -0.933
41 HD23 LEU 5 HD23 LEU 5 1.937 1.159 0.331
42 H VAL 6 HN VAL 6 0.356 0.891 3.868
43 HA VAL 6 HA VAL 6 -2.095 -0.366 3.320
44 HB VAL 6 HB VAL 6 0.024 -1.587 3.622
45 HG11 VAL 6 HG11 VAL 6 0.673 -0.093 5.639
46 HG12 VAL 6 HG12 VAL 6 1.096 -1.802 5.715
47 HG13 VAL 6 HG13 VAL 6 -0.306 -1.203 6.599
48 HG21 VAL 6 HG21 VAL 6 -2.221 -2.688 3.953
49 HG22 VAL 6 HG22 VAL 6 -2.034 -2.424 5.687
50 HG23 VAL 6 HG23 VAL 6 -0.905 -3.471 4.827
51 H VAL 7 HN VAL 7 -0.785 0.885 6.383
52 HA VAL 7 HA VAL 7 -3.021 0.184 7.973
53 HB VAL 7 HB VAL 7 -0.812 0.752 8.916
54 HG11 VAL 7 HG11 VAL 7 -1.501 3.625 8.253
55 HG12 VAL 7 HG12 VAL 7 -0.419 2.646 7.264
56 HG13 VAL 7 HG13 VAL 7 0.002 3.009 8.938
57 HG21 VAL 7 HG21 VAL 7 -1.643 1.933 10.824
58 HG22 VAL 7 HG22 VAL 7 -3.012 1.020 10.191
59 HG23 VAL 7 HG23 VAL 7 -2.879 2.749 9.868
60 H LEU 8 HN LEU 8 -2.193 3.121 6.168
61 HA LEU 8 HA LEU 8 -4.305 4.732 7.090
62 HB2 LEU 8 HB2 LEU 8 -2.325 5.537 5.783
63 HB3 LEU 8 HB1 LEU 8 -3.031 4.803 4.346
64 HG LEU 8 HG LEU 8 -5.082 6.209 4.698
65 HD11 LEU 8 HD11 LEU 8 -4.456 8.315 6.227
66 HD12 LEU 8 HD12 LEU 8 -3.467 7.116 7.059
67 HD13 LEU 8 HD13 LEU 8 -5.207 6.877 6.909
68 HD21 LEU 8 HD21 LEU 8 -4.078 8.258 3.840
69 HD22 LEU 8 HD22 LEU 8 -3.226 6.870 3.163
70 HD23 LEU 8 HD23 LEU 8 -2.501 7.791 4.481
71 H ASN 9 HN ASN 9 -4.093 2.549 4.283
72 HA ASN 9 HA ASN 9 -6.667 3.095 3.254
73 HB2 ASN 9 HB2 ASN 9 -4.965 1.958 1.924
74 HB3 ASN 9 HB1 ASN 9 -4.978 0.593 3.041
75 HD21 ASN 9 HD21 ASN 9 -7.135 2.407 0.804
76 HD22 ASN 9 HD22 ASN 9 -8.134 1.079 0.457
77 H ALA 10 HN ALA 10 -5.489 0.576 5.467
78 HA ALA 10 HA ALA 10 -8.035 -0.669 5.819
79 HB1 ALA 10 HB1 ALA 10 -6.048 -1.947 6.284
80 HB2 ALA 10 HB2 ALA 10 -6.916 -1.734 7.804
81 HB3 ALA 10 HB3 ALA 10 -5.494 -0.752 7.458
82 H ALA 11 HN ALA 11 -6.424 2.043 7.226
83 HA ALA 11 HA ALA 11 -8.053 2.203 9.599
84 HB1 ALA 11 HB1 ALA 11 -5.846 3.198 9.637
85 HB2 ALA 11 HB2 ALA 11 -7.046 4.479 9.813
86 HB3 ALA 11 HB3 ALA 11 -6.246 4.226 8.261
87 H SER 12 HN SER 12 -8.446 3.051 6.319
88 HA SER 12 HA SER 12 -10.183 5.284 6.568
89 HB2 SER 12 HB2 SER 12 -9.115 4.654 4.439
90 HB3 SER 12 HB1 SER 12 -10.084 3.184 4.387
91 HG SER 12 HG SER 12 -11.875 4.365 4.054
92 H VAL 13 HN VAL 13 -10.857 1.815 6.139
93 HA VAL 13 HA VAL 13 -13.689 2.246 6.748
94 HB VAL 13 HB VAL 13 -13.071 0.756 4.886
95 HG11 VAL 13 HG11 VAL 13 -10.930 -0.037 5.991
96 HG12 VAL 13 HG12 VAL 13 -11.908 -1.317 5.274
97 HG13 VAL 13 HG13 VAL 13 -11.927 -1.066 7.020
98 HG21 VAL 13 HG21 VAL 13 -14.236 -0.821 7.198
99 HG22 VAL 13 HG22 VAL 13 -14.570 -1.038 5.479
100 HG23 VAL 13 HG23 VAL 13 -15.139 0.407 6.313
101 H ALA 14 HN ALA 14 -10.787 1.219 8.333
102 HA ALA 14 HA ALA 14 -12.257 -0.135 10.484
103 HB1 ALA 14 HB1 ALA 14 -10.076 -1.023 9.534
104 HB2 ALA 14 HB2 ALA 14 -10.138 -0.855 11.288
105 HB3 ALA 14 HB3 ALA 14 -9.280 0.340 10.318
106 H GLY 15 HN GLY 15 -9.471 2.074 10.726
107 HA2 GLY 15 HA2 GLY 15 -10.308 3.140 13.204
108 HA3 GLY 15 HA1 GLY 15 -9.077 3.830 12.154
109 H ALA 16 HN ALA 16 -10.008 5.869 12.990
110 HA ALA 16 HA ALA 16 -12.597 6.644 11.871
111 HB1 ALA 16 HB1 ALA 16 -12.378 8.645 13.185
112 HB2 ALA 16 HB2 ALA 16 -10.683 8.300 13.527
113 HB3 ALA 16 HB3 ALA 16 -11.947 7.271 14.199
114 H HIS 17 HN HIS 17 -9.509 6.497 10.709
115 HA HIS 17 HA HIS 17 -8.787 8.864 9.601
116 HB2 HIS 17 HB2 HIS 17 -7.514 6.845 9.199
117 HB3 HIS 17 HB1 HIS 17 -8.822 6.171 8.231
118 HD2 HIS 17 HD2 HIS 17 -7.984 6.398 5.613
119 HE1 HIS 17 HE1 HIS 17 -6.394 10.304 5.825
120 HE2 HIS 17 HE2 HIS 17 -6.883 8.351 4.275
121 H GLY 18 HN GLY 18 -11.724 7.195 8.962
122 HA2 GLY 18 HA2 GLY 18 -12.293 8.226 6.370
123 HA3 GLY 18 HA1 GLY 18 -13.475 7.601 7.515
124 H ILE 19 HN ILE 19 -13.285 9.262 9.624
125 HA ILE 19 HA ILE 19 -14.877 11.420 9.002
126 HB ILE 19 HB ILE 19 -14.262 10.485 11.330
127 HG12 ILE 19 HG12 ILE 19 -14.298 13.506 11.057
128 HG13 ILE 19 HG11 ILE 19 -15.732 12.497 10.858
129 HG21 ILE 19 HG21 ILE 19 -11.753 11.041 10.867
130 HG22 ILE 19 HG22 ILE 19 -12.397 11.368 12.473
131 HG23 ILE 19 HG23 ILE 19 -12.193 12.684 11.318
132 HD11 ILE 19 HD11 ILE 19 -15.697 13.268 13.145
133 HD12 ILE 19 HD12 ILE 19 -14.020 12.761 13.342
134 HD13 ILE 19 HD13 ILE 19 -15.292 11.553 13.152
135 H LEU 20 HN LEU 20 -11.409 11.158 8.731
136 HA LEU 20 HA LEU 20 -10.848 13.932 8.619
137 HB2 LEU 20 HB2 LEU 20 -9.097 12.245 9.015
138 HB3 LEU 20 HB1 LEU 20 -9.341 11.595 7.406
139 HG LEU 20 HG LEU 20 -7.359 13.176 7.704
140 HD11 LEU 20 HD11 LEU 20 -8.949 12.743 5.497
141 HD12 LEU 20 HD12 LEU 20 -7.447 13.660 5.495
142 HD13 LEU 20 HD13 LEU 20 -8.989 14.498 5.620
143 HD21 LEU 20 HD21 LEU 20 -7.692 15.506 7.925
144 HD22 LEU 20 HD22 LEU 20 -8.777 14.802 9.121
145 HD23 LEU 20 HD23 LEU 20 -9.414 15.381 7.580
146 H SER 21 HN SER 21 -11.498 11.513 6.129
147 HA SER 21 HA SER 21 -11.147 13.149 3.871
148 HB2 SER 21 HB2 SER 21 -13.036 10.808 4.218
149 HB3 SER 21 HB1 SER 21 -12.532 11.501 2.679
150 HG SER 21 HG SER 21 -10.747 10.417 2.841
151 H PHE 22 HN PHE 22 -14.041 12.510 5.827
152 HA PHE 22 HA PHE 22 -15.853 14.008 4.273
153 HB2 PHE 22 HB2 PHE 22 -15.804 13.195 7.177
154 HB3 PHE 22 HB1 PHE 22 -17.117 14.173 6.521
155 HD1 PHE 22 HD2 PHE 22 -18.516 13.301 4.654
156 HD2 PHE 22 HD1 PHE 22 -15.622 10.846 6.665
157 HE1 PHE 22 HE2 PHE 22 -19.593 11.269 3.725
158 HE2 PHE 22 HE1 PHE 22 -16.698 8.815 5.736
159 HZ PHE 22 HZ PHE 22 -18.684 9.026 4.265
160 H LEU 23 HN LEU 23 -13.707 14.946 6.934
161 HA LEU 23 HA LEU 23 -14.668 17.565 7.295
162 HB2 LEU 23 HB2 LEU 23 -13.166 16.473 8.893
163 HB3 LEU 23 HB1 LEU 23 -11.874 16.466 7.696
164 HG LEU 23 HG LEU 23 -13.078 19.154 8.147
165 HD11 LEU 23 HD11 LEU 23 -11.600 17.722 10.371
166 HD12 LEU 23 HD12 LEU 23 -13.200 18.463 10.445
167 HD13 LEU 23 HD13 LEU 23 -11.768 19.475 10.278
168 HD21 LEU 23 HD21 LEU 23 -10.224 18.110 8.197
169 HD22 LEU 23 HD22 LEU 23 -10.694 19.809 8.180
170 HD23 LEU 23 HD23 LEU 23 -11.039 18.787 6.789
171 H VAL 24 HN VAL 24 -12.266 16.234 5.060
172 HA VAL 24 HA VAL 24 -11.374 18.752 4.052
173 HB VAL 24 HB VAL 24 -11.272 15.969 2.860
174 HG11 VAL 24 HG11 VAL 24 -11.075 17.480 1.022
175 HG12 VAL 24 HG12 VAL 24 -9.422 17.050 1.458
176 HG13 VAL 24 HG13 VAL 24 -10.089 18.603 1.958
177 HG21 VAL 24 HG21 VAL 24 -9.078 15.855 3.730
178 HG22 VAL 24 HG22 VAL 24 -10.009 16.576 5.044
179 HG23 VAL 24 HG23 VAL 24 -8.998 17.591 4.017
180 H PHE 25 HN PHE 25 -13.800 16.395 3.037
181 HA PHE 25 HA PHE 25 -14.558 17.666 0.628
182 HB2 PHE 25 HB2 PHE 25 -15.151 15.315 1.266
183 HB3 PHE 25 HB1 PHE 25 -16.321 15.972 2.411
184 HD1 PHE 25 HD1 PHE 25 -15.475 15.546 -1.146
185 HD2 PHE 25 HD2 PHE 25 -18.341 17.116 1.641
186 HE1 PHE 25 HE1 PHE 25 -17.116 15.819 -2.987
187 HE2 PHE 25 HE2 PHE 25 -19.982 17.388 -0.200
188 HZ PHE 25 HZ PHE 25 -19.369 16.739 -2.512
189 H PHE 26 HN PHE 26 -15.819 17.919 3.944
190 HA PHE 26 HA PHE 26 -17.943 19.672 3.339
191 HB2 PHE 26 HB2 PHE 26 -16.884 18.422 5.654
192 HB3 PHE 26 HB1 PHE 26 -16.853 20.145 6.008
193 HD1 PHE 26 HD1 PHE 26 -19.019 17.282 5.104
194 HD2 PHE 26 HD2 PHE 26 -18.892 21.425 6.233
195 HE1 PHE 26 HE1 PHE 26 -21.468 17.249 5.501
196 HE2 PHE 26 HE2 PHE 26 -21.340 21.392 6.631
197 HZ PHE 26 HZ PHE 26 -22.627 19.304 6.265
198 H SER 27 HN SER 27 -14.570 20.253 4.247
199 HA SER 27 HA SER 27 -14.640 23.011 4.595
200 HB2 SER 27 HB2 SER 27 -12.437 21.366 3.334
201 HB3 SER 27 HB1 SER 27 -12.257 22.989 3.993
202 HG SER 27 HG SER 27 -11.835 20.933 5.337
203 H ALA 28 HN ALA 28 -14.349 21.123 1.603
204 HA ALA 28 HA ALA 28 -14.112 23.459 -0.066
205 HB1 ALA 28 HB1 ALA 28 -14.459 21.794 -1.921
206 HB2 ALA 28 HB2 ALA 28 -14.635 20.546 -0.688
207 HB3 ALA 28 HB3 ALA 28 -13.111 21.418 -0.848
208 H ALA 29 HN ALA 29 -16.690 21.168 0.763
209 HA ALA 29 HA ALA 29 -18.668 22.210 -0.953
210 HB1 ALA 29 HB1 ALA 29 -20.238 20.954 0.346
211 HB2 ALA 29 HB2 ALA 29 -19.161 20.934 1.741
212 HB3 ALA 29 HB3 ALA 29 -18.749 20.012 0.297
213 H TRP 30 HN TRP 30 -17.712 23.070 2.343
214 HA TRP 30 HA TRP 30 -19.831 24.800 2.964
215 HB2 TRP 30 HB2 TRP 30 -18.156 23.991 4.607
216 HB3 TRP 30 HB1 TRP 30 -16.940 25.013 3.843
217 HD1 TRP 30 HD1 TRP 30 -17.111 27.623 4.188
218 HE1 TRP 30 HE1 TRP 30 -18.439 29.076 5.852
219 HE3 TRP 30 HE3 TRP 30 -20.417 24.151 5.949
220 HZ2 TRP 30 HZ2 TRP 30 -20.616 28.803 7.688
221 HZ3 TRP 30 HZ3 TRP 30 -22.105 24.774 7.653
222 HH2 TRP 30 HH2 TRP 30 -22.208 27.092 8.524
223 H TYR 31 HN TYR 31 -16.978 25.193 1.018
224 HA TYR 31 HA TYR 31 -16.715 27.956 0.879
225 HB2 TYR 31 HB2 TYR 31 -15.235 26.204 -0.226
226 HB3 TYR 31 HB1 TYR 31 -16.436 26.135 -1.517
227 HD1 TYR 31 HD1 TYR 31 -13.948 28.259 0.192
228 HD2 TYR 31 HD2 TYR 31 -16.740 27.988 -3.061
229 HE1 TYR 31 HE1 TYR 31 -12.963 30.297 -0.823
230 HE2 TYR 31 HE2 TYR 31 -15.756 30.026 -4.076
231 HH TYR 31 HH TYR 31 -13.190 31.846 -2.421
232 H ILE 32 HN ILE 32 -19.323 26.020 -0.077
233 HA ILE 32 HA ILE 32 -20.331 27.575 -2.236
234 HB ILE 32 HB ILE 32 -20.980 25.172 -1.593
235 HG12 ILE 32 HG12 ILE 32 -23.515 25.746 -2.187
236 HG13 ILE 32 HG11 ILE 32 -22.871 27.366 -2.437
237 HG21 ILE 32 HG21 ILE 32 -21.496 25.917 0.815
238 HG22 ILE 32 HG22 ILE 32 -22.657 24.833 0.049
239 HG23 ILE 32 HG23 ILE 32 -23.006 26.557 0.168
240 HD11 ILE 32 HD11 ILE 32 -21.228 26.473 -4.049
241 HD12 ILE 32 HD12 ILE 32 -22.870 26.062 -4.535
242 HD13 ILE 32 HD13 ILE 32 -21.846 24.844 -3.776
243 H LYS 33 HN LYS 33 -20.247 28.074 1.172
244 HA LYS 33 HA LYS 33 -22.477 29.432 1.857
245 HB2 LYS 33 HB2 LYS 33 -20.829 30.984 3.157
246 HB3 LYS 33 HB1 LYS 33 -20.867 29.268 3.537
247 HG2 LYS 33 HG2 LYS 33 -18.634 29.160 3.107
248 HG3 LYS 33 HG1 LYS 33 -18.951 29.545 1.423
249 HD2 LYS 33 HD2 LYS 33 -18.821 31.950 1.933
250 HD3 LYS 33 HD1 LYS 33 -18.512 31.570 3.627
251 HE2 LYS 33 HE2 LYS 33 -16.467 30.357 2.996
252 HE3 LYS 33 HE1 LYS 33 -16.779 30.708 1.296
253 HZ1 LYS 33 HZ1 LYS 33 -16.318 32.718 3.433
254 HZ2 LYS 33 HZ2 LYS 33 -16.650 33.071 1.805
255 HZ3 LYS 33 HZ3 LYS 33 -15.208 32.277 2.228
256 H GLY 34 HN GLY 34 -19.654 31.022 0.338
257 HA2 GLY 34 HA2 GLY 34 -19.475 32.969 -0.876
258 HA3 GLY 34 HA1 GLY 34 -21.097 32.611 -1.454
259 H ARG 35 HN ARG 35 -21.821 32.725 1.611
260 HA ARG 35 HA ARG 35 -21.968 35.680 1.826
261 HB2 ARG 35 HB2 ARG 35 -24.146 33.682 2.483
262 HB3 ARG 35 HB1 ARG 35 -24.241 35.430 2.713
263 HG2 ARG 35 HG2 ARG 35 -23.832 35.714 0.253
264 HG3 ARG 35 HG1 ARG 35 -23.935 33.962 0.078
265 HD2 ARG 35 HD2 ARG 35 -26.120 35.735 1.205
266 HD3 ARG 35 HD1 ARG 35 -26.100 35.057 -0.419
267 HE ARG 35 HE ARG 35 -26.816 33.678 1.994
268 HH11 ARG 35 HH21 ARG 35 -25.383 33.358 -1.138
269 HH12 ARG 35 HH22 ARG 35 -25.784 31.680 -1.302
270 HH21 ARG 35 HH11 ARG 35 -27.345 31.481 1.788
271 HH22 ARG 35 HH12 ARG 35 -26.894 30.618 0.355
272 H LEU 36 HN LEU 36 -19.983 35.107 3.185
273 HA LEU 36 HA LEU 36 -20.844 35.032 5.967
274 HB2 LEU 36 HB2 LEU 36 -20.244 32.609 4.977
275 HB3 LEU 36 HB1 LEU 36 -18.602 33.149 5.303
276 HG LEU 36 HG LEU 36 -19.432 31.953 7.248
277 HD11 LEU 36 HD11 LEU 36 -18.057 34.101 7.459
278 HD12 LEU 36 HD12 LEU 36 -18.905 33.564 8.907
279 HD13 LEU 36 HD13 LEU 36 -19.559 34.889 7.942
280 HD21 LEU 36 HD21 LEU 36 -21.534 32.162 8.122
281 HD22 LEU 36 HD22 LEU 36 -21.934 32.882 6.567
282 HD23 LEU 36 HD23 LEU 36 -21.556 33.916 7.943
283 H ALA 37 HN ALA 37 -19.843 36.712 6.883
284 HA ALA 37 HA ALA 37 -17.518 37.895 5.641
285 HB1 ALA 37 HB1 ALA 37 -17.902 39.228 8.061
286 HB2 ALA 37 HB2 ALA 37 -19.519 38.662 7.648
287 HB3 ALA 37 HB3 ALA 37 -18.629 39.679 6.519
288 HA PRO 38 HA PRO 38 -14.334 36.028 8.029
289 HB2 PRO 38 HB2 PRO 38 -12.691 38.178 8.618
290 HB3 PRO 38 HB1 PRO 38 -12.766 37.394 7.029
291 HG2 PRO 38 HG2 PRO 38 -14.104 39.897 7.963
292 HG3 PRO 38 HG1 PRO 38 -13.313 39.554 6.413
293 HD2 PRO 38 HD2 PRO 38 -16.013 39.508 6.676
294 HD3 PRO 38 HD1 PRO 38 -15.162 38.403 5.573
295 H GLY 39 HN GLY 39 -12.970 36.502 10.171
296 HA2 GLY 39 HA2 GLY 39 -12.980 37.331 12.419
297 HA3 GLY 39 HA1 GLY 39 -14.708 37.646 12.272
298 H ALA 40 HN ALA 40 -16.088 35.655 11.929
299 HA ALA 40 HA ALA 40 -15.794 33.878 14.062
300 HB1 ALA 40 HB1 ALA 40 -17.354 33.506 11.494
301 HB2 ALA 40 HB2 ALA 40 -17.947 34.263 12.973
302 HB3 ALA 40 HB3 ALA 40 -17.560 32.544 12.958
303 H ALA 41 HN ALA 41 -14.709 33.628 10.718
304 HA ALA 41 HA ALA 41 -13.961 30.872 10.862
305 HB1 ALA 41 HB1 ALA 41 -12.644 31.434 8.782
306 HB2 ALA 41 HB2 ALA 41 -13.182 33.103 8.978
307 HB3 ALA 41 HB3 ALA 41 -14.363 31.822 8.698
308 H TYR 42 HN TYR 42 -12.932 32.868 12.923
309 HA TYR 42 HA TYR 42 -10.187 33.292 12.666
310 HB2 TYR 42 HB2 TYR 42 -11.471 34.304 14.473
311 HB3 TYR 42 HB1 TYR 42 -11.801 32.715 15.162
312 HD1 TYR 42 HD1 TYR 42 -9.149 35.207 14.457
313 HD2 TYR 42 HD2 TYR 42 -10.147 31.536 16.453
314 HE1 TYR 42 HE1 TYR 42 -7.013 35.309 15.713
315 HE2 TYR 42 HE2 TYR 42 -8.012 31.638 17.709
316 HH TYR 42 HH TYR 42 -5.668 32.762 17.260
317 H ALA 43 HN ALA 43 -11.942 30.468 13.926
318 HA ALA 43 HA ALA 43 -9.720 28.990 14.797
319 HB1 ALA 43 HB1 ALA 43 -12.353 28.008 13.669
320 HB2 ALA 43 HB2 ALA 43 -12.007 28.347 15.364
321 HB3 ALA 43 HB3 ALA 43 -11.193 27.012 14.548
322 H PHE 44 HN PHE 44 -11.299 29.152 11.611
323 HA PHE 44 HA PHE 44 -9.899 27.130 10.315
324 HB2 PHE 44 HB2 PHE 44 -11.818 28.457 9.377
325 HB3 PHE 44 HB1 PHE 44 -10.690 29.784 9.096
326 HD1 PHE 44 HD1 PHE 44 -8.885 29.582 7.433
327 HD2 PHE 44 HD2 PHE 44 -11.719 26.416 8.064
328 HE1 PHE 44 HE1 PHE 44 -8.171 28.519 5.309
329 HE2 PHE 44 HE2 PHE 44 -11.005 25.353 5.940
330 HZ PHE 44 HZ PHE 44 -9.231 26.406 4.562
331 H TYR 45 HN TYR 45 -9.044 30.576 10.644
332 HA TYR 45 HA TYR 45 -6.519 30.249 9.301
333 HB2 TYR 45 HB2 TYR 45 -7.385 32.542 11.075
334 HB3 TYR 45 HB1 TYR 45 -6.137 32.562 9.829
335 HD1 TYR 45 HD2 TYR 45 -7.079 31.544 7.456
336 HD2 TYR 45 HD1 TYR 45 -9.400 33.550 10.462
337 HE1 TYR 45 HE2 TYR 45 -8.780 32.126 5.752
338 HE2 TYR 45 HE1 TYR 45 -11.101 34.134 8.758
339 HH TYR 45 HH TYR 45 -11.803 33.013 6.403
340 H GLY 46 HN GLY 46 -7.648 30.323 12.628
341 HA2 GLY 46 HA2 GLY 46 -5.413 30.686 14.127
342 HA3 GLY 46 HA1 GLY 46 -6.639 29.492 14.540
343 H VAL 47 HN VAL 47 -6.220 27.330 14.245
344 HA VAL 47 HA VAL 47 -3.758 26.525 12.856
345 HB VAL 47 HB VAL 47 -3.067 25.129 14.787
346 HG11 VAL 47 HG11 VAL 47 -2.157 27.439 14.352
347 HG12 VAL 47 HG12 VAL 47 -2.082 26.949 16.046
348 HG13 VAL 47 HG13 VAL 47 -3.338 28.062 15.504
349 HG21 VAL 47 HG21 VAL 47 -5.271 24.973 15.891
350 HG22 VAL 47 HG22 VAL 47 -5.224 26.702 16.236
351 HG23 VAL 47 HG23 VAL 47 -4.060 25.618 16.998
352 H TRP 48 HN TRP 48 -6.519 26.188 12.184
353 HA TRP 48 HA TRP 48 -7.507 23.643 12.875
354 HB2 TRP 48 HB2 TRP 48 -8.653 25.632 11.600
355 HB3 TRP 48 HB1 TRP 48 -8.023 24.836 10.164
356 HD1 TRP 48 HD1 TRP 48 -9.484 23.043 9.164
357 HE1 TRP 48 HE1 TRP 48 -11.453 21.591 9.981
358 HE3 TRP 48 HE3 TRP 48 -9.633 24.442 14.074
359 HZ2 TRP 48 HZ2 TRP 48 -12.899 21.091 12.398
360 HZ3 TRP 48 HZ3 TRP 48 -11.314 23.465 15.609
361 HH2 TRP 48 HH2 TRP 48 -12.947 21.792 14.779
362 HA PRO 49 HA PRO 49 -5.286 22.039 8.837
363 HB2 PRO 49 HB2 PRO 49 -2.905 23.339 8.245
364 HB3 PRO 49 HB1 PRO 49 -4.456 23.683 7.454
365 HG2 PRO 49 HG2 PRO 49 -3.124 25.117 9.712
366 HG3 PRO 49 HG1 PRO 49 -3.960 25.778 8.294
367 HD2 PRO 49 HD2 PRO 49 -5.163 25.698 10.673
368 HD3 PRO 49 HD1 PRO 49 -6.075 25.384 9.186
369 H LEU 50 HN LEU 50 -3.943 23.092 11.822
370 HA LEU 50 HA LEU 50 -1.623 21.387 11.773
371 HB2 LEU 50 HB2 LEU 50 -1.751 23.484 13.129
372 HB3 LEU 50 HB1 LEU 50 -2.955 22.705 14.152
373 HG LEU 50 HG LEU 50 -1.300 20.898 14.660
374 HD11 LEU 50 HD11 LEU 50 0.275 20.799 12.955
375 HD12 LEU 50 HD12 LEU 50 1.173 21.744 14.135
376 HD13 LEU 50 HD13 LEU 50 0.372 22.552 12.789
377 HD21 LEU 50 HD21 LEU 50 -0.497 23.760 15.265
378 HD22 LEU 50 HD22 LEU 50 0.177 22.353 16.089
379 HD23 LEU 50 HD23 LEU 50 -1.541 22.721 16.235
380 H LEU 51 HN LEU 51 -4.896 21.212 13.088
381 HA LEU 51 HA LEU 51 -4.563 18.867 14.622
382 HB2 LEU 51 HB2 LEU 51 -6.937 20.237 13.377
383 HB3 LEU 51 HB1 LEU 51 -7.139 18.664 14.144
384 HG LEU 51 HG LEU 51 -7.562 20.623 15.677
385 HD11 LEU 51 HD11 LEU 51 -5.159 19.311 16.864
386 HD12 LEU 51 HD12 LEU 51 -6.426 18.225 16.295
387 HD13 LEU 51 HD13 LEU 51 -6.799 19.458 17.493
388 HD21 LEU 51 HD21 LEU 51 -5.787 22.066 16.333
389 HD22 LEU 51 HD22 LEU 51 -5.656 21.957 14.578
390 HD23 LEU 51 HD23 LEU 51 -4.567 21.022 15.602
391 H LEU 52 HN LEU 52 -5.438 19.349 11.215
392 HA LEU 52 HA LEU 52 -6.217 16.821 10.482
393 HB2 LEU 52 HB2 LEU 52 -4.329 18.502 8.831
394 HB3 LEU 52 HB1 LEU 52 -5.553 17.372 8.258
395 HG LEU 52 HG LEU 52 -6.042 20.000 9.683
396 HD11 LEU 52 HD11 LEU 52 -5.442 20.102 7.258
397 HD12 LEU 52 HD12 LEU 52 -7.078 20.672 7.593
398 HD13 LEU 52 HD13 LEU 52 -6.826 19.066 6.910
399 HD21 LEU 52 HD21 LEU 52 -7.753 18.571 10.485
400 HD22 LEU 52 HD22 LEU 52 -7.892 17.726 8.943
401 HD23 LEU 52 HD23 LEU 52 -8.490 19.378 9.103
402 H LEU 53 HN LEU 53 -3.136 17.820 11.635
403 HA LEU 53 HA LEU 53 -1.518 15.836 10.393
404 HB2 LEU 53 HB2 LEU 53 -0.866 18.008 11.740
405 HB3 LEU 53 HB1 LEU 53 -0.915 16.931 13.134
406 HG LEU 53 HG LEU 53 0.728 16.449 10.629
407 HD11 LEU 53 HD11 LEU 53 1.607 18.355 11.853
408 HD12 LEU 53 HD12 LEU 53 2.660 16.966 12.121
409 HD13 LEU 53 HD13 LEU 53 1.524 17.464 13.373
410 HD21 LEU 53 HD21 LEU 53 0.264 14.897 13.164
411 HD22 LEU 53 HD22 LEU 53 1.861 14.836 12.418
412 HD23 LEU 53 HD23 LEU 53 0.451 14.319 11.507
413 H LEU 54 HN LEU 54 -3.274 15.974 13.474
414 HA LEU 54 HA LEU 54 -2.420 13.382 14.353
415 HB2 LEU 54 HB2 LEU 54 -4.806 14.987 15.292
416 HB3 LEU 54 HB1 LEU 54 -3.989 13.687 16.160
417 HG LEU 54 HG LEU 54 -2.736 16.332 15.371
418 HD11 LEU 54 HD11 LEU 54 -2.822 16.874 17.729
419 HD12 LEU 54 HD12 LEU 54 -3.459 15.277 18.119
420 HD13 LEU 54 HD13 LEU 54 -4.446 16.422 17.213
421 HD21 LEU 54 HD21 LEU 54 -0.939 14.825 15.418
422 HD22 LEU 54 HD22 LEU 54 -1.672 13.829 16.676
423 HD23 LEU 54 HD23 LEU 54 -0.974 15.397 17.084
424 H LEU 55 HN LEU 55 -4.866 14.481 12.191
425 HA LEU 55 HA LEU 55 -6.446 12.018 12.463
426 HB2 LEU 55 HB2 LEU 55 -6.815 14.659 11.074
427 HB3 LEU 55 HB1 LEU 55 -7.763 13.266 10.564
428 HG LEU 55 HG LEU 55 -8.552 12.964 12.895
429 HD11 LEU 55 HD11 LEU 55 -6.828 15.411 13.328
430 HD12 LEU 55 HD12 LEU 55 -6.775 13.875 14.194
431 HD13 LEU 55 HD13 LEU 55 -8.133 14.977 14.433
432 HD21 LEU 55 HD21 LEU 55 -8.970 15.805 11.914
433 HD22 LEU 55 HD22 LEU 55 -10.073 14.856 12.912
434 HD23 LEU 55 HD23 LEU 55 -9.787 14.397 11.233
435 H ALA 56 HN ALA 56 -4.454 13.772 10.131
436 HA ALA 56 HA ALA 56 -4.765 11.995 7.960
437 HB1 ALA 56 HB1 ALA 56 -3.819 14.275 7.745
438 HB2 ALA 56 HB2 ALA 56 -2.773 13.046 7.032
439 HB3 ALA 56 HB3 ALA 56 -2.374 13.739 8.605
440 H LEU 57 HN LEU 57 -2.614 11.971 10.742
441 HA LEU 57 HA LEU 57 -1.399 9.448 9.776
442 HB2 LEU 57 HB2 LEU 57 -0.371 11.741 11.387
443 HB3 LEU 57 HB1 LEU 57 0.240 10.135 11.789
444 HG LEU 57 HG LEU 57 0.920 9.780 9.467
445 HD11 LEU 57 HD11 LEU 57 0.811 11.933 7.974
446 HD12 LEU 57 HD12 LEU 57 -0.490 12.411 9.065
447 HD13 LEU 57 HD13 LEU 57 -0.622 10.921 8.131
448 HD21 LEU 57 HD21 LEU 57 2.663 11.572 9.308
449 HD22 LEU 57 HD22 LEU 57 2.561 10.851 10.915
450 HD23 LEU 57 HD23 LEU 57 1.846 12.435 10.613
451 HA PRO 58 HA PRO 58 -4.434 7.933 12.899
452 HB2 PRO 58 HB2 PRO 58 -3.113 5.391 11.999
453 HB3 PRO 58 HB1 PRO 58 -4.838 5.741 12.228
454 HG2 PRO 58 HG2 PRO 58 -3.758 5.638 9.797
455 HG3 PRO 58 HG1 PRO 58 -5.047 6.787 10.198
456 HD2 PRO 58 HD2 PRO 58 -2.141 7.293 9.763
457 HD3 PRO 58 HD1 PRO 58 -3.526 8.377 9.506
458 HA PRO 59 HA PRO 59 -2.059 7.186 16.574
459 HB2 PRO 59 HB2 PRO 59 -2.978 4.335 16.725
460 HB3 PRO 59 HB1 PRO 59 -3.065 5.614 17.955
461 HG2 PRO 59 HG2 PRO 59 -5.229 4.860 16.609
462 HG3 PRO 59 HG1 PRO 59 -4.954 6.564 17.021
463 HD2 PRO 59 HD2 PRO 59 -4.640 5.185 14.385
464 HD3 PRO 59 HD1 PRO 59 -5.188 6.840 14.731
465 H ARG 60 HN ARG 60 -1.896 4.429 14.323
466 HA ARG 60 HA ARG 60 0.471 3.276 15.240
467 HB2 ARG 60 HB2 ARG 60 -1.272 2.682 13.256
468 HB3 ARG 60 HB1 ARG 60 0.030 3.351 12.280
469 HG2 ARG 60 HG2 ARG 60 0.345 1.117 14.311
470 HG3 ARG 60 HG1 ARG 60 0.254 0.898 12.564
471 HD2 ARG 60 HD2 ARG 60 2.261 2.397 12.341
472 HD3 ARG 60 HD1 ARG 60 2.389 2.396 14.097
473 HE ARG 60 HE ARG 60 2.996 0.172 12.305
474 HH11 ARG 60 HH21 ARG 60 2.425 1.309 15.524
475 HH12 ARG 60 HH22 ARG 60 3.232 -0.022 16.282
476 HH21 ARG 60 HH11 ARG 60 4.057 -1.572 13.292
477 HH22 ARG 60 HH12 ARG 60 4.155 -1.653 15.020
478 H ALA 61 HN ALA 61 0.044 5.748 12.689
479 HA ALA 61 HA ALA 61 2.936 6.258 12.674
480 HB1 ALA 61 HB1 ALA 61 0.728 7.411 10.951
481 HB2 ALA 61 HB2 ALA 61 1.763 6.049 10.519
482 HB3 ALA 61 HB3 ALA 61 2.460 7.656 10.722
483 H TYR 62 HN TYR 62 3.724 8.467 12.802
484 HA TYR 62 HA TYR 62 2.103 10.583 13.809
485 HB2 TYR 62 HB2 TYR 62 2.179 9.147 15.836
486 HB3 TYR 62 HB1 TYR 62 3.939 9.250 15.815
487 HD1 TYR 62 HD1 TYR 62 0.805 11.181 16.235
488 HD2 TYR 62 HD2 TYR 62 5.092 11.253 16.501
489 HE1 TYR 62 HE1 TYR 62 0.694 13.345 17.441
490 HE2 TYR 62 HE2 TYR 62 4.981 13.417 17.707
491 HH TYR 62 HH TYR 62 2.364 15.369 17.738
492 H ALA 63 HN ALA 63 3.305 12.534 14.112
493 HA ALA 63 HA ALA 63 6.164 12.442 13.370
494 HB1 ALA 63 HB1 ALA 63 4.059 14.168 12.046
495 HB2 ALA 63 HB2 ALA 63 4.977 12.870 11.287
496 HB3 ALA 63 HB3 ALA 63 5.798 14.341 11.811
Start of MODEL 6
1 H1 ALA 1 HT1 ALA 1 7.617 2.968 7.408
2 H2 ALA 1 HT2 ALA 1 7.972 3.081 9.065
3 H3 ALA 1 HT3 ALA 1 8.742 4.113 7.956
4 HA ALA 1 HA ALA 1 6.298 4.480 9.315
5 HB1 ALA 1 HB1 ALA 1 7.876 6.141 7.329
6 HB2 ALA 1 HB2 ALA 1 8.021 6.190 9.086
7 HB3 ALA 1 HB3 ALA 1 6.542 6.751 8.307
8 H LEU 2 HN LEU 2 5.285 2.590 7.953
9 HA LEU 2 HA LEU 2 4.153 3.598 5.418
10 HB2 LEU 2 HB2 LEU 2 3.338 1.184 5.234
11 HB3 LEU 2 HB1 LEU 2 5.073 1.443 5.096
12 HG LEU 2 HG LEU 2 4.015 0.944 7.858
13 HD11 LEU 2 HD11 LEU 2 4.107 -1.152 5.679
14 HD12 LEU 2 HD12 LEU 2 2.775 -0.774 6.773
15 HD13 LEU 2 HD13 LEU 2 4.225 -1.563 7.390
16 HD21 LEU 2 HD21 LEU 2 6.144 -0.044 8.197
17 HD22 LEU 2 HD22 LEU 2 6.475 1.314 7.123
18 HD23 LEU 2 HD23 LEU 2 6.388 -0.321 6.472
19 H GLU 3 HN GLU 3 3.382 4.150 8.384
20 HA GLU 3 HA GLU 3 0.733 3.078 8.651
21 HB2 GLU 3 HB2 GLU 3 0.539 4.717 10.526
22 HB3 GLU 3 HB1 GLU 3 1.934 3.653 10.658
23 HG2 GLU 3 HG2 GLU 3 2.183 6.349 9.316
24 HG3 GLU 3 HG1 GLU 3 2.265 6.207 11.065
25 H ASN 4 HN ASN 4 1.418 4.635 6.183
26 HA ASN 4 HA ASN 4 -0.583 6.815 6.404
27 HB2 ASN 4 HB2 ASN 4 1.789 7.389 5.704
28 HB3 ASN 4 HB1 ASN 4 1.477 6.479 4.226
29 HD21 ASN 4 HD21 ASN 4 -0.874 7.178 3.258
30 HD22 ASN 4 HD22 ASN 4 -1.094 8.858 3.152
31 H LEU 5 HN LEU 5 0.561 4.209 4.264
32 HA LEU 5 HA LEU 5 -1.741 4.431 2.528
33 HB2 LEU 5 HB2 LEU 5 0.269 2.173 2.697
34 HB3 LEU 5 HB1 LEU 5 -0.792 2.558 1.340
35 HG LEU 5 HG LEU 5 1.413 4.341 2.418
36 HD11 LEU 5 HD11 LEU 5 1.190 2.552 -0.010
37 HD12 LEU 5 HD12 LEU 5 2.434 2.541 1.240
38 HD13 LEU 5 HD13 LEU 5 2.359 3.870 0.083
39 HD21 LEU 5 HD21 LEU 5 -0.181 5.826 1.533
40 HD22 LEU 5 HD22 LEU 5 -0.690 4.692 0.281
41 HD23 LEU 5 HD23 LEU 5 0.860 5.523 0.145
42 H VAL 6 HN VAL 6 -0.583 2.092 4.905
43 HA VAL 6 HA VAL 6 -2.811 0.339 4.753
44 HB VAL 6 HB VAL 6 -0.622 -0.280 5.763
45 HG11 VAL 6 HG11 VAL 6 -1.538 1.260 8.197
46 HG12 VAL 6 HG12 VAL 6 -0.467 1.975 6.993
47 HG13 VAL 6 HG13 VAL 6 0.043 0.543 7.888
48 HG21 VAL 6 HG21 VAL 6 -2.820 -1.460 6.262
49 HG22 VAL 6 HG22 VAL 6 -2.891 -0.527 7.757
50 HG23 VAL 6 HG23 VAL 6 -1.569 -1.663 7.488
51 H VAL 7 HN VAL 7 -2.073 3.057 6.913
52 HA VAL 7 HA VAL 7 -4.341 2.809 8.572
53 HB VAL 7 HB VAL 7 -2.640 5.196 7.823
54 HG11 VAL 7 HG11 VAL 7 -4.750 6.136 8.485
55 HG12 VAL 7 HG12 VAL 7 -3.699 6.229 9.895
56 HG13 VAL 7 HG13 VAL 7 -4.927 4.970 9.799
57 HG21 VAL 7 HG21 VAL 7 -1.526 3.434 9.131
58 HG22 VAL 7 HG22 VAL 7 -2.837 3.465 10.310
59 HG23 VAL 7 HG23 VAL 7 -1.783 4.867 10.128
60 H LEU 8 HN LEU 8 -3.829 4.859 5.673
61 HA LEU 8 HA LEU 8 -6.460 5.914 5.701
62 HB2 LEU 8 HB2 LEU 8 -4.236 6.631 4.375
63 HB3 LEU 8 HB1 LEU 8 -4.979 5.674 3.101
64 HG LEU 8 HG LEU 8 -5.688 7.979 2.827
65 HD11 LEU 8 HD11 LEU 8 -7.374 6.013 2.633
66 HD12 LEU 8 HD12 LEU 8 -8.014 7.652 2.678
67 HD13 LEU 8 HD13 LEU 8 -8.058 6.656 4.130
68 HD21 LEU 8 HD21 LEU 8 -6.182 9.406 4.530
69 HD22 LEU 8 HD22 LEU 8 -5.452 8.199 5.583
70 HD23 LEU 8 HD23 LEU 8 -7.199 8.229 5.359
71 H ASN 9 HN ASN 9 -4.980 3.171 4.013
72 HA ASN 9 HA ASN 9 -7.186 2.456 2.418
73 HB2 ASN 9 HB2 ASN 9 -4.962 0.787 3.599
74 HB3 ASN 9 HB1 ASN 9 -6.130 0.166 2.438
75 HD21 ASN 9 HD21 ASN 9 -6.121 3.014 1.152
76 HD22 ASN 9 HD22 ASN 9 -4.712 3.002 0.208
77 H ALA 10 HN ALA 10 -6.267 1.433 5.701
78 HA ALA 10 HA ALA 10 -8.611 -0.237 5.979
79 HB1 ALA 10 HB1 ALA 10 -6.800 0.751 8.193
80 HB2 ALA 10 HB2 ALA 10 -6.390 -0.615 7.154
81 HB3 ALA 10 HB3 ALA 10 -7.819 -0.690 8.185
82 H ALA 11 HN ALA 11 -7.511 2.538 7.933
83 HA ALA 11 HA ALA 11 -9.778 3.178 9.247
84 HB1 ALA 11 HB1 ALA 11 -8.969 5.372 9.514
85 HB2 ALA 11 HB2 ALA 11 -8.186 5.369 7.932
86 HB3 ALA 11 HB3 ALA 11 -7.520 4.402 9.249
87 H SER 12 HN SER 12 -9.276 3.553 5.809
88 HA SER 12 HA SER 12 -11.308 5.411 5.233
89 HB2 SER 12 HB2 SER 12 -9.884 3.280 3.701
90 HB3 SER 12 HB1 SER 12 -11.328 3.992 2.983
91 HG SER 12 HG SER 12 -10.286 5.807 2.715
92 H VAL 13 HN VAL 13 -11.391 1.862 5.497
93 HA VAL 13 HA VAL 13 -14.306 1.874 5.130
94 HB VAL 13 HB VAL 13 -12.387 -0.448 5.435
95 HG11 VAL 13 HG11 VAL 13 -15.315 -0.223 4.694
96 HG12 VAL 13 HG12 VAL 13 -14.616 -1.117 6.045
97 HG13 VAL 13 HG13 VAL 13 -14.355 -1.672 4.392
98 HG21 VAL 13 HG21 VAL 13 -12.591 -0.664 3.005
99 HG22 VAL 13 HG22 VAL 13 -11.993 0.946 3.400
100 HG23 VAL 13 HG23 VAL 13 -13.682 0.721 2.950
101 H ALA 14 HN ALA 14 -11.835 1.204 7.557
102 HA ALA 14 HA ALA 14 -13.344 -0.098 9.483
103 HB1 ALA 14 HB1 ALA 14 -11.625 0.379 10.959
104 HB2 ALA 14 HB2 ALA 14 -11.427 2.028 10.366
105 HB3 ALA 14 HB3 ALA 14 -10.808 0.672 9.424
106 H GLY 15 HN GLY 15 -12.970 3.409 8.966
107 HA2 GLY 15 HA2 GLY 15 -14.967 4.816 9.167
108 HA3 GLY 15 HA1 GLY 15 -15.438 3.842 10.557
109 H ALA 16 HN ALA 16 -12.294 3.939 11.045
110 HA ALA 16 HA ALA 16 -12.369 5.787 13.154
111 HB1 ALA 16 HB1 ALA 16 -10.709 4.058 13.181
112 HB2 ALA 16 HB2 ALA 16 -9.853 5.596 13.074
113 HB3 ALA 16 HB3 ALA 16 -10.044 4.595 11.637
114 H HIS 17 HN HIS 17 -11.137 6.125 9.822
115 HA HIS 17 HA HIS 17 -10.650 8.992 10.294
116 HB2 HIS 17 HB2 HIS 17 -9.761 7.078 8.132
117 HB3 HIS 17 HB1 HIS 17 -9.577 8.824 7.982
118 HD2 HIS 17 HD2 HIS 17 -6.804 8.934 8.409
119 HE1 HIS 17 HE1 HIS 17 -6.809 7.102 12.214
120 HE2 HIS 17 HE2 HIS 17 -5.377 8.329 10.512
121 H GLY 18 HN GLY 18 -13.228 7.295 9.643
122 HA2 GLY 18 HA2 GLY 18 -14.193 8.204 7.139
123 HA3 GLY 18 HA1 GLY 18 -15.188 7.633 8.478
124 H ILE 19 HN ILE 19 -14.820 9.397 10.447
125 HA ILE 19 HA ILE 19 -16.325 11.656 9.631
126 HB ILE 19 HB ILE 19 -16.359 10.645 11.928
127 HG12 ILE 19 HG12 ILE 19 -16.438 12.852 13.120
128 HG13 ILE 19 HG11 ILE 19 -15.697 13.603 11.710
129 HG21 ILE 19 HG21 ILE 19 -13.807 12.201 12.374
130 HG22 ILE 19 HG22 ILE 19 -13.801 10.483 11.980
131 HG23 ILE 19 HG23 ILE 19 -14.581 11.045 13.458
132 HD11 ILE 19 HD11 ILE 19 -18.354 13.534 12.040
133 HD12 ILE 19 HD12 ILE 19 -18.164 11.970 11.250
134 HD13 ILE 19 HD13 ILE 19 -17.615 13.443 10.444
135 H LEU 20 HN LEU 20 -12.911 11.085 10.062
136 HA LEU 20 HA LEU 20 -12.115 13.837 10.041
137 HB2 LEU 20 HB2 LEU 20 -10.668 11.219 9.685
138 HB3 LEU 20 HB1 LEU 20 -9.830 12.743 9.390
139 HG LEU 20 HG LEU 20 -11.377 12.416 11.960
140 HD11 LEU 20 HD11 LEU 20 -8.706 11.161 11.305
141 HD12 LEU 20 HD12 LEU 20 -10.106 10.423 12.086
142 HD13 LEU 20 HD13 LEU 20 -9.133 11.606 12.957
143 HD21 LEU 20 HD21 LEU 20 -8.690 13.742 11.513
144 HD22 LEU 20 HD22 LEU 20 -9.878 14.075 12.772
145 HD23 LEU 20 HD23 LEU 20 -10.189 14.573 11.110
146 H SER 21 HN SER 21 -12.495 11.326 7.584
147 HA SER 21 HA SER 21 -11.340 12.711 5.422
148 HB2 SER 21 HB2 SER 21 -11.734 10.395 5.123
149 HB3 SER 21 HB1 SER 21 -13.426 10.539 5.587
150 HG SER 21 HG SER 21 -12.372 10.706 3.170
151 H PHE 22 HN PHE 22 -14.683 12.609 6.636
152 HA PHE 22 HA PHE 22 -15.810 14.210 4.586
153 HB2 PHE 22 HB2 PHE 22 -16.691 13.637 7.415
154 HB3 PHE 22 HB1 PHE 22 -17.632 14.635 6.309
155 HD1 PHE 22 HD2 PHE 22 -17.900 13.542 3.850
156 HD2 PHE 22 HD1 PHE 22 -17.226 11.362 7.487
157 HE1 PHE 22 HE2 PHE 22 -18.841 11.503 2.803
158 HE2 PHE 22 HE1 PHE 22 -18.166 9.322 6.442
159 HZ PHE 22 HZ PHE 22 -18.975 9.392 4.100
160 H LEU 23 HN LEU 23 -14.225 14.993 7.643
161 HA LEU 23 HA LEU 23 -14.951 17.682 7.819
162 HB2 LEU 23 HB2 LEU 23 -13.775 16.415 9.612
163 HB3 LEU 23 HB1 LEU 23 -12.317 16.421 8.625
164 HG LEU 23 HG LEU 23 -12.333 18.914 8.655
165 HD11 LEU 23 HD11 LEU 23 -14.865 18.427 10.205
166 HD12 LEU 23 HD12 LEU 23 -14.516 19.649 8.981
167 HD13 LEU 23 HD13 LEU 23 -13.880 19.831 10.612
168 HD21 LEU 23 HD21 LEU 23 -12.443 17.618 11.396
169 HD22 LEU 23 HD22 LEU 23 -11.657 19.150 11.014
170 HD23 LEU 23 HD23 LEU 23 -11.038 17.647 10.330
171 H VAL 24 HN VAL 24 -12.433 16.082 5.930
172 HA VAL 24 HA VAL 24 -11.220 18.551 5.064
173 HB VAL 24 HB VAL 24 -10.940 15.767 3.901
174 HG11 VAL 24 HG11 VAL 24 -9.325 18.318 3.667
175 HG12 VAL 24 HG12 VAL 24 -10.123 17.434 2.367
176 HG13 VAL 24 HG13 VAL 24 -8.716 16.739 3.171
177 HG21 VAL 24 HG21 VAL 24 -10.286 15.617 6.188
178 HG22 VAL 24 HG22 VAL 24 -9.522 17.205 6.147
179 HG23 VAL 24 HG23 VAL 24 -8.785 15.854 5.291
180 H PHE 25 HN PHE 25 -13.381 16.129 3.665
181 HA PHE 25 HA PHE 25 -13.639 17.367 1.121
182 HB2 PHE 25 HB2 PHE 25 -14.196 15.015 1.447
183 HB3 PHE 25 HB1 PHE 25 -15.504 15.453 2.548
184 HD1 PHE 25 HD2 PHE 25 -14.285 15.860 -0.955
185 HD2 PHE 25 HD1 PHE 25 -17.642 16.066 1.718
186 HE1 PHE 25 HE2 PHE 25 -15.808 16.157 -2.890
187 HE2 PHE 25 HE1 PHE 25 -19.164 16.363 -0.217
188 HZ PHE 25 HZ PHE 25 -18.247 16.409 -2.521
189 H PHE 26 HN PHE 26 -15.573 17.524 4.088
190 HA PHE 26 HA PHE 26 -17.636 19.160 3.038
191 HB2 PHE 26 HB2 PHE 26 -17.933 17.844 5.081
192 HB3 PHE 26 HB1 PHE 26 -16.692 18.798 5.891
193 HD1 PHE 26 HD2 PHE 26 -19.938 19.158 4.059
194 HD2 PHE 26 HD1 PHE 26 -17.297 20.760 7.044
195 HE1 PHE 26 HE2 PHE 26 -21.646 20.853 4.661
196 HE2 PHE 26 HE1 PHE 26 -19.005 22.455 7.645
197 HZ PHE 26 HZ PHE 26 -21.177 22.502 6.453
198 H SER 27 HN SER 27 -14.430 19.831 4.211
199 HA SER 27 HA SER 27 -14.689 22.495 5.013
200 HB2 SER 27 HB2 SER 27 -12.333 22.666 4.713
201 HB3 SER 27 HB1 SER 27 -12.635 20.994 5.174
202 HG SER 27 HG SER 27 -11.254 21.545 3.216
203 H ALA 28 HN ALA 28 -14.521 21.050 1.825
204 HA ALA 28 HA ALA 28 -14.035 23.403 0.333
205 HB1 ALA 28 HB1 ALA 28 -15.064 22.081 -1.556
206 HB2 ALA 28 HB2 ALA 28 -15.382 20.795 -0.391
207 HB3 ALA 28 HB3 ALA 28 -13.722 21.283 -0.737
208 H ALA 29 HN ALA 29 -16.910 22.046 1.774
209 HA ALA 29 HA ALA 29 -18.918 23.297 0.317
210 HB1 ALA 29 HB1 ALA 29 -20.337 22.932 2.184
211 HB2 ALA 29 HB2 ALA 29 -18.989 23.014 3.320
212 HB3 ALA 29 HB3 ALA 29 -19.150 21.629 2.240
213 H TRP 30 HN TRP 30 -17.131 24.558 3.153
214 HA TRP 30 HA TRP 30 -18.438 27.006 3.396
215 HB2 TRP 30 HB2 TRP 30 -15.529 26.340 3.910
216 HB3 TRP 30 HB1 TRP 30 -16.361 27.779 4.500
217 HD1 TRP 30 HD1 TRP 30 -16.502 23.945 4.787
218 HE1 TRP 30 HE1 TRP 30 -17.575 23.337 7.050
219 HE3 TRP 30 HE3 TRP 30 -17.772 28.606 6.443
220 HZ2 TRP 30 HZ2 TRP 30 -18.811 24.652 9.270
221 HZ3 TRP 30 HZ3 TRP 30 -18.896 28.898 8.632
222 HH2 TRP 30 HH2 TRP 30 -19.416 26.930 10.047
223 H TYR 31 HN TYR 31 -15.795 26.029 1.265
224 HA TYR 31 HA TYR 31 -15.225 28.647 0.283
225 HB2 TYR 31 HB2 TYR 31 -14.618 25.862 -0.701
226 HB3 TYR 31 HB1 TYR 31 -14.190 27.281 -1.656
227 HD1 TYR 31 HD2 TYR 31 -13.892 25.922 1.831
228 HD2 TYR 31 HD1 TYR 31 -12.143 28.353 -1.250
229 HE1 TYR 31 HE2 TYR 31 -11.874 26.250 3.234
230 HE2 TYR 31 HE1 TYR 31 -10.126 28.681 0.154
231 HH TYR 31 HH TYR 31 -9.452 26.804 2.869
232 H ILE 32 HN ILE 32 -17.253 25.968 -0.921
233 HA ILE 32 HA ILE 32 -18.042 27.190 -3.327
234 HB ILE 32 HB ILE 32 -19.432 25.141 -1.585
235 HG12 ILE 32 HG12 ILE 32 -17.951 24.781 -4.203
236 HG13 ILE 32 HG11 ILE 32 -17.158 24.620 -2.635
237 HG21 ILE 32 HG21 ILE 32 -21.144 26.086 -2.954
238 HG22 ILE 32 HG22 ILE 32 -20.625 24.627 -3.799
239 HG23 ILE 32 HG23 ILE 32 -20.065 26.208 -4.344
240 HD11 ILE 32 HD11 ILE 32 -18.049 22.454 -3.675
241 HD12 ILE 32 HD12 ILE 32 -19.663 23.080 -3.337
242 HD13 ILE 32 HD13 ILE 32 -18.539 22.780 -2.011
243 H LYS 33 HN LYS 33 -19.540 27.221 -0.089
244 HA LYS 33 HA LYS 33 -21.845 28.683 -0.822
245 HB2 LYS 33 HB2 LYS 33 -20.380 28.420 1.808
246 HB3 LYS 33 HB1 LYS 33 -21.908 29.284 1.640
247 HG2 LYS 33 HG2 LYS 33 -22.891 27.188 0.638
248 HG3 LYS 33 HG1 LYS 33 -21.392 26.355 1.052
249 HD2 LYS 33 HD2 LYS 33 -23.107 27.836 3.062
250 HD3 LYS 33 HD1 LYS 33 -23.221 26.102 2.773
251 HE2 LYS 33 HE2 LYS 33 -21.745 26.183 4.580
252 HE3 LYS 33 HE1 LYS 33 -20.621 26.142 3.222
253 HZ1 LYS 33 HZ1 LYS 33 -19.877 28.151 3.747
254 HZ2 LYS 33 HZ2 LYS 33 -20.781 28.063 5.183
255 HZ3 LYS 33 HZ3 LYS 33 -21.444 28.800 3.802
256 H GLY 34 HN GLY 34 -18.668 29.729 0.384
257 HA2 GLY 34 HA2 GLY 34 -17.579 31.746 0.149
258 HA3 GLY 34 HA1 GLY 34 -18.814 32.212 -1.017
259 H ARG 35 HN ARG 35 -19.944 31.146 2.042
260 HA ARG 35 HA ARG 35 -20.833 33.869 2.689
261 HB2 ARG 35 HB2 ARG 35 -21.598 31.156 3.794
262 HB3 ARG 35 HB1 ARG 35 -22.234 32.681 4.408
263 HG2 ARG 35 HG2 ARG 35 -22.408 32.278 1.445
264 HG3 ARG 35 HG1 ARG 35 -23.454 31.260 2.431
265 HD2 ARG 35 HD2 ARG 35 -24.328 33.602 1.648
266 HD3 ARG 35 HD1 ARG 35 -24.640 33.077 3.299
267 HE ARG 35 HE ARG 35 -22.292 34.412 3.536
268 HH11 ARG 35 HH21 ARG 35 -25.330 35.139 2.048
269 HH12 ARG 35 HH22 ARG 35 -25.204 36.847 2.310
270 HH21 ARG 35 HH11 ARG 35 -22.118 36.648 3.879
271 HH22 ARG 35 HH12 ARG 35 -23.385 37.700 3.346
272 H LEU 36 HN LEU 36 -18.271 31.887 3.367
273 HA LEU 36 HA LEU 36 -17.923 32.259 6.155
274 HB2 LEU 36 HB2 LEU 36 -15.374 31.930 5.365
275 HB3 LEU 36 HB1 LEU 36 -16.509 30.584 5.392
276 HG LEU 36 HG LEU 36 -16.968 30.862 3.009
277 HD11 LEU 36 HD11 LEU 36 -15.379 32.548 1.787
278 HD12 LEU 36 HD12 LEU 36 -15.253 33.322 3.364
279 HD13 LEU 36 HD13 LEU 36 -16.823 33.176 2.573
280 HD21 LEU 36 HD21 LEU 36 -14.766 30.259 2.126
281 HD22 LEU 36 HD22 LEU 36 -15.009 29.503 3.700
282 HD23 LEU 36 HD23 LEU 36 -13.988 30.934 3.558
283 H ALA 37 HN ALA 37 -16.318 33.646 7.187
284 HA ALA 37 HA ALA 37 -15.195 35.857 5.789
285 HB1 ALA 37 HB1 ALA 37 -16.776 37.473 6.007
286 HB2 ALA 37 HB2 ALA 37 -17.067 37.066 7.700
287 HB3 ALA 37 HB3 ALA 37 -17.895 36.179 6.424
288 HA PRO 38 HA PRO 38 -12.649 36.301 9.363
289 HB2 PRO 38 HB2 PRO 38 -13.582 39.093 9.899
290 HB3 PRO 38 HB1 PRO 38 -11.937 38.494 9.600
291 HG2 PRO 38 HG2 PRO 38 -13.268 39.868 7.743
292 HG3 PRO 38 HG1 PRO 38 -12.210 38.512 7.307
293 HD2 PRO 38 HD2 PRO 38 -15.208 38.595 7.438
294 HD3 PRO 38 HD1 PRO 38 -14.146 37.758 6.284
295 H GLY 39 HN GLY 39 -12.780 35.769 11.500
296 HA2 GLY 39 HA2 GLY 39 -13.971 36.513 13.661
297 HA3 GLY 39 HA1 GLY 39 -15.424 35.992 12.810
298 H ALA 40 HN ALA 40 -15.910 33.843 12.669
299 HA ALA 40 HA ALA 40 -14.731 32.084 14.557
300 HB1 ALA 40 HB1 ALA 40 -17.079 31.889 13.892
301 HB2 ALA 40 HB2 ALA 40 -16.221 30.381 13.573
302 HB3 ALA 40 HB3 ALA 40 -16.594 31.480 12.246
303 H ALA 41 HN ALA 41 -14.408 32.423 11.045
304 HA ALA 41 HA ALA 41 -13.062 30.124 10.387
305 HB1 ALA 41 HB1 ALA 41 -11.879 31.527 8.653
306 HB2 ALA 41 HB2 ALA 41 -12.614 32.946 9.401
307 HB3 ALA 41 HB3 ALA 41 -13.633 31.702 8.677
308 H TYR 42 HN TYR 42 -11.070 33.007 10.534
309 HA TYR 42 HA TYR 42 -8.624 32.086 10.953
310 HB2 TYR 42 HB2 TYR 42 -9.913 34.329 12.507
311 HB3 TYR 42 HB1 TYR 42 -8.180 34.001 12.556
312 HD1 TYR 42 HD2 TYR 42 -6.919 33.884 10.309
313 HD2 TYR 42 HD1 TYR 42 -10.830 35.608 10.744
314 HE1 TYR 42 HE2 TYR 42 -6.609 35.123 8.183
315 HE2 TYR 42 HE1 TYR 42 -10.518 36.848 8.619
316 HH TYR 42 HH TYR 42 -9.198 37.202 6.875
317 H ALA 43 HN ALA 43 -10.994 32.252 13.612
318 HA ALA 43 HA ALA 43 -9.256 31.182 15.593
319 HB1 ALA 43 HB1 ALA 43 -11.409 30.757 16.833
320 HB2 ALA 43 HB2 ALA 43 -12.272 31.314 15.399
321 HB3 ALA 43 HB3 ALA 43 -11.207 32.415 16.271
322 H PHE 44 HN PHE 44 -11.780 29.719 13.572
323 HA PHE 44 HA PHE 44 -11.130 27.033 14.521
324 HB2 PHE 44 HB2 PHE 44 -13.468 27.547 14.183
325 HB3 PHE 44 HB1 PHE 44 -13.166 28.039 12.517
326 HD1 PHE 44 HD2 PHE 44 -12.855 25.127 14.845
327 HD2 PHE 44 HD1 PHE 44 -13.234 26.445 10.773
328 HE1 PHE 44 HE2 PHE 44 -13.123 22.775 14.107
329 HE2 PHE 44 HE1 PHE 44 -13.504 24.092 10.037
330 HZ PHE 44 HZ PHE 44 -13.448 22.258 11.704
331 H TYR 45 HN TYR 45 -11.606 28.271 11.202
332 HA TYR 45 HA TYR 45 -10.244 26.283 9.870
333 HB2 TYR 45 HB2 TYR 45 -10.978 29.096 9.282
334 HB3 TYR 45 HB1 TYR 45 -9.669 28.459 8.291
335 HD1 TYR 45 HD1 TYR 45 -10.018 26.519 6.827
336 HD2 TYR 45 HD2 TYR 45 -13.248 28.210 9.098
337 HE1 TYR 45 HE1 TYR 45 -11.652 25.292 5.421
338 HE2 TYR 45 HE2 TYR 45 -14.880 26.984 7.693
339 HH TYR 45 HH TYR 45 -14.549 24.588 6.162
340 H GLY 46 HN GLY 46 -8.871 29.195 11.370
341 HA2 GLY 46 HA2 GLY 46 -6.315 29.263 10.458
342 HA3 GLY 46 HA1 GLY 46 -6.706 29.516 12.153
343 H VAL 47 HN VAL 47 -7.770 26.695 12.296
344 HA VAL 47 HA VAL 47 -5.257 25.447 13.027
345 HB VAL 47 HB VAL 47 -8.068 24.325 13.114
346 HG11 VAL 47 HG11 VAL 47 -7.000 22.856 14.882
347 HG12 VAL 47 HG12 VAL 47 -5.437 23.486 14.366
348 HG13 VAL 47 HG13 VAL 47 -6.427 22.557 13.243
349 HG21 VAL 47 HG21 VAL 47 -7.672 26.450 14.445
350 HG22 VAL 47 HG22 VAL 47 -6.448 25.566 15.356
351 HG23 VAL 47 HG23 VAL 47 -8.133 25.048 15.413
352 H TRP 48 HN TRP 48 -4.438 25.460 10.788
353 HA TRP 48 HA TRP 48 -5.584 23.378 9.049
354 HB2 TRP 48 HB2 TRP 48 -4.100 25.874 8.618
355 HB3 TRP 48 HB1 TRP 48 -3.408 24.534 7.708
356 HD1 TRP 48 HD1 TRP 48 -5.546 22.959 6.509
357 HE1 TRP 48 HE1 TRP 48 -7.411 23.911 5.004
358 HE3 TRP 48 HE3 TRP 48 -5.418 27.860 7.941
359 HZ2 TRP 48 HZ2 TRP 48 -8.682 26.420 4.477
360 HZ3 TRP 48 HZ3 TRP 48 -6.965 29.507 6.924
361 HH2 TRP 48 HH2 TRP 48 -8.595 28.794 5.196
362 HA PRO 49 HA PRO 49 -0.834 22.218 9.800
363 HB2 PRO 49 HB2 PRO 49 -0.875 22.840 12.729
364 HB3 PRO 49 HB1 PRO 49 0.454 23.000 11.565
365 HG2 PRO 49 HG2 PRO 49 -0.865 25.137 12.444
366 HG3 PRO 49 HG1 PRO 49 -0.324 25.025 10.760
367 HD2 PRO 49 HD2 PRO 49 -3.078 24.689 11.882
368 HD3 PRO 49 HD1 PRO 49 -2.579 25.394 10.328
369 H LEU 50 HN LEU 50 -2.913 21.928 12.726
370 HA LEU 50 HA LEU 50 -2.357 19.178 13.130
371 HB2 LEU 50 HB2 LEU 50 -4.419 21.102 14.183
372 HB3 LEU 50 HB1 LEU 50 -4.535 19.382 14.561
373 HG LEU 50 HG LEU 50 -2.272 19.409 15.506
374 HD11 LEU 50 HD11 LEU 50 -2.346 22.284 14.575
375 HD12 LEU 50 HD12 LEU 50 -1.146 21.045 14.202
376 HD13 LEU 50 HD13 LEU 50 -1.226 21.734 15.823
377 HD21 LEU 50 HD21 LEU 50 -2.747 20.733 17.486
378 HD22 LEU 50 HD22 LEU 50 -4.263 20.034 16.915
379 HD23 LEU 50 HD23 LEU 50 -3.896 21.729 16.593
380 H LEU 51 HN LEU 51 -4.740 20.882 11.215
381 HA LEU 51 HA LEU 51 -6.627 18.829 10.909
382 HB2 LEU 51 HB2 LEU 51 -6.536 21.389 10.083
383 HB3 LEU 51 HB1 LEU 51 -6.029 20.630 8.581
384 HG LEU 51 HG LEU 51 -8.436 20.868 8.522
385 HD11 LEU 51 HD11 LEU 51 -8.010 17.968 9.224
386 HD12 LEU 51 HD12 LEU 51 -7.289 18.672 7.774
387 HD13 LEU 51 HD13 LEU 51 -9.039 18.656 7.974
388 HD21 LEU 51 HD21 LEU 51 -9.103 19.072 10.770
389 HD22 LEU 51 HD22 LEU 51 -9.809 20.621 10.314
390 HD23 LEU 51 HD23 LEU 51 -8.349 20.576 11.293
391 H LEU 52 HN LEU 52 -3.711 19.583 9.023
392 HA LEU 52 HA LEU 52 -4.114 17.343 7.238
393 HB2 LEU 52 HB2 LEU 52 -2.750 19.674 6.951
394 HB3 LEU 52 HB1 LEU 52 -1.417 18.619 7.417
395 HG LEU 52 HG LEU 52 -3.359 18.119 5.140
396 HD11 LEU 52 HD11 LEU 52 -1.406 18.505 3.700
397 HD12 LEU 52 HD12 LEU 52 -0.411 18.831 5.118
398 HD13 LEU 52 HD13 LEU 52 -1.728 19.925 4.694
399 HD21 LEU 52 HD21 LEU 52 -2.730 15.979 5.893
400 HD22 LEU 52 HD22 LEU 52 -1.101 16.503 6.329
401 HD23 LEU 52 HD23 LEU 52 -1.549 16.312 4.632
402 H LEU 53 HN LEU 53 -2.306 18.014 10.166
403 HA LEU 53 HA LEU 53 -0.594 15.760 10.077
404 HB2 LEU 53 HB2 LEU 53 -0.449 17.867 11.567
405 HB3 LEU 53 HB1 LEU 53 -1.597 17.040 12.612
406 HG LEU 53 HG LEU 53 0.015 15.052 12.584
407 HD11 LEU 53 HD11 LEU 53 1.710 17.147 11.226
408 HD12 LEU 53 HD12 LEU 53 1.536 15.435 10.835
409 HD13 LEU 53 HD13 LEU 53 2.463 15.926 12.244
410 HD21 LEU 53 HD21 LEU 53 1.042 17.621 13.829
411 HD22 LEU 53 HD22 LEU 53 1.351 15.978 14.392
412 HD23 LEU 53 HD23 LEU 53 -0.274 16.651 14.491
413 H LEU 54 HN LEU 54 -3.410 16.277 12.190
414 HA LEU 54 HA LEU 54 -3.636 13.665 13.124
415 HB2 LEU 54 HB2 LEU 54 -4.911 15.825 13.847
416 HB3 LEU 54 HB1 LEU 54 -6.071 15.365 12.608
417 HG LEU 54 HG LEU 54 -6.132 13.049 13.735
418 HD11 LEU 54 HD11 LEU 54 -4.560 14.630 15.768
419 HD12 LEU 54 HD12 LEU 54 -4.306 12.976 15.207
420 HD13 LEU 54 HD13 LEU 54 -5.638 13.342 16.294
421 HD21 LEU 54 HD21 LEU 54 -7.939 14.775 13.895
422 HD22 LEU 54 HD22 LEU 54 -7.149 15.411 15.342
423 HD23 LEU 54 HD23 LEU 54 -7.812 13.778 15.344
424 H LEU 55 HN LEU 55 -4.053 14.749 9.969
425 HA LEU 55 HA LEU 55 -6.124 12.916 9.202
426 HB2 LEU 55 HB2 LEU 55 -4.843 15.145 8.037
427 HB3 LEU 55 HB1 LEU 55 -4.407 13.798 6.991
428 HG LEU 55 HG LEU 55 -6.484 14.837 6.207
429 HD11 LEU 55 HD11 LEU 55 -7.550 12.854 5.731
430 HD12 LEU 55 HD12 LEU 55 -7.528 12.304 7.405
431 HD13 LEU 55 HD13 LEU 55 -6.072 12.182 6.416
432 HD21 LEU 55 HD21 LEU 55 -8.172 13.988 8.487
433 HD22 LEU 55 HD22 LEU 55 -8.190 15.492 7.570
434 HD23 LEU 55 HD23 LEU 55 -7.046 15.287 8.888
435 H ALA 56 HN ALA 56 -2.777 13.042 7.963
436 HA ALA 56 HA ALA 56 -2.808 10.115 7.679
437 HB1 ALA 56 HB1 ALA 56 -1.006 12.268 6.559
438 HB2 ALA 56 HB2 ALA 56 -2.167 11.270 5.683
439 HB3 ALA 56 HB3 ALA 56 -0.704 10.542 6.347
440 H LEU 57 HN LEU 57 -1.983 12.152 10.085
441 HA LEU 57 HA LEU 57 0.245 10.418 10.987
442 HB2 LEU 57 HB2 LEU 57 0.228 13.332 10.648
443 HB3 LEU 57 HB1 LEU 57 0.685 12.861 12.282
444 HG LEU 57 HG LEU 57 2.661 13.049 10.792
445 HD11 LEU 57 HD11 LEU 57 2.105 11.009 12.599
446 HD12 LEU 57 HD12 LEU 57 3.686 11.367 11.913
447 HD13 LEU 57 HD13 LEU 57 2.670 10.126 11.181
448 HD21 LEU 57 HD21 LEU 57 2.872 11.945 8.777
449 HD22 LEU 57 HD22 LEU 57 1.118 12.104 8.798
450 HD23 LEU 57 HD23 LEU 57 1.875 10.587 9.288
451 HA PRO 58 HA PRO 58 -3.161 10.413 14.097
452 HB2 PRO 58 HB2 PRO 58 -3.193 7.701 14.539
453 HB3 PRO 58 HB1 PRO 58 -4.094 8.485 13.227
454 HG2 PRO 58 HG2 PRO 58 -1.542 6.967 13.134
455 HG3 PRO 58 HG1 PRO 58 -2.847 7.060 11.941
456 HD2 PRO 58 HD2 PRO 58 -0.443 8.451 11.773
457 HD3 PRO 58 HD1 PRO 58 -1.927 8.902 10.908
458 HA PRO 59 HA PRO 59 -0.870 10.426 17.899
459 HB2 PRO 59 HB2 PRO 59 -2.514 8.077 18.802
460 HB3 PRO 59 HB1 PRO 59 -2.161 9.594 19.652
461 HG2 PRO 59 HG2 PRO 59 -4.524 9.135 18.453
462 HG3 PRO 59 HG1 PRO 59 -3.803 10.751 18.542
463 HD2 PRO 59 HD2 PRO 59 -4.124 8.987 16.182
464 HD3 PRO 59 HD1 PRO 59 -3.865 10.742 16.250
465 H ARG 60 HN ARG 60 -1.497 7.231 16.493
466 HA ARG 60 HA ARG 60 0.396 5.668 17.731
467 HB2 ARG 60 HB2 ARG 60 -0.548 5.731 14.865
468 HB3 ARG 60 HB1 ARG 60 0.587 4.513 15.444
469 HG2 ARG 60 HG2 ARG 60 -0.978 3.624 16.995
470 HG3 ARG 60 HG1 ARG 60 -2.038 5.023 16.846
471 HD2 ARG 60 HD2 ARG 60 -2.961 4.281 14.869
472 HD3 ARG 60 HD1 ARG 60 -1.477 3.496 14.333
473 HE ARG 60 HE ARG 60 -3.588 2.295 15.915
474 HH11 ARG 60 HH21 ARG 60 -0.240 2.311 15.038
475 HH12 ARG 60 HH22 ARG 60 0.007 0.631 15.383
476 HH21 ARG 60 HH11 ARG 60 -3.272 0.080 16.368
477 HH22 ARG 60 HH12 ARG 60 -1.710 -0.631 16.136
478 H ALA 61 HN ALA 61 0.888 7.926 15.026
479 HA ALA 61 HA ALA 61 3.808 7.499 15.203
480 HB1 ALA 61 HB1 ALA 61 3.758 8.937 13.071
481 HB2 ALA 61 HB2 ALA 61 2.014 8.669 13.083
482 HB3 ALA 61 HB3 ALA 61 3.118 7.299 12.966
483 H TYR 62 HN TYR 62 5.114 9.549 14.819
484 HA TYR 62 HA TYR 62 4.354 11.480 16.849
485 HB2 TYR 62 HB2 TYR 62 6.668 10.688 16.733
486 HB3 TYR 62 HB1 TYR 62 6.811 11.304 15.087
487 HD1 TYR 62 HD1 TYR 62 5.884 12.417 18.544
488 HD2 TYR 62 HD2 TYR 62 7.590 13.497 14.752
489 HE1 TYR 62 HE1 TYR 62 6.481 14.647 19.449
490 HE2 TYR 62 HE2 TYR 62 8.186 15.728 15.657
491 HH TYR 62 HH TYR 62 8.612 16.761 17.866
492 H ALA 63 HN ALA 63 6.042 12.423 13.926
493 HA ALA 63 HA ALA 63 3.779 13.782 12.764
494 HB1 ALA 63 HB1 ALA 63 5.989 15.424 14.024
495 HB2 ALA 63 HB2 ALA 63 4.326 15.327 14.602
496 HB3 ALA 63 HB3 ALA 63 4.673 16.055 13.034
Start of MODEL 7
1 H1 ALA 1 HT1 ALA 1 4.975 6.872 7.690
2 H2 ALA 1 HT2 ALA 1 6.503 6.944 8.429
3 H3 ALA 1 HT3 ALA 1 5.233 6.101 9.179
4 HA ALA 1 HA ALA 1 6.684 5.363 6.705
5 HB1 ALA 1 HB1 ALA 1 7.680 4.781 8.935
6 HB2 ALA 1 HB2 ALA 1 7.269 3.370 7.958
7 HB3 ALA 1 HB3 ALA 1 6.222 3.855 9.293
8 H LEU 2 HN LEU 2 5.679 2.604 7.474
9 HA LEU 2 HA LEU 2 3.478 2.497 5.691
10 HB2 LEU 2 HB2 LEU 2 4.451 0.473 7.728
11 HB3 LEU 2 HB1 LEU 2 3.276 0.142 6.457
12 HG LEU 2 HG LEU 2 6.012 1.258 5.817
13 HD11 LEU 2 HD11 LEU 2 6.755 -1.048 5.386
14 HD12 LEU 2 HD12 LEU 2 5.207 -1.666 5.967
15 HD13 LEU 2 HD13 LEU 2 6.306 -0.850 7.079
16 HD21 LEU 2 HD21 LEU 2 5.509 0.022 3.645
17 HD22 LEU 2 HD22 LEU 2 4.470 1.403 3.968
18 HD23 LEU 2 HD23 LEU 2 3.876 -0.232 4.254
19 H GLU 3 HN GLU 3 3.759 2.927 9.118
20 HA GLU 3 HA GLU 3 1.159 2.198 9.919
21 HB2 GLU 3 HB2 GLU 3 1.572 3.714 11.854
22 HB3 GLU 3 HB1 GLU 3 2.903 2.594 11.561
23 HG2 GLU 3 HG2 GLU 3 4.089 4.368 10.292
24 HG3 GLU 3 HG1 GLU 3 2.776 5.486 10.657
25 H ASN 4 HN ASN 4 2.039 4.514 7.727
26 HA ASN 4 HA ASN 4 -0.339 6.208 8.302
27 HB2 ASN 4 HB2 ASN 4 2.221 6.887 6.836
28 HB3 ASN 4 HB1 ASN 4 0.811 7.940 6.935
29 HD21 ASN 4 HD21 ASN 4 0.405 6.761 9.815
30 HD22 ASN 4 HD22 ASN 4 1.494 7.667 10.748
31 H LEU 5 HN LEU 5 0.757 3.761 6.357
32 HA LEU 5 HA LEU 5 -0.809 4.655 4.000
33 HB2 LEU 5 HB2 LEU 5 1.498 2.762 4.369
34 HB3 LEU 5 HB1 LEU 5 0.402 2.525 3.008
35 HG LEU 5 HG LEU 5 0.802 4.831 2.260
36 HD11 LEU 5 HD11 LEU 5 2.852 5.967 3.464
37 HD12 LEU 5 HD12 LEU 5 2.382 4.943 4.820
38 HD13 LEU 5 HD13 LEU 5 1.242 6.115 4.163
39 HD21 LEU 5 HD21 LEU 5 2.321 2.913 1.582
40 HD22 LEU 5 HD22 LEU 5 3.450 3.466 2.818
41 HD23 LEU 5 HD23 LEU 5 3.052 4.513 1.458
42 H VAL 6 HN VAL 6 -0.045 1.432 5.324
43 HA VAL 6 HA VAL 6 -2.281 0.107 4.481
44 HB VAL 6 HB VAL 6 -0.343 -0.933 5.652
45 HG11 VAL 6 HG11 VAL 6 -0.354 0.792 7.519
46 HG12 VAL 6 HG12 VAL 6 -0.195 -0.881 8.050
47 HG13 VAL 6 HG13 VAL 6 -1.746 -0.056 8.188
48 HG21 VAL 6 HG21 VAL 6 -2.616 -2.050 5.336
49 HG22 VAL 6 HG22 VAL 6 -2.960 -1.622 7.013
50 HG23 VAL 6 HG23 VAL 6 -1.621 -2.707 6.635
51 H VAL 7 HN VAL 7 -2.006 2.259 7.262
52 HA VAL 7 HA VAL 7 -4.506 1.609 8.446
53 HB VAL 7 HB VAL 7 -4.216 3.635 9.737
54 HG11 VAL 7 HG11 VAL 7 -2.751 1.711 10.274
55 HG12 VAL 7 HG12 VAL 7 -1.951 3.244 10.615
56 HG13 VAL 7 HG13 VAL 7 -1.533 2.336 9.162
57 HG21 VAL 7 HG21 VAL 7 -3.620 5.232 8.048
58 HG22 VAL 7 HG22 VAL 7 -2.189 4.308 7.589
59 HG23 VAL 7 HG23 VAL 7 -2.244 5.138 9.143
60 H LEU 8 HN LEU 8 -3.507 4.050 6.060
61 HA LEU 8 HA LEU 8 -5.945 5.452 5.947
62 HB2 LEU 8 HB2 LEU 8 -3.559 5.899 4.842
63 HB3 LEU 8 HB1 LEU 8 -4.288 5.079 3.466
64 HG LEU 8 HG LEU 8 -4.668 7.460 3.211
65 HD11 LEU 8 HD11 LEU 8 -7.014 7.444 2.867
66 HD12 LEU 8 HD12 LEU 8 -7.285 6.353 4.223
67 HD13 LEU 8 HD13 LEU 8 -6.538 5.750 2.743
68 HD21 LEU 8 HD21 LEU 8 -5.199 8.892 4.918
69 HD22 LEU 8 HD22 LEU 8 -4.680 7.587 5.977
70 HD23 LEU 8 HD23 LEU 8 -6.389 7.794 5.613
71 H ASN 9 HN ASN 9 -4.728 2.833 3.837
72 HA ASN 9 HA ASN 9 -7.102 2.551 2.335
73 HB2 ASN 9 HB2 ASN 9 -4.957 1.629 1.587
74 HB3 ASN 9 HB1 ASN 9 -4.959 0.502 2.943
75 HD21 ASN 9 HD21 ASN 9 -6.253 -1.401 2.761
76 HD22 ASN 9 HD22 ASN 9 -7.162 -1.772 1.376
77 H ALA 10 HN ALA 10 -5.907 0.851 5.212
78 HA ALA 10 HA ALA 10 -8.107 -0.922 5.454
79 HB1 ALA 10 HB1 ALA 10 -6.270 0.100 7.636
80 HB2 ALA 10 HB2 ALA 10 -5.921 -1.271 6.582
81 HB3 ALA 10 HB3 ALA 10 -7.279 -1.346 7.705
82 H ALA 11 HN ALA 11 -7.492 2.343 6.568
83 HA ALA 11 HA ALA 11 -9.625 2.542 8.419
84 HB1 ALA 11 HB1 ALA 11 -9.394 5.028 7.974
85 HB2 ALA 11 HB2 ALA 11 -8.144 4.617 6.799
86 HB3 ALA 11 HB3 ALA 11 -7.923 4.212 8.502
87 H SER 12 HN SER 12 -9.407 3.065 4.932
88 HA SER 12 HA SER 12 -11.791 4.348 4.411
89 HB2 SER 12 HB2 SER 12 -10.107 3.754 2.687
90 HB3 SER 12 HB1 SER 12 -10.606 2.068 2.807
91 HG SER 12 HG SER 12 -12.378 4.207 2.230
92 H VAL 13 HN VAL 13 -11.239 1.027 5.365
93 HA VAL 13 HA VAL 13 -14.027 0.270 4.885
94 HB VAL 13 HB VAL 13 -11.740 -1.312 6.087
95 HG11 VAL 13 HG11 VAL 13 -13.248 -3.244 5.536
96 HG12 VAL 13 HG12 VAL 13 -14.518 -2.083 5.151
97 HG13 VAL 13 HG13 VAL 13 -13.891 -2.191 6.796
98 HG21 VAL 13 HG21 VAL 13 -12.915 -1.228 3.290
99 HG22 VAL 13 HG22 VAL 13 -11.750 -2.429 3.848
100 HG23 VAL 13 HG23 VAL 13 -11.290 -0.728 3.760
101 H ALA 14 HN ALA 14 -11.771 0.497 7.640
102 HA ALA 14 HA ALA 14 -13.692 -0.075 9.639
103 HB1 ALA 14 HB1 ALA 14 -11.155 -0.106 9.867
104 HB2 ALA 14 HB2 ALA 14 -12.044 0.615 11.207
105 HB3 ALA 14 HB3 ALA 14 -11.244 1.648 10.024
106 H GLY 15 HN GLY 15 -12.364 3.026 8.503
107 HA2 GLY 15 HA2 GLY 15 -13.955 4.870 8.098
108 HA3 GLY 15 HA1 GLY 15 -14.771 4.394 9.585
109 H ALA 16 HN ALA 16 -11.603 3.920 10.224
110 HA ALA 16 HA ALA 16 -11.377 6.082 12.014
111 HB1 ALA 16 HB1 ALA 16 -10.091 4.033 12.318
112 HB2 ALA 16 HB2 ALA 16 -8.991 5.403 12.185
113 HB3 ALA 16 HB3 ALA 16 -9.224 4.324 10.810
114 H HIS 17 HN HIS 17 -8.494 5.986 10.286
115 HA HIS 17 HA HIS 17 -8.209 8.654 9.799
116 HB2 HIS 17 HB2 HIS 17 -7.215 6.445 7.981
117 HB3 HIS 17 HB1 HIS 17 -6.562 8.079 8.083
118 HD2 HIS 17 HD2 HIS 17 -4.568 8.335 9.997
119 HE1 HIS 17 HE1 HIS 17 -5.416 4.825 12.184
120 HE2 HIS 17 HE2 HIS 17 -3.822 6.791 11.966
121 H GLY 18 HN GLY 18 -10.452 6.612 8.272
122 HA2 GLY 18 HA2 GLY 18 -10.662 7.883 5.725
123 HA3 GLY 18 HA1 GLY 18 -11.888 6.874 6.487
124 H ILE 19 HN ILE 19 -12.398 8.256 8.794
125 HA ILE 19 HA ILE 19 -14.345 10.076 8.133
126 HB ILE 19 HB ILE 19 -13.899 9.095 10.433
127 HG12 ILE 19 HG12 ILE 19 -14.306 12.101 10.386
128 HG13 ILE 19 HG11 ILE 19 -15.554 10.942 9.924
129 HG21 ILE 19 HG21 ILE 19 -12.314 10.080 11.877
130 HG22 ILE 19 HG22 ILE 19 -12.153 11.521 10.873
131 HG23 ILE 19 HG23 ILE 19 -11.449 9.998 10.345
132 HD11 ILE 19 HD11 ILE 19 -15.445 9.908 12.149
133 HD12 ILE 19 HD12 ILE 19 -15.787 11.632 12.292
134 HD13 ILE 19 HD13 ILE 19 -14.163 11.026 12.617
135 H LEU 20 HN LEU 20 -10.919 10.569 8.189
136 HA LEU 20 HA LEU 20 -10.920 13.384 8.455
137 HB2 LEU 20 HB2 LEU 20 -8.857 12.060 8.746
138 HB3 LEU 20 HB1 LEU 20 -8.921 11.582 7.059
139 HG LEU 20 HG LEU 20 -7.317 13.499 7.651
140 HD11 LEU 20 HD11 LEU 20 -7.420 14.190 5.490
141 HD12 LEU 20 HD12 LEU 20 -9.103 14.694 5.613
142 HD13 LEU 20 HD13 LEU 20 -8.710 13.006 5.314
143 HD21 LEU 20 HD21 LEU 20 -8.153 15.657 8.121
144 HD22 LEU 20 HD22 LEU 20 -9.139 14.604 9.127
145 HD23 LEU 20 HD23 LEU 20 -9.785 15.228 7.615
146 H SER 21 HN SER 21 -10.981 11.241 5.642
147 HA SER 21 HA SER 21 -10.783 13.095 3.601
148 HB2 SER 21 HB2 SER 21 -10.818 10.808 2.984
149 HB3 SER 21 HB1 SER 21 -12.355 10.529 3.800
150 HG SER 21 HG SER 21 -13.163 12.185 2.240
151 H PHE 22 HN PHE 22 -13.674 12.132 5.428
152 HA PHE 22 HA PHE 22 -15.487 13.724 3.944
153 HB2 PHE 22 HB2 PHE 22 -15.529 12.126 6.409
154 HB3 PHE 22 HB1 PHE 22 -16.556 13.550 6.535
155 HD1 PHE 22 HD1 PHE 22 -18.287 13.978 4.731
156 HD2 PHE 22 HD2 PHE 22 -16.194 10.244 5.099
157 HE1 PHE 22 HE1 PHE 22 -20.018 12.872 3.341
158 HE2 PHE 22 HE2 PHE 22 -17.925 9.137 3.709
159 HZ PHE 22 HZ PHE 22 -19.836 10.452 2.831
160 H LEU 23 HN LEU 23 -13.709 14.394 6.993
161 HA LEU 23 HA LEU 23 -14.777 16.864 7.573
162 HB2 LEU 23 HB2 LEU 23 -12.897 15.328 8.729
163 HB3 LEU 23 HB1 LEU 23 -11.827 16.491 7.954
164 HG LEU 23 HG LEU 23 -14.088 17.141 9.870
165 HD11 LEU 23 HD11 LEU 23 -12.119 16.243 10.998
166 HD12 LEU 23 HD12 LEU 23 -12.217 17.980 11.288
167 HD13 LEU 23 HD13 LEU 23 -11.071 17.345 10.107
168 HD21 LEU 23 HD21 LEU 23 -12.297 18.861 8.152
169 HD22 LEU 23 HD22 LEU 23 -12.946 19.481 9.671
170 HD23 LEU 23 HD23 LEU 23 -14.041 18.969 8.390
171 H VAL 24 HN VAL 24 -11.976 16.177 5.430
172 HA VAL 24 HA VAL 24 -11.478 18.931 4.847
173 HB VAL 24 HB VAL 24 -9.684 17.339 4.592
174 HG11 VAL 24 HG11 VAL 24 -9.775 15.539 2.930
175 HG12 VAL 24 HG12 VAL 24 -11.410 16.021 2.479
176 HG13 VAL 24 HG13 VAL 24 -11.091 15.377 4.086
177 HG21 VAL 24 HG21 VAL 24 -9.892 19.291 2.966
178 HG22 VAL 24 HG22 VAL 24 -10.541 18.137 1.800
179 HG23 VAL 24 HG23 VAL 24 -8.897 17.945 2.410
180 H PHE 25 HN PHE 25 -13.313 16.351 3.257
181 HA PHE 25 HA PHE 25 -13.939 17.826 0.918
182 HB2 PHE 25 HB2 PHE 25 -14.728 15.266 2.132
183 HB3 PHE 25 HB1 PHE 25 -16.058 16.024 1.270
184 HD1 PHE 25 HD2 PHE 25 -15.772 16.670 -1.138
185 HD2 PHE 25 HD1 PHE 25 -12.866 14.299 0.956
186 HE1 PHE 25 HE2 PHE 25 -14.798 15.954 -3.303
187 HE2 PHE 25 HE1 PHE 25 -11.891 13.582 -1.208
188 HZ PHE 25 HZ PHE 25 -12.856 14.410 -3.337
189 H PHE 26 HN PHE 26 -15.525 17.520 4.072
190 HA PHE 26 HA PHE 26 -17.837 19.032 3.287
191 HB2 PHE 26 HB2 PHE 26 -17.882 17.362 5.121
192 HB3 PHE 26 HB1 PHE 26 -16.806 18.397 6.062
193 HD1 PHE 26 HD1 PHE 26 -20.194 18.073 4.616
194 HD2 PHE 26 HD2 PHE 26 -17.587 20.465 7.053
195 HE1 PHE 26 HE1 PHE 26 -22.140 19.393 5.402
196 HE2 PHE 26 HE2 PHE 26 -19.533 21.785 7.840
197 HZ PHE 26 HZ PHE 26 -21.810 21.249 7.014
198 H SER 27 HN SER 27 -14.952 19.711 5.274
199 HA SER 27 HA SER 27 -15.540 22.355 5.936
200 HB2 SER 27 HB2 SER 27 -12.859 21.047 5.435
201 HB3 SER 27 HB1 SER 27 -13.071 22.629 6.180
202 HG SER 27 HG SER 27 -13.168 21.428 7.925
203 H ALA 28 HN ALA 28 -13.916 21.025 3.061
204 HA ALA 28 HA ALA 28 -13.305 23.559 1.911
205 HB1 ALA 28 HB1 ALA 28 -12.114 21.530 1.241
206 HB2 ALA 28 HB2 ALA 28 -12.919 22.247 -0.154
207 HB3 ALA 28 HB3 ALA 28 -13.613 20.830 0.633
208 H ALA 29 HN ALA 29 -16.001 21.287 1.627
209 HA ALA 29 HA ALA 29 -17.356 22.529 -0.495
210 HB1 ALA 29 HB1 ALA 29 -19.321 21.324 0.269
211 HB2 ALA 29 HB2 ALA 29 -18.584 21.058 1.848
212 HB3 ALA 29 HB3 ALA 29 -17.909 20.276 0.419
213 H TRP 30 HN TRP 30 -17.459 23.105 3.001
214 HA TRP 30 HA TRP 30 -19.619 24.812 3.187
215 HB2 TRP 30 HB2 TRP 30 -17.840 23.960 4.987
216 HB3 TRP 30 HB1 TRP 30 -17.112 25.536 4.687
217 HD1 TRP 30 HD1 TRP 30 -18.017 27.391 6.178
218 HE1 TRP 30 HE1 TRP 30 -20.210 27.834 7.457
219 HE3 TRP 30 HE3 TRP 30 -20.693 23.269 4.789
220 HZ2 TRP 30 HZ2 TRP 30 -22.764 26.602 7.841
221 HZ3 TRP 30 HZ3 TRP 30 -23.002 22.930 5.625
222 HH2 TRP 30 HH2 TRP 30 -24.039 24.588 7.147
223 H TYR 31 HN TYR 31 -16.425 25.422 1.892
224 HA TYR 31 HA TYR 31 -16.463 28.224 1.828
225 HB2 TYR 31 HB2 TYR 31 -14.574 26.499 1.211
226 HB3 TYR 31 HB1 TYR 31 -15.243 26.620 -0.414
227 HD1 TYR 31 HD2 TYR 31 -15.506 28.970 -1.441
228 HD2 TYR 31 HD1 TYR 31 -13.138 28.172 2.052
229 HE1 TYR 31 HE2 TYR 31 -14.311 31.119 -1.761
230 HE2 TYR 31 HE1 TYR 31 -11.942 30.322 1.732
231 HH TYR 31 HH TYR 31 -11.506 31.858 -0.551
232 H ILE 32 HN ILE 32 -18.124 25.858 -0.100
233 HA ILE 32 HA ILE 32 -18.704 27.456 -2.359
234 HB ILE 32 HB ILE 32 -19.023 24.875 -1.964
235 HG12 ILE 32 HG12 ILE 32 -21.063 26.510 -3.507
236 HG13 ILE 32 HG11 ILE 32 -19.459 26.065 -4.091
237 HG21 ILE 32 HG21 ILE 32 -21.861 25.744 -1.409
238 HG22 ILE 32 HG22 ILE 32 -20.744 25.416 -0.089
239 HG23 ILE 32 HG23 ILE 32 -21.149 24.139 -1.236
240 HD11 ILE 32 HD11 ILE 32 -21.762 24.210 -3.444
241 HD12 ILE 32 HD12 ILE 32 -20.117 23.640 -3.725
242 HD13 ILE 32 HD13 ILE 32 -20.996 24.465 -5.013
243 H LYS 33 HN LYS 33 -20.236 27.157 0.797
244 HA LYS 33 HA LYS 33 -22.638 28.521 0.116
245 HB2 LYS 33 HB2 LYS 33 -22.256 27.042 2.143
246 HB3 LYS 33 HB1 LYS 33 -21.349 28.375 2.846
247 HG2 LYS 33 HG2 LYS 33 -23.504 28.731 3.716
248 HG3 LYS 33 HG1 LYS 33 -23.475 29.803 2.319
249 HD2 LYS 33 HD2 LYS 33 -24.759 28.276 0.996
250 HD3 LYS 33 HD1 LYS 33 -24.539 26.970 2.159
251 HE2 LYS 33 HE2 LYS 33 -25.960 29.545 2.859
252 HE3 LYS 33 HE1 LYS 33 -26.801 28.135 2.214
253 HZ1 LYS 33 HZ1 LYS 33 -25.747 28.589 4.842
254 HZ2 LYS 33 HZ2 LYS 33 -25.248 27.104 4.185
255 HZ3 LYS 33 HZ3 LYS 33 -26.903 27.463 4.319
256 H GLY 34 HN GLY 34 -19.732 29.609 1.892
257 HA2 GLY 34 HA2 GLY 34 -18.694 31.738 1.312
258 HA3 GLY 34 HA1 GLY 34 -20.301 32.378 0.985
259 H ARG 35 HN ARG 35 -20.253 30.316 3.676
260 HA ARG 35 HA ARG 35 -20.807 32.498 5.471
261 HB2 ARG 35 HB2 ARG 35 -22.028 30.397 5.708
262 HB3 ARG 35 HB1 ARG 35 -20.517 29.524 5.967
263 HG2 ARG 35 HG2 ARG 35 -20.112 30.675 8.041
264 HG3 ARG 35 HG1 ARG 35 -21.438 31.797 7.740
265 HD2 ARG 35 HD2 ARG 35 -21.819 28.809 8.012
266 HD3 ARG 35 HD1 ARG 35 -21.962 29.926 9.367
267 HE ARG 35 HE ARG 35 -23.909 29.499 7.308
268 HH11 ARG 35 HH21 ARG 35 -22.471 31.857 9.394
269 HH12 ARG 35 HH22 ARG 35 -23.872 32.872 9.443
270 HH21 ARG 35 HH11 ARG 35 -25.754 30.827 7.371
271 HH22 ARG 35 HH12 ARG 35 -25.732 32.290 8.299
272 H LEU 36 HN LEU 36 -17.999 30.874 4.442
273 HA LEU 36 HA LEU 36 -16.453 31.058 6.837
274 HB2 LEU 36 HB2 LEU 36 -15.981 29.612 4.765
275 HB3 LEU 36 HB1 LEU 36 -15.344 31.083 4.033
276 HG LEU 36 HG LEU 36 -13.976 31.237 6.329
277 HD11 LEU 36 HD11 LEU 36 -15.171 29.149 7.184
278 HD12 LEU 36 HD12 LEU 36 -13.410 29.110 7.273
279 HD13 LEU 36 HD13 LEU 36 -14.249 28.241 5.988
280 HD21 LEU 36 HD21 LEU 36 -12.941 31.089 4.115
281 HD22 LEU 36 HD22 LEU 36 -13.279 29.360 4.047
282 HD23 LEU 36 HD23 LEU 36 -12.127 29.987 5.224
283 H ALA 37 HN ALA 37 -17.704 33.449 6.719
284 HA ALA 37 HA ALA 37 -16.130 35.458 5.409
285 HB1 ALA 37 HB1 ALA 37 -18.630 35.319 6.869
286 HB2 ALA 37 HB2 ALA 37 -18.074 36.579 5.769
287 HB3 ALA 37 HB3 ALA 37 -17.669 36.662 7.482
288 HA PRO 38 HA PRO 38 -13.036 36.205 8.445
289 HB2 PRO 38 HB2 PRO 38 -12.892 38.957 8.522
290 HB3 PRO 38 HB1 PRO 38 -12.273 37.982 7.173
291 HG2 PRO 38 HG2 PRO 38 -14.850 39.477 7.401
292 HG3 PRO 38 HG1 PRO 38 -13.753 39.325 6.015
293 HD2 PRO 38 HD2 PRO 38 -16.055 37.867 6.229
294 HD3 PRO 38 HD1 PRO 38 -14.611 37.255 5.393
295 H GLY 39 HN GLY 39 -12.557 37.403 10.545
296 HA2 GLY 39 HA2 GLY 39 -13.440 38.612 12.466
297 HA3 GLY 39 HA1 GLY 39 -15.025 37.938 12.105
298 H ALA 40 HN ALA 40 -15.438 35.734 12.582
299 HA ALA 40 HA ALA 40 -13.953 34.759 14.884
300 HB1 ALA 40 HB1 ALA 40 -16.378 34.638 14.945
301 HB2 ALA 40 HB2 ALA 40 -15.714 33.003 14.936
302 HB3 ALA 40 HB3 ALA 40 -16.398 33.686 13.460
303 H ALA 41 HN ALA 41 -14.757 33.589 11.628
304 HA ALA 41 HA ALA 41 -13.135 31.223 11.887
305 HB1 ALA 41 HB1 ALA 41 -13.750 30.746 9.636
306 HB2 ALA 41 HB2 ALA 41 -14.158 32.431 9.314
307 HB3 ALA 41 HB3 ALA 41 -15.173 31.467 10.387
308 H TYR 42 HN TYR 42 -12.247 34.333 11.743
309 HA TYR 42 HA TYR 42 -10.074 34.070 9.798
310 HB2 TYR 42 HB2 TYR 42 -11.105 36.208 9.765
311 HB3 TYR 42 HB1 TYR 42 -11.076 36.342 11.521
312 HD1 TYR 42 HD1 TYR 42 -8.951 36.324 8.464
313 HD2 TYR 42 HD2 TYR 42 -9.139 37.125 12.679
314 HE1 TYR 42 HE1 TYR 42 -6.724 37.411 8.358
315 HE2 TYR 42 HE2 TYR 42 -6.912 38.211 12.573
316 HH TYR 42 HH TYR 42 -5.297 38.960 11.222
317 H ALA 43 HN ALA 43 -10.486 34.533 13.303
318 HA ALA 43 HA ALA 43 -7.731 34.577 13.939
319 HB1 ALA 43 HB1 ALA 43 -10.123 33.802 15.621
320 HB2 ALA 43 HB2 ALA 43 -9.392 35.402 15.505
321 HB3 ALA 43 HB3 ALA 43 -8.498 34.077 16.251
322 H PHE 44 HN PHE 44 -9.954 31.981 14.910
323 HA PHE 44 HA PHE 44 -7.883 30.059 15.181
324 HB2 PHE 44 HB2 PHE 44 -10.892 29.897 15.093
325 HB3 PHE 44 HB1 PHE 44 -9.914 28.432 15.161
326 HD1 PHE 44 HD2 PHE 44 -10.133 31.794 16.829
327 HD2 PHE 44 HD1 PHE 44 -9.365 27.590 17.271
328 HE1 PHE 44 HE2 PHE 44 -9.840 32.105 19.272
329 HE2 PHE 44 HE1 PHE 44 -9.073 27.901 19.714
330 HZ PHE 44 HZ PHE 44 -9.311 30.158 20.714
331 H TYR 45 HN TYR 45 -8.790 31.457 12.430
332 HA TYR 45 HA TYR 45 -9.496 29.673 10.515
333 HB2 TYR 45 HB2 TYR 45 -8.907 32.009 10.026
334 HB3 TYR 45 HB1 TYR 45 -7.207 31.643 10.298
335 HD1 TYR 45 HD1 TYR 45 -5.955 30.209 8.740
336 HD2 TYR 45 HD2 TYR 45 -10.063 31.240 8.028
337 HE1 TYR 45 HE1 TYR 45 -5.741 29.443 6.392
338 HE2 TYR 45 HE2 TYR 45 -9.848 30.475 5.680
339 HH TYR 45 HH TYR 45 -8.005 28.588 4.525
340 H GLY 46 HN GLY 46 -6.585 29.604 12.402
341 HA2 GLY 46 HA2 GLY 46 -5.285 27.641 10.653
342 HA3 GLY 46 HA1 GLY 46 -4.592 28.380 12.093
343 H VAL 47 HN VAL 47 -7.805 26.962 12.037
344 HA VAL 47 HA VAL 47 -6.851 24.816 13.851
345 HB VAL 47 HB VAL 47 -8.478 26.562 14.739
346 HG11 VAL 47 HG11 VAL 47 -10.530 25.019 13.145
347 HG12 VAL 47 HG12 VAL 47 -9.820 26.513 12.534
348 HG13 VAL 47 HG13 VAL 47 -10.743 26.525 14.037
349 HG21 VAL 47 HG21 VAL 47 -9.256 23.630 14.704
350 HG22 VAL 47 HG22 VAL 47 -9.890 24.813 15.847
351 HG23 VAL 47 HG23 VAL 47 -8.173 24.414 15.851
352 H TRP 48 HN TRP 48 -8.507 25.535 10.901
353 HA TRP 48 HA TRP 48 -9.593 22.867 10.566
354 HB2 TRP 48 HB2 TRP 48 -10.608 23.657 8.576
355 HB3 TRP 48 HB1 TRP 48 -10.680 25.020 9.686
356 HD1 TRP 48 HD1 TRP 48 -9.509 27.203 8.982
357 HE1 TRP 48 HE1 TRP 48 -8.031 27.916 6.994
358 HE3 TRP 48 HE3 TRP 48 -8.770 22.667 6.755
359 HZ2 TRP 48 HZ2 TRP 48 -6.707 26.720 4.758
360 HZ3 TRP 48 HZ3 TRP 48 -7.394 22.480 4.705
361 HH2 TRP 48 HH2 TRP 48 -6.365 24.500 3.702
362 HA PRO 49 HA PRO 49 -5.937 22.581 7.501
363 HB2 PRO 49 HB2 PRO 49 -3.794 24.250 7.819
364 HB3 PRO 49 HB1 PRO 49 -5.237 24.704 6.893
365 HG2 PRO 49 HG2 PRO 49 -4.338 25.647 9.534
366 HG3 PRO 49 HG1 PRO 49 -5.445 26.408 8.380
367 HD2 PRO 49 HD2 PRO 49 -6.125 24.871 10.739
368 HD3 PRO 49 HD1 PRO 49 -7.210 25.670 9.604
369 H LEU 50 HN LEU 50 -5.378 23.065 10.902
370 HA LEU 50 HA LEU 50 -2.887 21.625 11.011
371 HB2 LEU 50 HB2 LEU 50 -3.643 23.372 12.686
372 HB3 LEU 50 HB1 LEU 50 -4.792 22.182 13.289
373 HG LEU 50 HG LEU 50 -2.720 20.606 13.500
374 HD11 LEU 50 HD11 LEU 50 -1.420 23.330 13.231
375 HD12 LEU 50 HD12 LEU 50 -1.033 21.853 12.351
376 HD13 LEU 50 HD13 LEU 50 -0.641 21.987 14.062
377 HD21 LEU 50 HD21 LEU 50 -2.137 21.701 15.731
378 HD22 LEU 50 HD22 LEU 50 -3.846 21.347 15.475
379 HD23 LEU 50 HD23 LEU 50 -3.246 22.995 15.281
380 H LEU 51 HN LEU 51 -6.246 20.901 11.917
381 HA LEU 51 HA LEU 51 -5.742 18.221 12.709
382 HB2 LEU 51 HB2 LEU 51 -8.341 19.420 11.715
383 HB3 LEU 51 HB1 LEU 51 -8.156 17.969 12.699
384 HG LEU 51 HG LEU 51 -7.291 20.747 13.552
385 HD11 LEU 51 HD11 LEU 51 -9.711 19.088 14.330
386 HD12 LEU 51 HD12 LEU 51 -9.731 20.592 13.407
387 HD13 LEU 51 HD13 LEU 51 -9.234 20.601 15.098
388 HD21 LEU 51 HD21 LEU 51 -7.339 19.460 15.842
389 HD22 LEU 51 HD22 LEU 51 -5.950 19.252 14.779
390 HD23 LEU 51 HD23 LEU 51 -7.206 18.015 14.838
391 H LEU 52 HN LEU 52 -5.472 19.596 9.730
392 HA LEU 52 HA LEU 52 -6.748 17.705 8.056
393 HB2 LEU 52 HB2 LEU 52 -5.839 20.032 7.437
394 HB3 LEU 52 HB1 LEU 52 -4.265 19.257 7.320
395 HG LEU 52 HG LEU 52 -6.478 17.875 5.842
396 HD11 LEU 52 HD11 LEU 52 -7.055 20.166 5.305
397 HD12 LEU 52 HD12 LEU 52 -6.260 19.436 3.913
398 HD13 LEU 52 HD13 LEU 52 -5.372 20.551 4.951
399 HD21 LEU 52 HD21 LEU 52 -4.107 17.126 5.780
400 HD22 LEU 52 HD22 LEU 52 -3.655 18.678 5.074
401 HD23 LEU 52 HD23 LEU 52 -4.703 17.576 4.181
402 H LEU 53 HN LEU 53 -3.511 17.864 9.488
403 HA LEU 53 HA LEU 53 -2.737 15.349 8.184
404 HB2 LEU 53 HB2 LEU 53 -1.146 17.165 10.008
405 HB3 LEU 53 HB1 LEU 53 -0.518 15.817 9.065
406 HG LEU 53 HG LEU 53 -1.916 18.201 7.820
407 HD11 LEU 53 HD11 LEU 53 1.038 17.677 8.257
408 HD12 LEU 53 HD12 LEU 53 0.093 19.015 8.908
409 HD13 LEU 53 HD13 LEU 53 0.401 18.916 7.175
410 HD21 LEU 53 HD21 LEU 53 -0.316 15.862 6.754
411 HD22 LEU 53 HD22 LEU 53 -0.557 17.327 5.808
412 HD23 LEU 53 HD23 LEU 53 -1.944 16.362 6.299
413 H LEU 54 HN LEU 54 -3.007 16.727 11.426
414 HA LEU 54 HA LEU 54 -2.256 14.657 13.040
415 HB2 LEU 54 HB2 LEU 54 -3.190 16.831 13.864
416 HB3 LEU 54 HB1 LEU 54 -4.802 16.236 13.486
417 HG LEU 54 HG LEU 54 -4.342 14.264 15.011
418 HD11 LEU 54 HD11 LEU 54 -1.820 15.853 15.453
419 HD12 LEU 54 HD12 LEU 54 -2.017 14.113 15.261
420 HD13 LEU 54 HD13 LEU 54 -2.488 14.888 16.768
421 HD21 LEU 54 HD21 LEU 54 -4.767 15.537 17.058
422 HD22 LEU 54 HD22 LEU 54 -5.663 16.248 15.716
423 HD23 LEU 54 HD23 LEU 54 -4.179 17.012 16.288
424 H LEU 55 HN LEU 55 -5.615 15.050 11.901
425 HA LEU 55 HA LEU 55 -6.492 12.501 12.723
426 HB2 LEU 55 HB2 LEU 55 -7.488 14.547 10.765
427 HB3 LEU 55 HB1 LEU 55 -8.272 12.969 10.841
428 HG LEU 55 HG LEU 55 -8.711 13.277 13.233
429 HD11 LEU 55 HD11 LEU 55 -8.239 15.603 14.182
430 HD12 LEU 55 HD12 LEU 55 -7.179 15.848 12.794
431 HD13 LEU 55 HD13 LEU 55 -6.833 14.565 13.952
432 HD21 LEU 55 HD21 LEU 55 -10.405 14.122 11.706
433 HD22 LEU 55 HD22 LEU 55 -9.517 15.631 11.496
434 HD23 LEU 55 HD23 LEU 55 -10.254 15.251 13.054
435 H ALA 56 HN ALA 56 -5.165 13.639 9.638
436 HA ALA 56 HA ALA 56 -5.562 11.254 8.172
437 HB1 ALA 56 HB1 ALA 56 -4.891 13.559 7.279
438 HB2 ALA 56 HB2 ALA 56 -4.087 12.167 6.556
439 HB3 ALA 56 HB3 ALA 56 -3.247 13.142 7.759
440 H LEU 57 HN LEU 57 -3.846 11.610 10.937
441 HA LEU 57 HA LEU 57 -2.019 9.400 10.231
442 HB2 LEU 57 HB2 LEU 57 -1.380 11.796 11.963
443 HB3 LEU 57 HB1 LEU 57 -0.334 10.395 11.764
444 HG LEU 57 HG LEU 57 -1.313 12.054 9.425
445 HD11 LEU 57 HD11 LEU 57 0.929 13.126 9.472
446 HD12 LEU 57 HD12 LEU 57 1.269 12.306 10.996
447 HD13 LEU 57 HD13 LEU 57 -0.018 13.509 10.910
448 HD21 LEU 57 HD21 LEU 57 0.881 11.023 8.464
449 HD22 LEU 57 HD22 LEU 57 -0.520 9.972 8.616
450 HD23 LEU 57 HD23 LEU 57 0.772 9.894 9.811
451 HA PRO 58 HA PRO 58 -3.882 7.372 13.666
452 HB2 PRO 58 HB2 PRO 58 -1.864 5.639 14.416
453 HB3 PRO 58 HB1 PRO 58 -2.902 5.405 12.995
454 HG2 PRO 58 HG2 PRO 58 -0.131 6.507 13.152
455 HG3 PRO 58 HG1 PRO 58 -0.850 5.418 11.953
456 HD2 PRO 58 HD2 PRO 58 -0.509 8.084 11.487
457 HD3 PRO 58 HD1 PRO 58 -1.835 7.145 10.765
458 HA PRO 59 HA PRO 59 -2.807 9.781 17.325
459 HB2 PRO 59 HB2 PRO 59 -3.556 7.258 18.775
460 HB3 PRO 59 HB1 PRO 59 -4.082 8.926 19.077
461 HG2 PRO 59 HG2 PRO 59 -5.655 7.131 17.842
462 HG3 PRO 59 HG1 PRO 59 -5.692 8.858 17.444
463 HD2 PRO 59 HD2 PRO 59 -4.614 6.599 15.845
464 HD3 PRO 59 HD1 PRO 59 -5.155 8.209 15.318
465 H ARG 60 HN ARG 60 -1.506 6.658 16.564
466 HA ARG 60 HA ARG 60 0.373 6.389 18.662
467 HB2 ARG 60 HB2 ARG 60 -0.270 4.548 17.115
468 HB3 ARG 60 HB1 ARG 60 0.594 5.371 15.818
469 HG2 ARG 60 HG2 ARG 60 2.689 5.238 17.123
470 HG3 ARG 60 HG1 ARG 60 1.824 4.408 18.417
471 HD2 ARG 60 HD2 ARG 60 1.193 2.630 16.752
472 HD3 ARG 60 HD1 ARG 60 2.244 3.423 15.583
473 HE ARG 60 HE ARG 60 3.075 1.787 17.806
474 HH11 ARG 60 HH21 ARG 60 3.904 4.403 15.699
475 HH12 ARG 60 HH22 ARG 60 5.613 4.189 15.879
476 HH21 ARG 60 HH11 ARG 60 5.313 1.500 18.047
477 HH22 ARG 60 HH12 ARG 60 6.411 2.544 17.208
478 H ALA 61 HN ALA 61 0.595 7.862 15.431
479 HA ALA 61 HA ALA 61 3.283 8.891 16.068
480 HB1 ALA 61 HB1 ALA 61 3.249 9.578 13.642
481 HB2 ALA 61 HB2 ALA 61 1.706 8.737 13.493
482 HB3 ALA 61 HB3 ALA 61 3.163 7.839 13.922
483 H TYR 62 HN TYR 62 3.391 11.152 14.578
484 HA TYR 62 HA TYR 62 1.199 12.928 15.000
485 HB2 TYR 62 HB2 TYR 62 2.310 14.373 16.695
486 HB3 TYR 62 HB1 TYR 62 1.878 12.786 17.331
487 HD1 TYR 62 HD1 TYR 62 4.658 14.932 16.183
488 HD2 TYR 62 HD2 TYR 62 3.570 11.142 17.886
489 HE1 TYR 62 HE1 TYR 62 7.031 14.517 16.774
490 HE2 TYR 62 HE2 TYR 62 5.943 10.726 18.477
491 HH TYR 62 HH TYR 62 8.220 11.525 17.602
492 H ALA 63 HN ALA 63 1.653 15.085 14.208
493 HA ALA 63 HA ALA 63 2.544 16.487 12.632
494 HB1 ALA 63 HB1 ALA 63 4.170 16.890 14.396
495 HB2 ALA 63 HB2 ALA 63 4.990 16.873 12.835
496 HB3 ALA 63 HB3 ALA 63 5.098 15.474 13.902
Start of MODEL 8
1 H1 ALA 1 HT1 ALA 1 3.645 -1.287 6.553
2 H2 ALA 1 HT2 ALA 1 2.370 -0.854 5.518
3 H3 ALA 1 HT3 ALA 1 2.964 0.263 6.653
4 HA ALA 1 HA ALA 1 5.190 -0.381 5.256
5 HB1 ALA 1 HB1 ALA 1 3.926 -1.604 3.583
6 HB2 ALA 1 HB2 ALA 1 4.454 -0.081 2.871
7 HB3 ALA 1 HB3 ALA 1 2.786 -0.270 3.412
8 H LEU 2 HN LEU 2 2.795 1.555 3.595
9 HA LEU 2 HA LEU 2 4.293 3.962 4.095
10 HB2 LEU 2 HB2 LEU 2 1.748 3.339 2.603
11 HB3 LEU 2 HB1 LEU 2 2.267 5.003 2.855
12 HG LEU 2 HG LEU 2 3.035 4.009 0.668
13 HD11 LEU 2 HD11 LEU 2 5.014 5.200 0.702
14 HD12 LEU 2 HD12 LEU 2 5.552 4.496 2.224
15 HD13 LEU 2 HD13 LEU 2 4.346 5.781 2.224
16 HD21 LEU 2 HD21 LEU 2 4.941 2.377 2.354
17 HD22 LEU 2 HD22 LEU 2 4.637 2.246 0.623
18 HD23 LEU 2 HD23 LEU 2 3.412 1.714 1.775
19 H GLU 3 HN GLU 3 3.682 5.759 5.297
20 HA GLU 3 HA GLU 3 2.249 5.227 7.684
21 HB2 GLU 3 HB2 GLU 3 4.116 6.872 7.489
22 HB3 GLU 3 HB1 GLU 3 3.057 7.907 6.532
23 HG2 GLU 3 HG2 GLU 3 1.532 8.182 8.372
24 HG3 GLU 3 HG1 GLU 3 2.361 6.945 9.316
25 H ASN 4 HN ASN 4 1.224 6.038 4.561
26 HA ASN 4 HA ASN 4 -1.287 7.285 5.501
27 HB2 ASN 4 HB2 ASN 4 -0.142 8.463 3.705
28 HB3 ASN 4 HB1 ASN 4 -0.131 7.001 2.720
29 HD21 ASN 4 HD21 ASN 4 -2.859 8.101 4.752
30 HD22 ASN 4 HD22 ASN 4 -3.924 8.362 3.455
31 H LEU 5 HN LEU 5 -0.433 4.923 2.945
32 HA LEU 5 HA LEU 5 -2.917 3.795 2.582
33 HB2 LEU 5 HB2 LEU 5 -0.325 2.240 2.567
34 HB3 LEU 5 HB1 LEU 5 -1.797 1.865 1.673
35 HG LEU 5 HG LEU 5 -0.112 4.359 1.292
36 HD11 LEU 5 HD11 LEU 5 0.995 2.314 0.467
37 HD12 LEU 5 HD12 LEU 5 0.481 3.340 -0.871
38 HD13 LEU 5 HD13 LEU 5 -0.452 1.902 -0.454
39 HD21 LEU 5 HD21 LEU 5 -1.634 4.408 -0.847
40 HD22 LEU 5 HD22 LEU 5 -2.296 4.987 0.679
41 HD23 LEU 5 HD23 LEU 5 -2.704 3.373 0.099
42 H VAL 6 HN VAL 6 -0.622 3.155 5.163
43 HA VAL 6 HA VAL 6 -1.795 0.794 6.184
44 HB VAL 6 HB VAL 6 0.444 1.638 6.830
45 HG11 VAL 6 HG11 VAL 6 -0.968 3.599 8.641
46 HG12 VAL 6 HG12 VAL 6 -0.469 4.062 7.014
47 HG13 VAL 6 HG13 VAL 6 0.731 3.541 8.188
48 HG21 VAL 6 HG21 VAL 6 -0.962 0.055 8.264
49 HG22 VAL 6 HG22 VAL 6 -1.367 1.460 9.251
50 HG23 VAL 6 HG23 VAL 6 0.310 0.933 9.116
51 H VAL 7 HN VAL 7 -2.294 4.215 7.078
52 HA VAL 7 HA VAL 7 -4.476 3.518 8.872
53 HB VAL 7 HB VAL 7 -2.966 5.310 9.519
54 HG11 VAL 7 HG11 VAL 7 -2.869 7.397 8.222
55 HG12 VAL 7 HG12 VAL 7 -3.954 6.708 7.014
56 HG13 VAL 7 HG13 VAL 7 -2.339 6.034 7.239
57 HG21 VAL 7 HG21 VAL 7 -4.621 6.916 10.139
58 HG22 VAL 7 HG22 VAL 7 -5.479 5.381 10.024
59 HG23 VAL 7 HG23 VAL 7 -5.604 6.561 8.720
60 H LEU 8 HN LEU 8 -4.044 4.756 5.636
61 HA LEU 8 HA LEU 8 -6.548 5.910 5.207
62 HB2 LEU 8 HB2 LEU 8 -4.419 5.827 3.680
63 HB3 LEU 8 HB1 LEU 8 -5.155 4.369 3.026
64 HG LEU 8 HG LEU 8 -6.505 7.082 3.177
65 HD11 LEU 8 HD11 LEU 8 -6.283 6.917 0.649
66 HD12 LEU 8 HD12 LEU 8 -5.157 5.586 0.916
67 HD13 LEU 8 HD13 LEU 8 -4.776 7.201 1.520
68 HD21 LEU 8 HD21 LEU 8 -7.367 4.351 2.223
69 HD22 LEU 8 HD22 LEU 8 -8.047 5.798 1.478
70 HD23 LEU 8 HD23 LEU 8 -8.258 5.515 3.202
71 H ASN 9 HN ASN 9 -5.653 2.763 3.779
72 HA ASN 9 HA ASN 9 -8.273 1.925 3.320
73 HB2 ASN 9 HB2 ASN 9 -5.747 0.321 3.734
74 HB3 ASN 9 HB1 ASN 9 -7.269 -0.369 3.173
75 HD21 ASN 9 HD21 ASN 9 -8.210 1.503 1.365
76 HD22 ASN 9 HD22 ASN 9 -7.095 1.722 0.105
77 H ALA 10 HN ALA 10 -6.368 1.808 6.233
78 HA ALA 10 HA ALA 10 -8.019 -0.160 7.544
79 HB1 ALA 10 HB1 ALA 10 -5.970 1.764 8.650
80 HB2 ALA 10 HB2 ALA 10 -5.672 0.098 8.163
81 HB3 ALA 10 HB3 ALA 10 -6.710 0.442 9.548
82 H ALA 11 HN ALA 11 -7.293 3.025 8.893
83 HA ALA 11 HA ALA 11 -9.632 3.281 10.353
84 HB1 ALA 11 HB1 ALA 11 -7.777 5.373 9.228
85 HB2 ALA 11 HB2 ALA 11 -7.818 4.725 10.866
86 HB3 ALA 11 HB3 ALA 11 -9.117 5.762 10.294
87 H SER 12 HN SER 12 -8.963 5.084 7.326
88 HA SER 12 HA SER 12 -11.316 6.334 6.858
89 HB2 SER 12 HB2 SER 12 -10.162 4.749 4.580
90 HB3 SER 12 HB1 SER 12 -10.818 6.379 4.575
91 HG SER 12 HG SER 12 -8.973 7.144 5.320
92 H VAL 13 HN VAL 13 -10.721 2.913 6.057
93 HA VAL 13 HA VAL 13 -13.341 2.386 5.120
94 HB VAL 13 HB VAL 13 -11.197 0.553 6.226
95 HG11 VAL 13 HG11 VAL 13 -13.901 -0.025 5.003
96 HG12 VAL 13 HG12 VAL 13 -13.247 -0.626 6.524
97 HG13 VAL 13 HG13 VAL 13 -12.597 -1.211 4.994
98 HG21 VAL 13 HG21 VAL 13 -10.855 0.012 3.855
99 HG22 VAL 13 HG22 VAL 13 -10.677 1.747 4.106
100 HG23 VAL 13 HG23 VAL 13 -12.160 1.106 3.400
101 H ALA 14 HN ALA 14 -11.781 2.036 8.283
102 HA ALA 14 HA ALA 14 -13.945 0.803 9.612
103 HB1 ALA 14 HB1 ALA 14 -11.909 2.647 10.875
104 HB2 ALA 14 HB2 ALA 14 -11.562 0.971 10.445
105 HB3 ALA 14 HB3 ALA 14 -12.801 1.335 11.645
106 H GLY 15 HN GLY 15 -13.458 4.025 8.527
107 HA2 GLY 15 HA2 GLY 15 -15.340 5.531 8.394
108 HA3 GLY 15 HA1 GLY 15 -15.921 4.894 9.929
109 H ALA 16 HN ALA 16 -13.171 4.929 11.070
110 HA ALA 16 HA ALA 16 -13.225 7.341 12.435
111 HB1 ALA 16 HB1 ALA 16 -10.932 5.484 11.776
112 HB2 ALA 16 HB2 ALA 16 -11.832 5.610 13.288
113 HB3 ALA 16 HB3 ALA 16 -10.730 6.901 12.808
114 H HIS 17 HN HIS 17 -10.251 7.007 10.727
115 HA HIS 17 HA HIS 17 -9.916 9.611 10.007
116 HB2 HIS 17 HB2 HIS 17 -8.169 7.870 9.827
117 HB3 HIS 17 HB1 HIS 17 -8.965 7.258 8.376
118 HD2 HIS 17 HD2 HIS 17 -7.627 8.298 6.203
119 HE1 HIS 17 HE1 HIS 17 -6.808 12.136 7.762
120 HE2 HIS 17 HE2 HIS 17 -6.564 10.635 5.727
121 H GLY 18 HN GLY 18 -12.360 7.701 8.826
122 HA2 GLY 18 HA2 GLY 18 -12.523 8.479 6.092
123 HA3 GLY 18 HA1 GLY 18 -13.844 7.848 7.070
124 H ILE 19 HN ILE 19 -14.234 9.664 8.994
125 HA ILE 19 HA ILE 19 -15.554 11.805 7.653
126 HB ILE 19 HB ILE 19 -16.366 10.827 9.779
127 HG12 ILE 19 HG12 ILE 19 -15.694 13.762 10.112
128 HG13 ILE 19 HG11 ILE 19 -16.927 13.186 8.989
129 HG21 ILE 19 HG21 ILE 19 -14.328 12.427 11.289
130 HG22 ILE 19 HG22 ILE 19 -13.862 10.849 10.674
131 HG23 ILE 19 HG23 ILE 19 -15.212 10.992 11.792
132 HD11 ILE 19 HD11 ILE 19 -18.094 12.071 10.878
133 HD12 ILE 19 HD12 ILE 19 -17.959 13.811 11.127
134 HD13 ILE 19 HD13 ILE 19 -16.881 12.712 11.985
135 H LEU 20 HN LEU 20 -12.444 11.523 9.255
136 HA LEU 20 HA LEU 20 -11.906 14.324 9.462
137 HB2 LEU 20 HB2 LEU 20 -10.355 11.827 9.769
138 HB3 LEU 20 HB1 LEU 20 -9.393 13.227 9.331
139 HG LEU 20 HG LEU 20 -9.550 12.911 11.794
140 HD11 LEU 20 HD11 LEU 20 -9.476 15.170 12.084
141 HD12 LEU 20 HD12 LEU 20 -11.129 15.397 11.522
142 HD13 LEU 20 HD13 LEU 20 -9.814 15.281 10.364
143 HD21 LEU 20 HD21 LEU 20 -12.443 13.723 11.664
144 HD22 LEU 20 HD22 LEU 20 -11.576 12.917 12.968
145 HD23 LEU 20 HD23 LEU 20 -12.012 12.018 11.520
146 H SER 21 HN SER 21 -11.203 11.879 7.011
147 HA SER 21 HA SER 21 -9.683 13.572 5.318
148 HB2 SER 21 HB2 SER 21 -11.330 11.174 4.485
149 HB3 SER 21 HB1 SER 21 -9.961 11.874 3.628
150 HG SER 21 HG SER 21 -10.024 10.167 5.766
151 H PHE 22 HN PHE 22 -13.117 12.897 5.620
152 HA PHE 22 HA PHE 22 -13.850 14.352 3.252
153 HB2 PHE 22 HB2 PHE 22 -15.272 12.552 4.084
154 HB3 PHE 22 HB1 PHE 22 -15.511 13.417 5.602
155 HD1 PHE 22 HD1 PHE 22 -15.904 13.845 1.901
156 HD2 PHE 22 HD2 PHE 22 -17.309 14.915 5.816
157 HE1 PHE 22 HE1 PHE 22 -17.782 15.106 0.883
158 HE2 PHE 22 HE2 PHE 22 -19.187 16.175 4.798
159 HZ PHE 22 HZ PHE 22 -19.424 16.269 2.331
160 H LEU 23 HN LEU 23 -13.161 15.189 6.547
161 HA LEU 23 HA LEU 23 -14.714 17.520 6.793
162 HB2 LEU 23 HB2 LEU 23 -13.630 16.461 8.722
163 HB3 LEU 23 HB1 LEU 23 -12.045 16.833 8.051
164 HG LEU 23 HG LEU 23 -12.517 19.239 8.211
165 HD11 LEU 23 HD11 LEU 23 -14.664 19.758 9.682
166 HD12 LEU 23 HD12 LEU 23 -15.233 18.228 9.020
167 HD13 LEU 23 HD13 LEU 23 -14.814 19.556 7.938
168 HD21 LEU 23 HD21 LEU 23 -12.651 19.396 10.707
169 HD22 LEU 23 HD22 LEU 23 -11.473 18.211 10.144
170 HD23 LEU 23 HD23 LEU 23 -13.038 17.676 10.756
171 H VAL 24 HN VAL 24 -11.460 16.990 5.481
172 HA VAL 24 HA VAL 24 -10.889 19.769 5.098
173 HB VAL 24 HB VAL 24 -9.248 17.728 5.201
174 HG11 VAL 24 HG11 VAL 24 -8.729 16.618 3.189
175 HG12 VAL 24 HG12 VAL 24 -9.538 17.838 2.201
176 HG13 VAL 24 HG13 VAL 24 -10.488 16.703 3.151
177 HG21 VAL 24 HG21 VAL 24 -8.954 19.994 3.206
178 HG22 VAL 24 HG22 VAL 24 -7.621 18.979 3.755
179 HG23 VAL 24 HG23 VAL 24 -8.470 20.014 4.903
180 H PHE 25 HN PHE 25 -12.519 17.304 3.306
181 HA PHE 25 HA PHE 25 -12.482 18.618 0.770
182 HB2 PHE 25 HB2 PHE 25 -12.888 16.145 1.143
183 HB3 PHE 25 HB1 PHE 25 -14.508 16.574 1.695
184 HD1 PHE 25 HD1 PHE 25 -16.145 17.580 0.152
185 HD2 PHE 25 HD2 PHE 25 -12.248 16.371 -1.186
186 HE1 PHE 25 HE1 PHE 25 -16.907 17.732 -2.204
187 HE2 PHE 25 HE2 PHE 25 -13.010 16.523 -3.542
188 HZ PHE 25 HZ PHE 25 -15.339 17.204 -4.051
189 H PHE 26 HN PHE 26 -14.751 18.481 3.476
190 HA PHE 26 HA PHE 26 -16.840 19.931 2.236
191 HB2 PHE 26 HB2 PHE 26 -16.943 18.507 4.385
192 HB3 PHE 26 HB1 PHE 26 -16.307 19.933 5.206
193 HD1 PHE 26 HD1 PHE 26 -17.569 22.131 5.019
194 HD2 PHE 26 HD2 PHE 26 -19.229 18.380 3.745
195 HE1 PHE 26 HE1 PHE 26 -19.842 23.124 5.055
196 HE2 PHE 26 HE2 PHE 26 -21.502 19.373 3.784
197 HZ PHE 26 HZ PHE 26 -21.807 21.746 4.438
198 H SER 27 HN SER 27 -14.034 20.893 4.147
199 HA SER 27 HA SER 27 -14.570 23.508 4.773
200 HB2 SER 27 HB2 SER 27 -12.190 23.920 4.691
201 HB3 SER 27 HB1 SER 27 -12.442 22.276 5.269
202 HG SER 27 HG SER 27 -10.876 22.804 3.418
203 H ALA 28 HN ALA 28 -13.622 22.196 1.634
204 HA ALA 28 HA ALA 28 -13.312 24.654 0.277
205 HB1 ALA 28 HB1 ALA 28 -14.203 21.994 -0.864
206 HB2 ALA 28 HB2 ALA 28 -12.524 22.471 -0.607
207 HB3 ALA 28 HB3 ALA 28 -13.523 23.345 -1.768
208 H ALA 29 HN ALA 29 -16.104 22.765 1.162
209 HA ALA 29 HA ALA 29 -18.015 23.779 -0.605
210 HB1 ALA 29 HB1 ALA 29 -19.661 23.018 0.939
211 HB2 ALA 29 HB2 ALA 29 -18.549 23.157 2.299
212 HB3 ALA 29 HB3 ALA 29 -18.306 21.900 1.086
213 H TRP 30 HN TRP 30 -16.754 25.112 2.428
214 HA TRP 30 HA TRP 30 -18.576 27.202 2.794
215 HB2 TRP 30 HB2 TRP 30 -15.607 27.158 3.399
216 HB3 TRP 30 HB1 TRP 30 -16.788 28.257 4.105
217 HD1 TRP 30 HD1 TRP 30 -18.696 25.252 3.930
218 HE1 TRP 30 HE1 TRP 30 -18.576 23.869 6.089
219 HE3 TRP 30 HE3 TRP 30 -14.611 27.396 6.134
220 HZ2 TRP 30 HZ2 TRP 30 -16.967 23.681 8.445
221 HZ3 TRP 30 HZ3 TRP 30 -13.810 26.591 8.335
222 HH2 TRP 30 HH2 TRP 30 -14.981 24.737 9.493
223 H TYR 31 HN TYR 31 -15.645 27.031 0.809
224 HA TYR 31 HA TYR 31 -15.643 29.752 0.010
225 HB2 TYR 31 HB2 TYR 31 -13.658 28.370 -0.250
226 HB3 TYR 31 HB1 TYR 31 -14.517 27.297 -1.357
227 HD1 TYR 31 HD1 TYR 31 -13.535 30.878 -0.898
228 HD2 TYR 31 HD2 TYR 31 -14.530 27.751 -3.670
229 HE1 TYR 31 HE1 TYR 31 -12.945 32.368 -2.791
230 HE2 TYR 31 HE2 TYR 31 -13.939 29.241 -5.563
231 HH TYR 31 HH TYR 31 -13.626 31.488 -6.102
232 H ILE 32 HN ILE 32 -17.015 26.819 -1.429
233 HA ILE 32 HA ILE 32 -18.017 28.060 -3.777
234 HB ILE 32 HB ILE 32 -19.036 25.567 -2.398
235 HG12 ILE 32 HG12 ILE 32 -16.984 25.805 -4.622
236 HG13 ILE 32 HG11 ILE 32 -16.548 25.616 -2.924
237 HG21 ILE 32 HG21 ILE 32 -19.621 25.009 -4.822
238 HG22 ILE 32 HG22 ILE 32 -19.316 26.706 -5.186
239 HG23 ILE 32 HG23 ILE 32 -20.602 26.262 -4.064
240 HD11 ILE 32 HD11 ILE 32 -18.484 23.675 -4.174
241 HD12 ILE 32 HD12 ILE 32 -17.391 23.440 -2.813
242 HD13 ILE 32 HD13 ILE 32 -16.753 23.484 -4.453
243 H LYS 33 HN LYS 33 -19.495 27.334 -0.625
244 HA LYS 33 HA LYS 33 -22.089 28.303 -1.336
245 HB2 LYS 33 HB2 LYS 33 -20.746 27.797 1.326
246 HB3 LYS 33 HB1 LYS 33 -22.434 28.281 1.156
247 HG2 LYS 33 HG2 LYS 33 -22.917 26.302 -0.178
248 HG3 LYS 33 HG1 LYS 33 -21.217 25.832 -0.149
249 HD2 LYS 33 HD2 LYS 33 -21.306 25.588 2.292
250 HD3 LYS 33 HD1 LYS 33 -22.995 26.097 2.295
251 HE2 LYS 33 HE2 LYS 33 -23.599 24.158 0.910
252 HE3 LYS 33 HE1 LYS 33 -21.909 23.653 0.863
253 HZ1 LYS 33 HZ1 LYS 33 -22.835 22.407 2.574
254 HZ2 LYS 33 HZ2 LYS 33 -23.755 23.707 3.169
255 HZ3 LYS 33 HZ3 LYS 33 -22.070 23.680 3.391
256 H GLY 34 HN GLY 34 -19.505 29.694 0.726
257 HA2 GLY 34 HA2 GLY 34 -18.895 31.890 1.063
258 HA3 GLY 34 HA1 GLY 34 -19.941 32.341 -0.280
259 H ARG 35 HN ARG 35 -21.147 30.498 2.436
260 HA ARG 35 HA ARG 35 -22.902 32.759 3.171
261 HB2 ARG 35 HB2 ARG 35 -24.297 31.075 4.264
262 HB3 ARG 35 HB1 ARG 35 -23.992 30.620 2.590
263 HG2 ARG 35 HG2 ARG 35 -22.211 29.082 3.313
264 HG3 ARG 35 HG1 ARG 35 -22.467 29.548 4.990
265 HD2 ARG 35 HD2 ARG 35 -23.638 27.462 4.554
266 HD3 ARG 35 HD1 ARG 35 -24.811 28.745 4.834
267 HE ARG 35 HE ARG 35 -24.270 28.524 2.055
268 HH11 ARG 35 HH21 ARG 35 -25.820 26.919 4.699
269 HH12 ARG 35 HH22 ARG 35 -27.013 26.144 3.709
270 HH21 ARG 35 HH11 ARG 35 -25.831 27.512 0.750
271 HH22 ARG 35 HH12 ARG 35 -27.019 26.479 1.475
272 H LEU 36 HN LEU 36 -19.980 31.883 4.026
273 HA LEU 36 HA LEU 36 -20.408 32.126 6.950
274 HB2 LEU 36 HB2 LEU 36 -18.220 30.864 5.302
275 HB3 LEU 36 HB1 LEU 36 -17.954 31.305 6.988
276 HG LEU 36 HG LEU 36 -20.421 29.709 6.310
277 HD11 LEU 36 HD11 LEU 36 -18.848 28.363 5.160
278 HD12 LEU 36 HD12 LEU 36 -18.963 27.629 6.758
279 HD13 LEU 36 HD13 LEU 36 -17.587 28.658 6.357
280 HD21 LEU 36 HD21 LEU 36 -18.484 29.563 8.644
281 HD22 LEU 36 HD22 LEU 36 -20.098 28.855 8.559
282 HD23 LEU 36 HD23 LEU 36 -19.904 30.606 8.621
283 H ALA 37 HN ALA 37 -18.439 33.207 8.033
284 HA ALA 37 HA ALA 37 -17.197 35.321 6.498
285 HB1 ALA 37 HB1 ALA 37 -18.555 37.066 7.051
286 HB2 ALA 37 HB2 ALA 37 -18.587 36.593 8.749
287 HB3 ALA 37 HB3 ALA 37 -19.714 35.864 7.610
288 HA PRO 38 HA PRO 38 -13.995 35.346 9.546
289 HB2 PRO 38 HB2 PRO 38 -14.719 38.124 10.436
290 HB3 PRO 38 HB1 PRO 38 -13.154 37.488 9.891
291 HG2 PRO 38 HG2 PRO 38 -14.642 39.027 8.311
292 HG3 PRO 38 HG1 PRO 38 -13.718 37.662 7.656
293 HD2 PRO 38 HD2 PRO 38 -16.666 37.885 8.148
294 HD3 PRO 38 HD1 PRO 38 -15.792 37.031 6.859
295 H GLY 39 HN GLY 39 -15.589 33.806 10.705
296 HA2 GLY 39 HA2 GLY 39 -16.457 34.929 13.316
297 HA3 GLY 39 HA1 GLY 39 -17.198 33.539 12.529
298 H ALA 40 HN ALA 40 -16.777 31.804 13.730
299 HA ALA 40 HA ALA 40 -14.240 31.541 15.160
300 HB1 ALA 40 HB1 ALA 40 -16.364 30.935 16.275
301 HB2 ALA 40 HB2 ALA 40 -15.254 29.569 16.175
302 HB3 ALA 40 HB3 ALA 40 -16.624 29.675 15.070
303 H ALA 41 HN ALA 41 -16.021 29.966 12.537
304 HA ALA 41 HA ALA 41 -14.099 27.883 12.137
305 HB1 ALA 41 HB1 ALA 41 -16.242 28.962 10.291
306 HB2 ALA 41 HB2 ALA 41 -16.423 27.612 11.411
307 HB3 ALA 41 HB3 ALA 41 -15.327 27.477 10.037
308 H TYR 42 HN TYR 42 -14.062 31.175 11.472
309 HA TYR 42 HA TYR 42 -12.431 30.979 9.047
310 HB2 TYR 42 HB2 TYR 42 -14.013 33.047 10.326
311 HB3 TYR 42 HB1 TYR 42 -12.382 33.655 10.082
312 HD1 TYR 42 HD1 TYR 42 -15.364 32.240 8.384
313 HD2 TYR 42 HD2 TYR 42 -11.509 34.065 7.877
314 HE1 TYR 42 HE1 TYR 42 -15.844 32.584 5.975
315 HE2 TYR 42 HE2 TYR 42 -11.987 34.407 5.467
316 HH TYR 42 HH TYR 42 -13.679 33.084 3.726
317 H ALA 43 HN ALA 43 -12.040 32.173 12.382
318 HA ALA 43 HA ALA 43 -9.287 32.711 12.206
319 HB1 ALA 43 HB1 ALA 43 -10.858 33.440 14.047
320 HB2 ALA 43 HB2 ALA 43 -9.307 32.812 14.601
321 HB3 ALA 43 HB3 ALA 43 -10.750 31.802 14.690
322 H PHE 44 HN PHE 44 -11.009 29.835 13.393
323 HA PHE 44 HA PHE 44 -8.712 28.313 14.001
324 HB2 PHE 44 HB2 PHE 44 -11.051 27.796 14.760
325 HB3 PHE 44 HB1 PHE 44 -11.402 27.239 13.124
326 HD1 PHE 44 HD2 PHE 44 -9.011 26.741 15.955
327 HD2 PHE 44 HD1 PHE 44 -10.878 25.025 12.488
328 HE1 PHE 44 HE2 PHE 44 -7.997 24.545 16.497
329 HE2 PHE 44 HE1 PHE 44 -9.864 22.827 13.031
330 HZ PHE 44 HZ PHE 44 -8.423 22.587 15.035
331 H TYR 45 HN TYR 45 -10.713 28.506 11.066
332 HA TYR 45 HA TYR 45 -9.705 26.534 9.498
333 HB2 TYR 45 HB2 TYR 45 -11.231 27.728 8.257
334 HB3 TYR 45 HB1 TYR 45 -10.731 29.268 8.943
335 HD1 TYR 45 HD1 TYR 45 -8.641 30.379 8.113
336 HD2 TYR 45 HD2 TYR 45 -10.333 26.947 6.163
337 HE1 TYR 45 HE1 TYR 45 -7.269 30.847 6.101
338 HE2 TYR 45 HE2 TYR 45 -8.961 27.413 4.149
339 HH TYR 45 HH TYR 45 -7.859 29.618 3.150
340 H GLY 46 HN GLY 46 -7.974 29.305 10.677
341 HA2 GLY 46 HA2 GLY 46 -5.861 29.414 8.827
342 HA3 GLY 46 HA1 GLY 46 -5.787 29.976 10.490
343 H VAL 47 HN VAL 47 -5.730 27.971 12.120
344 HA VAL 47 HA VAL 47 -3.338 26.494 11.397
345 HB VAL 47 HB VAL 47 -3.960 27.648 13.679
346 HG11 VAL 47 HG11 VAL 47 -4.979 24.876 14.292
347 HG12 VAL 47 HG12 VAL 47 -6.080 26.160 13.793
348 HG13 VAL 47 HG13 VAL 47 -5.123 26.341 15.265
349 HG21 VAL 47 HG21 VAL 47 -2.686 25.513 14.795
350 HG22 VAL 47 HG22 VAL 47 -1.859 26.681 13.768
351 HG23 VAL 47 HG23 VAL 47 -2.415 25.161 13.090
352 H TRP 48 HN TRP 48 -6.300 25.939 10.496
353 HA TRP 48 HA TRP 48 -7.205 23.522 11.334
354 HB2 TRP 48 HB2 TRP 48 -7.940 25.043 9.240
355 HB3 TRP 48 HB1 TRP 48 -7.138 23.768 8.349
356 HD1 TRP 48 HD1 TRP 48 -8.105 21.568 10.724
357 HE1 TRP 48 HE1 TRP 48 -10.483 20.636 10.470
358 HE3 TRP 48 HE3 TRP 48 -10.114 25.115 7.646
359 HZ2 TRP 48 HZ2 TRP 48 -12.926 21.301 9.136
360 HZ3 TRP 48 HZ3 TRP 48 -12.469 24.932 6.894
361 HH2 TRP 48 HH2 TRP 48 -13.875 23.029 7.632
362 HA PRO 49 HA PRO 49 -4.059 21.229 8.290
363 HB2 PRO 49 HB2 PRO 49 -1.731 23.080 8.613
364 HB3 PRO 49 HB1 PRO 49 -2.282 22.210 7.167
365 HG2 PRO 49 HG2 PRO 49 -2.671 24.821 7.405
366 HG3 PRO 49 HG1 PRO 49 -3.923 23.783 6.693
367 HD2 PRO 49 HD2 PRO 49 -3.770 24.959 9.437
368 HD3 PRO 49 HD1 PRO 49 -5.174 24.822 8.368
369 H LEU 50 HN LEU 50 -4.220 22.020 11.386
370 HA LEU 50 HA LEU 50 -1.799 20.559 12.260
371 HB2 LEU 50 HB2 LEU 50 -2.540 22.882 13.207
372 HB3 LEU 50 HB1 LEU 50 -3.714 21.953 14.125
373 HG LEU 50 HG LEU 50 -0.724 21.409 14.127
374 HD11 LEU 50 HD11 LEU 50 -0.999 23.521 15.189
375 HD12 LEU 50 HD12 LEU 50 -0.923 22.342 16.496
376 HD13 LEU 50 HD13 LEU 50 -2.479 23.006 16.002
377 HD21 LEU 50 HD21 LEU 50 -3.107 20.190 15.513
378 HD22 LEU 50 HD22 LEU 50 -1.559 20.230 16.358
379 HD23 LEU 50 HD23 LEU 50 -1.693 19.404 14.813
380 H LEU 51 HN LEU 51 -5.306 20.740 12.863
381 HA LEU 51 HA LEU 51 -5.475 18.437 14.447
382 HB2 LEU 51 HB2 LEU 51 -7.293 20.103 14.278
383 HB3 LEU 51 HB1 LEU 51 -7.596 19.599 12.617
384 HG LEU 51 HG LEU 51 -8.124 17.311 13.413
385 HD11 LEU 51 HD11 LEU 51 -6.957 16.907 15.383
386 HD12 LEU 51 HD12 LEU 51 -8.547 17.275 16.045
387 HD13 LEU 51 HD13 LEU 51 -7.288 18.510 16.040
388 HD21 LEU 51 HD21 LEU 51 -10.229 17.908 14.646
389 HD22 LEU 51 HD22 LEU 51 -9.980 18.860 13.182
390 HD23 LEU 51 HD23 LEU 51 -9.640 19.566 14.764
391 H LEU 52 HN LEU 52 -5.632 18.873 10.942
392 HA LEU 52 HA LEU 52 -6.458 16.279 10.254
393 HB2 LEU 52 HB2 LEU 52 -4.872 18.410 8.828
394 HB3 LEU 52 HB1 LEU 52 -5.107 16.832 8.081
395 HG LEU 52 HG LEU 52 -6.845 18.554 7.439
396 HD11 LEU 52 HD11 LEU 52 -8.370 16.461 8.926
397 HD12 LEU 52 HD12 LEU 52 -7.174 15.879 7.777
398 HD13 LEU 52 HD13 LEU 52 -8.470 16.936 7.238
399 HD21 LEU 52 HD21 LEU 52 -7.874 18.165 10.256
400 HD22 LEU 52 HD22 LEU 52 -8.435 19.323 9.050
401 HD23 LEU 52 HD23 LEU 52 -6.858 19.536 9.810
402 H LEU 53 HN LEU 53 -3.136 17.459 9.746
403 HA LEU 53 HA LEU 53 -1.878 15.048 9.520
404 HB2 LEU 53 HB2 LEU 53 -0.974 17.695 10.625
405 HB3 LEU 53 HB1 LEU 53 0.128 16.318 10.654
406 HG LEU 53 HG LEU 53 -0.084 16.048 8.238
407 HD11 LEU 53 HD11 LEU 53 -2.353 16.682 7.836
408 HD12 LEU 53 HD12 LEU 53 -1.364 17.864 6.978
409 HD13 LEU 53 HD13 LEU 53 -2.099 18.286 8.525
410 HD21 LEU 53 HD21 LEU 53 1.645 17.581 8.906
411 HD22 LEU 53 HD22 LEU 53 0.476 18.876 9.171
412 HD23 LEU 53 HD23 LEU 53 0.817 18.319 7.533
413 H LEU 54 HN LEU 54 -2.941 16.604 12.506
414 HA LEU 54 HA LEU 54 -1.510 14.974 14.315
415 HB2 LEU 54 HB2 LEU 54 -2.673 17.089 14.926
416 HB3 LEU 54 HB1 LEU 54 -4.218 16.266 14.725
417 HG LEU 54 HG LEU 54 -3.496 14.599 16.461
418 HD11 LEU 54 HD11 LEU 54 -1.167 14.606 16.568
419 HD12 LEU 54 HD12 LEU 54 -1.554 15.616 17.955
420 HD13 LEU 54 HD13 LEU 54 -1.056 16.360 16.437
421 HD21 LEU 54 HD21 LEU 54 -3.662 16.245 18.385
422 HD22 LEU 54 HD22 LEU 54 -4.933 16.386 17.172
423 HD23 LEU 54 HD23 LEU 54 -3.597 17.537 17.189
424 H LEU 55 HN LEU 55 -5.020 14.790 13.700
425 HA LEU 55 HA LEU 55 -5.228 12.134 14.707
426 HB2 LEU 55 HB2 LEU 55 -7.120 13.809 13.047
427 HB3 LEU 55 HB1 LEU 55 -7.536 12.238 13.728
428 HG LEU 55 HG LEU 55 -6.535 14.569 15.393
429 HD11 LEU 55 HD11 LEU 55 -8.856 14.965 16.020
430 HD12 LEU 55 HD12 LEU 55 -9.391 13.632 14.999
431 HD13 LEU 55 HD13 LEU 55 -8.702 15.081 14.270
432 HD21 LEU 55 HD21 LEU 55 -7.857 13.094 17.156
433 HD22 LEU 55 HD22 LEU 55 -6.215 12.655 16.710
434 HD23 LEU 55 HD23 LEU 55 -7.579 11.800 15.992
435 H ALA 56 HN ALA 56 -4.988 13.497 11.472
436 HA ALA 56 HA ALA 56 -5.526 11.214 9.957
437 HB1 ALA 56 HB1 ALA 56 -3.542 13.410 9.320
438 HB2 ALA 56 HB2 ALA 56 -5.277 13.491 9.012
439 HB3 ALA 56 HB3 ALA 56 -4.286 12.305 8.164
440 H LEU 57 HN LEU 57 -2.889 11.869 12.043
441 HA LEU 57 HA LEU 57 -1.384 9.571 10.927
442 HB2 LEU 57 HB2 LEU 57 -0.199 11.973 12.325
443 HB3 LEU 57 HB1 LEU 57 0.670 10.637 11.573
444 HG LEU 57 HG LEU 57 -1.198 12.487 10.062
445 HD11 LEU 57 HD11 LEU 57 0.731 13.662 9.269
446 HD12 LEU 57 HD12 LEU 57 1.826 12.495 10.009
447 HD13 LEU 57 HD13 LEU 57 0.886 13.589 11.023
448 HD21 LEU 57 HD21 LEU 57 -1.021 10.467 8.840
449 HD22 LEU 57 HD22 LEU 57 0.669 10.241 9.286
450 HD23 LEU 57 HD23 LEU 57 0.223 11.489 8.124
451 HA PRO 58 HA PRO 58 -2.924 8.308 15.110
452 HB2 PRO 58 HB2 PRO 58 -1.810 5.740 14.049
453 HB3 PRO 58 HB1 PRO 58 -3.366 6.044 14.843
454 HG2 PRO 58 HG2 PRO 58 -3.192 5.663 12.206
455 HG3 PRO 58 HG1 PRO 58 -4.362 6.794 12.912
456 HD2 PRO 58 HD2 PRO 58 -1.822 7.372 11.448
457 HD3 PRO 58 HD1 PRO 58 -3.319 8.330 11.530
458 HA PRO 59 HA PRO 59 0.715 8.015 17.645
459 HB2 PRO 59 HB2 PRO 59 0.262 5.140 18.353
460 HB3 PRO 59 HB1 PRO 59 0.402 6.555 19.416
461 HG2 PRO 59 HG2 PRO 59 -1.956 5.411 18.966
462 HG3 PRO 59 HG1 PRO 59 -1.808 7.175 19.100
463 HD2 PRO 59 HD2 PRO 59 -2.104 5.481 16.639
464 HD3 PRO 59 HD1 PRO 59 -2.848 7.052 17.017
465 H ARG 60 HN ARG 60 0.347 5.066 15.696
466 HA ARG 60 HA ARG 60 3.064 4.281 15.689
467 HB2 ARG 60 HB2 ARG 60 2.407 3.055 13.559
468 HB3 ARG 60 HB1 ARG 60 1.451 2.673 14.994
469 HG2 ARG 60 HG2 ARG 60 -0.394 3.914 14.263
470 HG3 ARG 60 HG1 ARG 60 0.560 4.865 13.128
471 HD2 ARG 60 HD2 ARG 60 -0.075 1.908 12.871
472 HD3 ARG 60 HD1 ARG 60 -0.820 3.204 11.938
473 HE ARG 60 HE ARG 60 1.717 2.008 11.415
474 HH11 ARG 60 HH21 ARG 60 -0.001 5.012 11.418
475 HH12 ARG 60 HH22 ARG 60 0.969 5.726 10.174
476 HH21 ARG 60 HH11 ARG 60 2.992 2.937 9.782
477 HH22 ARG 60 HH12 ARG 60 2.665 4.552 9.250
478 H ALA 61 HN ALA 61 2.027 7.147 14.746
479 HA ALA 61 HA ALA 61 3.218 7.398 12.132
480 HB1 ALA 61 HB1 ALA 61 2.760 9.780 12.383
481 HB2 ALA 61 HB2 ALA 61 2.400 9.554 14.095
482 HB3 ALA 61 HB3 ALA 61 1.347 8.843 12.872
483 H TYR 62 HN TYR 62 5.361 6.808 12.240
484 HA TYR 62 HA TYR 62 7.110 8.086 14.224
485 HB2 TYR 62 HB2 TYR 62 8.850 6.600 13.241
486 HB3 TYR 62 HB1 TYR 62 7.455 5.714 13.856
487 HD1 TYR 62 HD1 TYR 62 9.159 6.926 10.804
488 HD2 TYR 62 HD2 TYR 62 5.949 4.542 12.374
489 HE1 TYR 62 HE1 TYR 62 8.800 5.930 8.561
490 HE2 TYR 62 HE2 TYR 62 5.590 3.548 10.132
491 HH TYR 62 HH TYR 62 7.768 4.265 7.434
492 H ALA 63 HN ALA 63 6.364 8.134 10.797
493 HA ALA 63 HA ALA 63 7.149 9.432 9.064
494 HB1 ALA 63 HB1 ALA 63 6.016 11.172 10.309
495 HB2 ALA 63 HB2 ALA 63 7.529 11.823 9.679
496 HB3 ALA 63 HB3 ALA 63 7.407 11.366 11.376
Start of MODEL 9
1 H1 ALA 1 HT1 ALA 1 0.049 1.523 11.807
2 H2 ALA 1 HT2 ALA 1 0.210 0.103 10.888
3 H3 ALA 1 HT3 ALA 1 0.480 1.619 10.169
4 HA ALA 1 HA ALA 1 2.159 1.395 12.406
5 HB1 ALA 1 HB1 ALA 1 2.183 -0.939 10.474
6 HB2 ALA 1 HB2 ALA 1 1.993 -1.004 12.226
7 HB3 ALA 1 HB3 ALA 1 3.540 -0.531 11.524
8 H LEU 2 HN LEU 2 2.461 0.449 8.976
9 HA LEU 2 HA LEU 2 4.644 2.271 8.552
10 HB2 LEU 2 HB2 LEU 2 3.034 0.454 6.761
11 HB3 LEU 2 HB1 LEU 2 4.228 1.571 6.098
12 HG LEU 2 HG LEU 2 5.966 0.574 7.540
13 HD11 LEU 2 HD11 LEU 2 5.269 -1.670 8.648
14 HD12 LEU 2 HD12 LEU 2 3.619 -1.065 8.504
15 HD13 LEU 2 HD13 LEU 2 4.805 -0.177 9.460
16 HD21 LEU 2 HD21 LEU 2 4.362 -1.403 5.887
17 HD22 LEU 2 HD22 LEU 2 6.008 -1.692 6.457
18 HD23 LEU 2 HD23 LEU 2 5.684 -0.382 5.320
19 H GLU 3 HN GLU 3 4.663 4.209 7.456
20 HA GLU 3 HA GLU 3 2.248 5.745 7.503
21 HB2 GLU 3 HB2 GLU 3 5.018 6.342 6.434
22 HB3 GLU 3 HB1 GLU 3 3.707 7.518 6.472
23 HG2 GLU 3 HG2 GLU 3 4.829 7.964 8.490
24 HG3 GLU 3 HG1 GLU 3 3.538 6.890 9.016
25 H ASN 4 HN ASN 4 3.320 3.469 5.370
26 HA ASN 4 HA ASN 4 2.829 4.664 2.849
27 HB2 ASN 4 HB2 ASN 4 2.509 1.751 3.602
28 HB3 ASN 4 HB1 ASN 4 2.781 2.405 1.987
29 HD21 ASN 4 HD21 ASN 4 4.451 0.684 4.093
30 HD22 ASN 4 HD22 ASN 4 5.988 1.393 3.977
31 H LEU 5 HN LEU 5 0.982 2.433 2.003
32 HA LEU 5 HA LEU 5 -1.482 3.913 2.393
33 HB2 LEU 5 HB2 LEU 5 -0.677 1.534 0.723
34 HB3 LEU 5 HB1 LEU 5 -2.372 1.970 0.909
35 HG LEU 5 HG LEU 5 -1.259 2.998 -1.127
36 HD11 LEU 5 HD11 LEU 5 -1.990 5.318 0.618
37 HD12 LEU 5 HD12 LEU 5 -3.199 4.047 0.457
38 HD13 LEU 5 HD13 LEU 5 -2.601 4.877 -0.975
39 HD21 LEU 5 HD21 LEU 5 0.129 4.785 0.882
40 HD22 LEU 5 HD22 LEU 5 0.397 4.699 -0.858
41 HD23 LEU 5 HD23 LEU 5 0.927 3.377 0.182
42 H VAL 6 HN VAL 6 0.128 1.501 4.055
43 HA VAL 6 HA VAL 6 -1.933 -0.245 4.821
44 HB VAL 6 HB VAL 6 0.537 0.665 6.315
45 HG11 VAL 6 HG11 VAL 6 -0.902 -0.205 7.992
46 HG12 VAL 6 HG12 VAL 6 0.116 -1.571 7.540
47 HG13 VAL 6 HG13 VAL 6 -1.532 -1.455 6.920
48 HG21 VAL 6 HG21 VAL 6 0.986 -0.501 4.198
49 HG22 VAL 6 HG22 VAL 6 -0.103 -1.805 4.669
50 HG23 VAL 6 HG23 VAL 6 1.397 -1.543 5.560
51 H VAL 7 HN VAL 7 -0.784 2.774 6.284
52 HA VAL 7 HA VAL 7 -2.598 2.783 8.456
53 HB VAL 7 HB VAL 7 -2.114 5.355 8.338
54 HG11 VAL 7 HG11 VAL 7 -0.149 3.132 8.859
55 HG12 VAL 7 HG12 VAL 7 -0.966 4.179 10.013
56 HG13 VAL 7 HG13 VAL 7 0.362 4.811 9.041
57 HG21 VAL 7 HG21 VAL 7 -0.026 4.307 6.402
58 HG22 VAL 7 HG22 VAL 7 -0.176 5.962 6.981
59 HG23 VAL 7 HG23 VAL 7 -1.414 5.282 5.933
60 H LEU 8 HN LEU 8 -2.725 4.355 5.266
61 HA LEU 8 HA LEU 8 -5.211 5.615 5.598
62 HB2 LEU 8 HB2 LEU 8 -3.722 6.212 3.754
63 HB3 LEU 8 HB1 LEU 8 -3.905 4.602 3.060
64 HG LEU 8 HG LEU 8 -6.320 5.009 2.726
65 HD11 LEU 8 HD11 LEU 8 -5.660 7.550 4.202
66 HD12 LEU 8 HD12 LEU 8 -7.027 6.455 4.429
67 HD13 LEU 8 HD13 LEU 8 -6.990 7.543 3.044
68 HD21 LEU 8 HD21 LEU 8 -4.565 7.244 1.664
69 HD22 LEU 8 HD22 LEU 8 -6.138 6.792 1.010
70 HD23 LEU 8 HD23 LEU 8 -4.789 5.661 0.922
71 H ASN 9 HN ASN 9 -4.363 2.414 4.299
72 HA ASN 9 HA ASN 9 -6.953 1.630 3.525
73 HB2 ASN 9 HB2 ASN 9 -4.546 0.040 4.416
74 HB3 ASN 9 HB1 ASN 9 -6.031 -0.711 3.837
75 HD21 ASN 9 HD21 ASN 9 -6.741 1.016 1.728
76 HD22 ASN 9 HD22 ASN 9 -5.534 0.968 0.536
77 H ALA 10 HN ALA 10 -5.185 1.156 6.575
78 HA ALA 10 HA ALA 10 -7.334 -0.205 7.870
79 HB1 ALA 10 HB1 ALA 10 -4.957 -0.408 8.569
80 HB2 ALA 10 HB2 ALA 10 -6.019 0.061 9.896
81 HB3 ALA 10 HB3 ALA 10 -5.000 1.269 9.110
82 H ALA 11 HN ALA 11 -6.266 3.146 7.675
83 HA ALA 11 HA ALA 11 -7.958 4.185 9.685
84 HB1 ALA 11 HB1 ALA 11 -7.511 6.369 8.664
85 HB2 ALA 11 HB2 ALA 11 -6.845 5.570 7.240
86 HB3 ALA 11 HB3 ALA 11 -6.028 5.424 8.796
87 H SER 12 HN SER 12 -8.420 3.583 6.243
88 HA SER 12 HA SER 12 -10.817 5.017 5.886
89 HB2 SER 12 HB2 SER 12 -11.172 3.486 3.946
90 HB3 SER 12 HB1 SER 12 -9.564 4.204 3.980
91 HG SER 12 HG SER 12 -9.996 1.768 5.290
92 H VAL 13 HN VAL 13 -10.177 1.797 7.155
93 HA VAL 13 HA VAL 13 -13.071 1.284 7.435
94 HB VAL 13 HB VAL 13 -12.362 -1.017 8.029
95 HG11 VAL 13 HG11 VAL 13 -12.861 -0.521 5.702
96 HG12 VAL 13 HG12 VAL 13 -11.455 -1.584 5.759
97 HG13 VAL 13 HG13 VAL 13 -11.244 0.141 5.457
98 HG21 VAL 13 HG21 VAL 13 -10.178 -0.490 9.007
99 HG22 VAL 13 HG22 VAL 13 -9.604 0.107 7.450
100 HG23 VAL 13 HG23 VAL 13 -9.967 -1.608 7.658
101 H ALA 14 HN ALA 14 -10.393 2.388 9.202
102 HA ALA 14 HA ALA 14 -10.676 1.381 11.751
103 HB1 ALA 14 HB1 ALA 14 -10.006 4.162 10.803
104 HB2 ALA 14 HB2 ALA 14 -8.907 2.906 11.378
105 HB3 ALA 14 HB3 ALA 14 -9.980 3.726 12.512
106 H GLY 15 HN GLY 15 -12.320 4.313 10.522
107 HA2 GLY 15 HA2 GLY 15 -14.835 4.246 10.935
108 HA3 GLY 15 HA1 GLY 15 -14.394 3.937 12.611
109 H ALA 16 HN ALA 16 -12.865 5.598 13.583
110 HA ALA 16 HA ALA 16 -14.078 8.108 13.605
111 HB1 ALA 16 HB1 ALA 16 -12.723 7.458 15.466
112 HB2 ALA 16 HB2 ALA 16 -11.941 8.860 14.735
113 HB3 ALA 16 HB3 ALA 16 -11.306 7.242 14.438
114 H HIS 17 HN HIS 17 -11.049 7.110 12.012
115 HA HIS 17 HA HIS 17 -10.280 9.498 10.890
116 HB2 HIS 17 HB2 HIS 17 -10.103 6.695 9.808
117 HB3 HIS 17 HB1 HIS 17 -9.351 8.072 9.003
118 HD2 HIS 17 HD2 HIS 17 -6.904 8.808 10.088
119 HE1 HIS 17 HE1 HIS 17 -7.128 6.496 13.615
120 HE2 HIS 17 HE2 HIS 17 -5.641 8.016 12.231
121 H GLY 18 HN GLY 18 -13.081 7.648 10.196
122 HA2 GLY 18 HA2 GLY 18 -13.574 8.394 7.515
123 HA3 GLY 18 HA1 GLY 18 -14.798 7.908 8.685
124 H ILE 19 HN ILE 19 -15.134 9.700 10.456
125 HA ILE 19 HA ILE 19 -16.368 11.889 9.262
126 HB ILE 19 HB ILE 19 -15.220 11.898 12.057
127 HG12 ILE 19 HG12 ILE 19 -16.371 9.773 11.782
128 HG13 ILE 19 HG11 ILE 19 -17.434 10.847 12.690
129 HG21 ILE 19 HG21 ILE 19 -17.710 13.127 10.838
130 HG22 ILE 19 HG22 ILE 19 -16.231 14.002 11.233
131 HG23 ILE 19 HG23 ILE 19 -17.201 13.285 12.520
132 HD11 ILE 19 HD11 ILE 19 -18.871 9.914 11.060
133 HD12 ILE 19 HD12 ILE 19 -17.641 10.005 9.801
134 HD13 ILE 19 HD13 ILE 19 -18.430 11.473 10.370
135 H LEU 20 HN LEU 20 -13.050 11.372 10.047
136 HA LEU 20 HA LEU 20 -12.313 14.165 9.985
137 HB2 LEU 20 HB2 LEU 20 -10.796 11.577 10.125
138 HB3 LEU 20 HB1 LEU 20 -9.950 13.089 9.818
139 HG LEU 20 HG LEU 20 -11.895 12.993 12.118
140 HD11 LEU 20 HD11 LEU 20 -9.186 11.677 12.031
141 HD12 LEU 20 HD12 LEU 20 -10.696 11.036 12.670
142 HD13 LEU 20 HD13 LEU 20 -9.838 12.308 13.541
143 HD21 LEU 20 HD21 LEU 20 -10.638 15.071 11.308
144 HD22 LEU 20 HD22 LEU 20 -9.167 14.292 11.882
145 HD23 LEU 20 HD23 LEU 20 -10.454 14.692 13.018
146 H SER 21 HN SER 21 -12.481 11.478 7.749
147 HA SER 21 HA SER 21 -10.949 12.706 5.674
148 HB2 SER 21 HB2 SER 21 -13.079 10.634 5.193
149 HB3 SER 21 HB1 SER 21 -11.551 10.868 4.348
150 HG SER 21 HG SER 21 -10.633 9.642 5.778
151 H PHE 22 HN PHE 22 -14.425 12.405 6.350
152 HA PHE 22 HA PHE 22 -15.233 13.873 4.042
153 HB2 PHE 22 HB2 PHE 22 -16.697 13.149 6.584
154 HB3 PHE 22 HB1 PHE 22 -17.455 13.948 5.207
155 HD1 PHE 22 HD2 PHE 22 -17.346 12.803 2.921
156 HD2 PHE 22 HD1 PHE 22 -16.381 10.802 6.597
157 HE1 PHE 22 HE2 PHE 22 -17.643 10.608 1.805
158 HE2 PHE 22 HE1 PHE 22 -16.677 8.607 5.481
159 HZ PHE 22 HZ PHE 22 -17.308 8.511 3.085
160 H LEU 23 HN LEU 23 -13.912 14.772 7.022
161 HA LEU 23 HA LEU 23 -15.218 17.264 7.428
162 HB2 LEU 23 HB2 LEU 23 -14.038 16.295 9.275
163 HB3 LEU 23 HB1 LEU 23 -12.547 16.204 8.354
164 HG LEU 23 HG LEU 23 -13.749 18.932 8.587
165 HD11 LEU 23 HD11 LEU 23 -14.103 18.087 10.865
166 HD12 LEU 23 HD12 LEU 23 -12.794 19.270 10.854
167 HD13 LEU 23 HD13 LEU 23 -12.425 17.549 10.940
168 HD21 LEU 23 HD21 LEU 23 -10.894 18.286 9.262
169 HD22 LEU 23 HD22 LEU 23 -11.545 19.620 8.314
170 HD23 LEU 23 HD23 LEU 23 -11.390 18.030 7.595
171 H VAL 24 HN VAL 24 -12.513 16.260 5.451
172 HA VAL 24 HA VAL 24 -11.377 18.807 4.963
173 HB VAL 24 HB VAL 24 -10.374 16.489 4.467
174 HG11 VAL 24 HG11 VAL 24 -12.475 15.912 3.045
175 HG12 VAL 24 HG12 VAL 24 -10.900 15.416 2.430
176 HG13 VAL 24 HG13 VAL 24 -11.695 16.849 1.777
177 HG21 VAL 24 HG21 VAL 24 -9.074 17.389 2.546
178 HG22 VAL 24 HG22 VAL 24 -9.270 18.590 3.823
179 HG23 VAL 24 HG23 VAL 24 -10.263 18.680 2.368
180 H PHE 25 HN PHE 25 -14.233 17.311 3.784
181 HA PHE 25 HA PHE 25 -14.481 18.594 1.269
182 HB2 PHE 25 HB2 PHE 25 -16.351 17.219 3.140
183 HB3 PHE 25 HB1 PHE 25 -17.071 18.235 1.904
184 HD1 PHE 25 HD1 PHE 25 -14.658 15.428 2.407
185 HD2 PHE 25 HD2 PHE 25 -17.251 17.481 -0.327
186 HE1 PHE 25 HE1 PHE 25 -14.292 13.644 0.725
187 HE2 PHE 25 HE2 PHE 25 -16.888 15.699 -2.012
188 HZ PHE 25 HZ PHE 25 -15.407 13.780 -1.486
189 H PHE 26 HN PHE 26 -15.418 19.573 4.552
190 HA PHE 26 HA PHE 26 -16.943 21.828 3.872
191 HB2 PHE 26 HB2 PHE 26 -15.263 21.264 6.322
192 HB3 PHE 26 HB1 PHE 26 -16.384 22.619 6.188
193 HD1 PHE 26 HD2 PHE 26 -18.804 21.823 5.143
194 HD2 PHE 26 HD1 PHE 26 -16.104 19.405 7.447
195 HE1 PHE 26 HE2 PHE 26 -20.677 20.336 5.774
196 HE2 PHE 26 HE1 PHE 26 -17.982 17.915 8.082
197 HZ PHE 26 HZ PHE 26 -20.270 18.381 7.246
198 H SER 27 HN SER 27 -13.469 21.469 4.506
199 HA SER 27 HA SER 27 -12.609 24.062 4.505
200 HB2 SER 27 HB2 SER 27 -11.236 21.881 4.606
201 HB3 SER 27 HB1 SER 27 -11.197 21.978 2.847
202 HG SER 27 HG SER 27 -10.379 24.014 4.657
203 H ALA 28 HN ALA 28 -13.313 22.072 1.646
204 HA ALA 28 HA ALA 28 -12.845 24.288 -0.160
205 HB1 ALA 28 HB1 ALA 28 -14.142 21.635 -0.799
206 HB2 ALA 28 HB2 ALA 28 -12.395 21.861 -0.720
207 HB3 ALA 28 HB3 ALA 28 -13.346 22.744 -1.915
208 H ALA 29 HN ALA 29 -15.633 22.544 1.162
209 HA ALA 29 HA ALA 29 -17.662 23.658 -0.377
210 HB1 ALA 29 HB1 ALA 29 -18.181 23.264 2.541
211 HB2 ALA 29 HB2 ALA 29 -17.663 21.866 1.604
212 HB3 ALA 29 HB3 ALA 29 -19.126 22.734 1.151
213 H TRP 30 HN TRP 30 -15.803 25.063 2.221
214 HA TRP 30 HA TRP 30 -17.535 27.204 2.875
215 HB2 TRP 30 HB2 TRP 30 -14.592 26.679 3.213
216 HB3 TRP 30 HB1 TRP 30 -15.242 28.273 3.587
217 HD1 TRP 30 HD1 TRP 30 -14.560 25.114 5.208
218 HE1 TRP 30 HE1 TRP 30 -15.944 24.825 7.361
219 HE3 TRP 30 HE3 TRP 30 -18.004 28.823 4.543
220 HZ2 TRP 30 HZ2 TRP 30 -18.214 26.011 8.635
221 HZ3 TRP 30 HZ3 TRP 30 -19.764 29.223 6.240
222 HH2 TRP 30 HH2 TRP 30 -19.873 27.822 8.284
223 H TYR 31 HN TYR 31 -15.278 26.700 0.263
224 HA TYR 31 HA TYR 31 -15.131 29.473 -0.512
225 HB2 TYR 31 HB2 TYR 31 -14.279 26.886 -1.806
226 HB3 TYR 31 HB1 TYR 31 -14.128 28.437 -2.634
227 HD1 TYR 31 HD1 TYR 31 -13.117 26.549 0.408
228 HD2 TYR 31 HD2 TYR 31 -12.406 29.985 -2.064
229 HE1 TYR 31 HE1 TYR 31 -11.024 27.011 1.656
230 HE2 TYR 31 HE2 TYR 31 -10.313 30.450 -0.817
231 HH TYR 31 HH TYR 31 -9.608 29.284 2.086
232 H ILE 32 HN ILE 32 -16.707 26.592 -1.917
233 HA ILE 32 HA ILE 32 -18.050 28.004 -3.980
234 HB ILE 32 HB ILE 32 -19.153 25.967 -4.457
235 HG12 ILE 32 HG12 ILE 32 -18.759 25.334 -1.523
236 HG13 ILE 32 HG11 ILE 32 -20.287 25.539 -2.369
237 HG21 ILE 32 HG21 ILE 32 -16.584 25.916 -4.462
238 HG22 ILE 32 HG22 ILE 32 -17.399 24.353 -4.432
239 HG23 ILE 32 HG23 ILE 32 -16.708 25.014 -2.951
240 HD11 ILE 32 HD11 ILE 32 -18.321 23.260 -2.635
241 HD12 ILE 32 HD12 ILE 32 -19.610 23.542 -3.805
242 HD13 ILE 32 HD13 ILE 32 -20.006 23.182 -2.124
243 H LYS 33 HN LYS 33 -18.973 27.092 -0.697
244 HA LYS 33 HA LYS 33 -21.691 27.769 -0.814
245 HB2 LYS 33 HB2 LYS 33 -19.706 27.776 1.466
246 HB3 LYS 33 HB1 LYS 33 -21.418 28.125 1.692
247 HG2 LYS 33 HG2 LYS 33 -20.679 25.641 0.162
248 HG3 LYS 33 HG1 LYS 33 -20.483 25.622 1.912
249 HD2 LYS 33 HD2 LYS 33 -23.068 26.657 0.762
250 HD3 LYS 33 HD1 LYS 33 -22.805 24.915 0.816
251 HE2 LYS 33 HE2 LYS 33 -22.329 25.077 3.249
252 HE3 LYS 33 HE1 LYS 33 -22.652 26.808 3.183
253 HZ1 LYS 33 HZ1 LYS 33 -24.528 24.565 2.816
254 HZ2 LYS 33 HZ2 LYS 33 -24.878 26.097 2.170
255 HZ3 LYS 33 HZ3 LYS 33 -24.661 25.907 3.844
256 H GLY 34 HN GLY 34 -18.824 29.732 -0.337
257 HA2 GLY 34 HA2 GLY 34 -18.581 32.026 -0.709
258 HA3 GLY 34 HA1 GLY 34 -20.320 32.140 -0.956
259 H ARG 35 HN ARG 35 -20.127 30.448 1.794
260 HA ARG 35 HA ARG 35 -20.621 32.801 3.440
261 HB2 ARG 35 HB2 ARG 35 -20.857 29.832 3.975
262 HB3 ARG 35 HB1 ARG 35 -21.222 31.081 5.166
263 HG2 ARG 35 HG2 ARG 35 -22.948 32.016 3.731
264 HG3 ARG 35 HG1 ARG 35 -22.530 30.890 2.438
265 HD2 ARG 35 HD2 ARG 35 -24.490 30.059 3.628
266 HD3 ARG 35 HD1 ARG 35 -23.121 28.995 3.937
267 HE ARG 35 HE ARG 35 -23.309 31.017 5.944
268 HH11 ARG 35 HH21 ARG 35 -24.719 28.072 4.797
269 HH12 ARG 35 HH22 ARG 35 -25.296 27.580 6.354
270 HH21 ARG 35 HH11 ARG 35 -24.062 30.377 7.989
271 HH22 ARG 35 HH12 ARG 35 -24.923 28.885 8.162
272 H LEU 36 HN LEU 36 -18.160 33.233 2.957
273 HA LEU 36 HA LEU 36 -16.688 32.255 5.321
274 HB2 LEU 36 HB2 LEU 36 -16.048 31.183 2.966
275 HB3 LEU 36 HB1 LEU 36 -15.179 32.699 2.759
276 HG LEU 36 HG LEU 36 -13.656 31.055 3.754
277 HD11 LEU 36 HD11 LEU 36 -12.886 32.341 5.600
278 HD12 LEU 36 HD12 LEU 36 -14.516 32.860 6.016
279 HD13 LEU 36 HD13 LEU 36 -13.728 33.500 4.573
280 HD21 LEU 36 HD21 LEU 36 -15.124 30.784 6.322
281 HD22 LEU 36 HD22 LEU 36 -14.267 29.559 5.389
282 HD23 LEU 36 HD23 LEU 36 -15.917 29.998 4.962
283 H ALA 37 HN ALA 37 -16.373 34.000 6.537
284 HA ALA 37 HA ALA 37 -14.975 36.269 5.473
285 HB1 ALA 37 HB1 ALA 37 -16.678 37.750 5.196
286 HB2 ALA 37 HB2 ALA 37 -17.386 37.322 6.754
287 HB3 ALA 37 HB3 ALA 37 -17.780 36.380 5.318
288 HA PRO 38 HA PRO 38 -13.530 36.996 9.564
289 HB2 PRO 38 HB2 PRO 38 -15.014 39.592 9.754
290 HB3 PRO 38 HB1 PRO 38 -13.288 39.262 9.991
291 HG2 PRO 38 HG2 PRO 38 -14.168 40.450 7.783
292 HG3 PRO 38 HG1 PRO 38 -12.840 39.278 7.727
293 HD2 PRO 38 HD2 PRO 38 -15.696 38.930 6.905
294 HD3 PRO 38 HD1 PRO 38 -14.229 38.226 6.196
295 H GLY 39 HN GLY 39 -14.157 36.247 11.520
296 HA2 GLY 39 HA2 GLY 39 -16.363 36.950 13.023
297 HA3 GLY 39 HA1 GLY 39 -16.892 35.602 12.021
298 H ALA 40 HN ALA 40 -16.829 33.755 13.126
299 HA ALA 40 HA ALA 40 -14.795 33.380 15.222
300 HB1 ALA 40 HB1 ALA 40 -16.190 31.417 15.855
301 HB2 ALA 40 HB2 ALA 40 -17.303 31.825 14.550
302 HB3 ALA 40 HB3 ALA 40 -17.081 32.938 15.899
303 H ALA 41 HN ALA 41 -15.185 32.722 11.974
304 HA ALA 41 HA ALA 41 -14.394 30.076 11.644
305 HB1 ALA 41 HB1 ALA 41 -13.756 30.676 9.424
306 HB2 ALA 41 HB2 ALA 41 -13.477 32.353 9.887
307 HB3 ALA 41 HB3 ALA 41 -15.119 31.712 9.846
308 H TYR 42 HN TYR 42 -12.727 32.409 13.293
309 HA TYR 42 HA TYR 42 -10.045 31.974 12.460
310 HB2 TYR 42 HB2 TYR 42 -11.333 33.098 14.936
311 HB3 TYR 42 HB1 TYR 42 -9.595 32.808 14.908
312 HD1 TYR 42 HD2 TYR 42 -8.427 33.634 12.605
313 HD2 TYR 42 HD1 TYR 42 -12.039 35.227 14.289
314 HE1 TYR 42 HE2 TYR 42 -8.090 35.736 11.336
315 HE2 TYR 42 HE1 TYR 42 -11.706 37.331 13.020
316 HH TYR 42 HH TYR 42 -9.854 37.657 10.463
317 H ALA 43 HN ALA 43 -12.095 30.471 14.921
318 HA ALA 43 HA ALA 43 -10.140 28.865 16.136
319 HB1 ALA 43 HB1 ALA 43 -13.046 28.133 15.736
320 HB2 ALA 43 HB2 ALA 43 -12.482 29.258 16.972
321 HB3 ALA 43 HB3 ALA 43 -11.968 27.571 17.013
322 H PHE 44 HN PHE 44 -12.450 28.035 13.530
323 HA PHE 44 HA PHE 44 -11.441 25.454 13.058
324 HB2 PHE 44 HB2 PHE 44 -13.206 27.379 11.617
325 HB3 PHE 44 HB1 PHE 44 -12.464 26.123 10.630
326 HD1 PHE 44 HD1 PHE 44 -12.658 23.682 11.447
327 HD2 PHE 44 HD2 PHE 44 -15.102 26.884 12.940
328 HE1 PHE 44 HE1 PHE 44 -14.308 22.032 12.288
329 HE2 PHE 44 HE2 PHE 44 -16.751 25.234 13.780
330 HZ PHE 44 HZ PHE 44 -16.354 22.809 13.454
331 H TYR 45 HN TYR 45 -11.069 28.245 10.861
332 HA TYR 45 HA TYR 45 -8.943 27.156 9.396
333 HB2 TYR 45 HB2 TYR 45 -10.294 29.055 8.605
334 HB3 TYR 45 HB1 TYR 45 -9.600 30.074 9.867
335 HD1 TYR 45 HD2 TYR 45 -8.826 28.127 6.802
336 HD2 TYR 45 HD1 TYR 45 -7.396 30.989 9.667
337 HE1 TYR 45 HE2 TYR 45 -6.880 28.614 5.344
338 HE2 TYR 45 HE1 TYR 45 -5.449 31.476 8.208
339 HH TYR 45 HH TYR 45 -4.247 30.679 6.424
340 H GLY 46 HN GLY 46 -9.011 28.395 12.550
341 HA2 GLY 46 HA2 GLY 46 -6.636 29.683 12.991
342 HA3 GLY 46 HA1 GLY 46 -7.324 28.533 14.133
343 H VAL 47 HN VAL 47 -6.762 26.249 13.857
344 HA VAL 47 HA VAL 47 -4.138 25.866 12.518
345 HB VAL 47 HB VAL 47 -3.626 24.255 14.366
346 HG11 VAL 47 HG11 VAL 47 -2.773 26.586 14.364
347 HG12 VAL 47 HG12 VAL 47 -3.070 26.002 16.001
348 HG13 VAL 47 HG13 VAL 47 -4.217 27.102 15.234
349 HG21 VAL 47 HG21 VAL 47 -4.978 24.270 16.369
350 HG22 VAL 47 HG22 VAL 47 -6.058 23.955 15.010
351 HG23 VAL 47 HG23 VAL 47 -5.997 25.562 15.733
352 H TRP 48 HN TRP 48 -6.399 25.356 11.105
353 HA TRP 48 HA TRP 48 -7.376 22.711 11.403
354 HB2 TRP 48 HB2 TRP 48 -8.178 24.845 9.897
355 HB3 TRP 48 HB1 TRP 48 -7.390 23.880 8.652
356 HD1 TRP 48 HD1 TRP 48 -8.177 21.035 10.056
357 HE1 TRP 48 HE1 TRP 48 -10.584 20.179 9.756
358 HE3 TRP 48 HE3 TRP 48 -10.520 25.405 8.834
359 HZ2 TRP 48 HZ2 TRP 48 -13.168 21.210 9.084
360 HZ3 TRP 48 HZ3 TRP 48 -12.954 25.437 8.368
361 HH2 TRP 48 HH2 TRP 48 -14.280 23.345 8.491
362 HA PRO 49 HA PRO 49 -4.061 21.856 7.868
363 HB2 PRO 49 HB2 PRO 49 -1.934 23.740 8.775
364 HB3 PRO 49 HB1 PRO 49 -2.491 23.378 7.130
365 HG2 PRO 49 HG2 PRO 49 -3.088 25.686 8.299
366 HG3 PRO 49 HG1 PRO 49 -4.261 24.856 7.260
367 HD2 PRO 49 HD2 PRO 49 -4.167 24.961 10.269
368 HD3 PRO 49 HD1 PRO 49 -5.566 25.073 9.184
369 H LEU 50 HN LEU 50 -3.322 22.690 11.185
370 HA LEU 50 HA LEU 50 -1.118 20.878 11.468
371 HB2 LEU 50 HB2 LEU 50 -1.358 22.856 12.912
372 HB3 LEU 50 HB1 LEU 50 -2.845 22.189 13.581
373 HG LEU 50 HG LEU 50 -0.552 20.301 13.700
374 HD11 LEU 50 HD11 LEU 50 -0.473 22.920 15.221
375 HD12 LEU 50 HD12 LEU 50 0.751 22.284 14.125
376 HD13 LEU 50 HD13 LEU 50 0.467 21.498 15.677
377 HD21 LEU 50 HD21 LEU 50 -1.433 19.888 15.924
378 HD22 LEU 50 HD22 LEU 50 -2.800 20.035 14.821
379 HD23 LEU 50 HD23 LEU 50 -2.373 21.379 15.876
380 H LEU 51 HN LEU 51 -4.578 20.643 11.761
381 HA LEU 51 HA LEU 51 -4.404 17.997 13.039
382 HB2 LEU 51 HB2 LEU 51 -6.105 19.891 13.670
383 HB3 LEU 51 HB1 LEU 51 -6.985 19.334 12.247
384 HG LEU 51 HG LEU 51 -6.586 16.931 13.358
385 HD11 LEU 51 HD11 LEU 51 -5.223 18.086 15.214
386 HD12 LEU 51 HD12 LEU 51 -6.454 16.935 15.733
387 HD13 LEU 51 HD13 LEU 51 -6.770 18.667 15.826
388 HD21 LEU 51 HD21 LEU 51 -8.774 17.208 14.553
389 HD22 LEU 51 HD22 LEU 51 -8.796 17.851 12.911
390 HD23 LEU 51 HD23 LEU 51 -8.657 18.948 14.285
391 H LEU 52 HN LEU 52 -3.901 18.932 10.054
392 HA LEU 52 HA LEU 52 -5.812 17.347 8.569
393 HB2 LEU 52 HB2 LEU 52 -4.786 19.388 7.617
394 HB3 LEU 52 HB1 LEU 52 -3.212 18.598 7.650
395 HG LEU 52 HG LEU 52 -5.331 17.002 6.296
396 HD11 LEU 52 HD11 LEU 52 -5.255 18.361 4.218
397 HD12 LEU 52 HD12 LEU 52 -4.356 19.607 5.085
398 HD13 LEU 52 HD13 LEU 52 -6.017 19.235 5.548
399 HD21 LEU 52 HD21 LEU 52 -3.551 16.417 4.839
400 HD22 LEU 52 HD22 LEU 52 -2.765 16.622 6.402
401 HD23 LEU 52 HD23 LEU 52 -2.661 17.898 5.193
402 H LEU 53 HN LEU 53 -2.417 16.997 9.515
403 HA LEU 53 HA LEU 53 -1.687 14.735 8.122
404 HB2 LEU 53 HB2 LEU 53 0.019 14.359 9.835
405 HB3 LEU 53 HB1 LEU 53 -0.168 16.094 9.637
406 HG LEU 53 HG LEU 53 -0.108 15.757 12.040
407 HD11 LEU 53 HD11 LEU 53 -3.052 15.770 11.421
408 HD12 LEU 53 HD12 LEU 53 -2.016 17.158 11.158
409 HD13 LEU 53 HD13 LEU 53 -2.258 16.525 12.781
410 HD21 LEU 53 HD21 LEU 53 -0.883 13.159 11.520
411 HD22 LEU 53 HD22 LEU 53 -2.342 13.816 12.248
412 HD23 LEU 53 HD23 LEU 53 -0.825 13.858 13.131
413 H LEU 54 HN LEU 54 -4.237 14.953 10.262
414 HA LEU 54 HA LEU 54 -4.164 12.526 11.652
415 HB2 LEU 54 HB2 LEU 54 -5.859 14.590 11.723
416 HB3 LEU 54 HB1 LEU 54 -6.797 13.557 10.651
417 HG LEU 54 HG LEU 54 -7.486 13.097 12.954
418 HD11 LEU 54 HD11 LEU 54 -7.259 10.737 12.942
419 HD12 LEU 54 HD12 LEU 54 -5.655 10.810 12.221
420 HD13 LEU 54 HD13 LEU 54 -7.076 11.183 11.248
421 HD21 LEU 54 HD21 LEU 54 -6.042 12.980 14.740
422 HD22 LEU 54 HD22 LEU 54 -4.891 13.759 13.658
423 HD23 LEU 54 HD23 LEU 54 -4.869 12.009 13.850
424 H LEU 55 HN LEU 55 -5.822 13.263 8.569
425 HA LEU 55 HA LEU 55 -6.567 10.565 8.080
426 HB2 LEU 55 HB2 LEU 55 -7.747 12.446 7.043
427 HB3 LEU 55 HB1 LEU 55 -6.290 12.892 6.160
428 HG LEU 55 HG LEU 55 -7.068 10.045 5.795
429 HD11 LEU 55 HD11 LEU 55 -8.938 10.538 4.264
430 HD12 LEU 55 HD12 LEU 55 -8.837 12.247 4.688
431 HD13 LEU 55 HD13 LEU 55 -9.312 11.062 5.906
432 HD21 LEU 55 HD21 LEU 55 -5.292 11.212 4.495
433 HD22 LEU 55 HD22 LEU 55 -6.511 12.300 3.836
434 HD23 LEU 55 HD23 LEU 55 -6.561 10.581 3.447
435 H ALA 56 HN ALA 56 -4.012 12.623 6.669
436 HA ALA 56 HA ALA 56 -2.878 10.581 5.083
437 HB1 ALA 56 HB1 ALA 56 -1.757 13.174 6.152
438 HB2 ALA 56 HB2 ALA 56 -2.395 12.862 4.538
439 HB3 ALA 56 HB3 ALA 56 -0.876 12.123 5.044
440 H LEU 57 HN LEU 57 -2.520 11.453 8.444
441 HA LEU 57 HA LEU 57 -0.784 9.136 8.850
442 HB2 LEU 57 HB2 LEU 57 -0.024 11.966 9.552
443 HB3 LEU 57 HB1 LEU 57 0.673 10.582 10.388
444 HG LEU 57 HG LEU 57 0.992 9.830 7.732
445 HD11 LEU 57 HD11 LEU 57 1.741 12.752 7.777
446 HD12 LEU 57 HD12 LEU 57 0.164 12.227 7.191
447 HD13 LEU 57 HD13 LEU 57 1.633 11.666 6.391
448 HD21 LEU 57 HD21 LEU 57 2.836 11.327 9.600
449 HD22 LEU 57 HD22 LEU 57 3.383 10.700 8.044
450 HD23 LEU 57 HD23 LEU 57 2.781 9.592 9.280
451 HA PRO 58 HA PRO 58 -4.205 8.990 11.920
452 HB2 PRO 58 HB2 PRO 58 -2.674 6.492 12.546
453 HB3 PRO 58 HB1 PRO 58 -4.420 6.707 12.310
454 HG2 PRO 58 HG2 PRO 58 -2.885 5.590 10.448
455 HG3 PRO 58 HG1 PRO 58 -4.281 6.601 10.038
456 HD2 PRO 58 HD2 PRO 58 -1.378 7.216 9.816
457 HD3 PRO 58 HD1 PRO 58 -2.744 7.863 8.876
458 HA PRO 59 HA PRO 59 -2.532 10.132 15.861
459 HB2 PRO 59 HB2 PRO 59 -3.047 7.452 17.090
460 HB3 PRO 59 HB1 PRO 59 -3.579 9.056 17.626
461 HG2 PRO 59 HG2 PRO 59 -5.277 7.379 16.477
462 HG3 PRO 59 HG1 PRO 59 -5.341 9.118 16.126
463 HD2 PRO 59 HD2 PRO 59 -4.234 6.896 14.450
464 HD3 PRO 59 HD1 PRO 59 -5.121 8.347 13.931
465 H ARG 60 HN ARG 60 -1.446 7.023 14.658
466 HA ARG 60 HA ARG 60 0.675 6.342 16.217
467 HB2 ARG 60 HB2 ARG 60 0.712 6.428 13.187
468 HB3 ARG 60 HB1 ARG 60 1.748 5.436 14.215
469 HG2 ARG 60 HG2 ARG 60 -0.204 4.253 15.093
470 HG3 ARG 60 HG1 ARG 60 -1.280 5.280 14.145
471 HD2 ARG 60 HD2 ARG 60 -0.053 4.468 12.082
472 HD3 ARG 60 HD1 ARG 60 0.746 3.286 13.110
473 HE ARG 60 HE ARG 60 -1.926 3.120 12.124
474 HH11 ARG 60 HH21 ARG 60 0.095 2.469 14.857
475 HH12 ARG 60 HH22 ARG 60 -0.874 1.156 15.435
476 HH21 ARG 60 HH11 ARG 60 -3.202 1.401 12.878
477 HH22 ARG 60 HH12 ARG 60 -2.743 0.551 14.316
478 H ALA 61 HN ALA 61 0.341 9.206 14.302
479 HA ALA 61 HA ALA 61 3.184 9.909 14.742
480 HB1 ALA 61 HB1 ALA 61 2.378 10.008 12.396
481 HB2 ALA 61 HB2 ALA 61 2.891 11.583 13.002
482 HB3 ALA 61 HB3 ALA 61 1.174 11.201 12.882
483 H TYR 62 HN TYR 62 3.396 12.429 14.956
484 HA TYR 62 HA TYR 62 1.290 13.736 16.428
485 HB2 TYR 62 HB2 TYR 62 2.827 14.049 18.461
486 HB3 TYR 62 HB1 TYR 62 2.034 12.483 18.290
487 HD1 TYR 62 HD2 TYR 62 3.289 10.500 17.567
488 HD2 TYR 62 HD1 TYR 62 5.219 14.302 18.087
489 HE1 TYR 62 HE2 TYR 62 5.504 9.382 17.518
490 HE2 TYR 62 HE1 TYR 62 7.434 13.185 18.037
491 HH TYR 62 HH TYR 62 8.224 10.725 16.876
492 H ALA 63 HN ALA 63 2.979 14.182 14.063
493 HA ALA 63 HA ALA 63 4.963 16.136 14.648
494 HB1 ALA 63 HB1 ALA 63 4.939 16.588 12.260
495 HB2 ALA 63 HB2 ALA 63 3.405 15.736 12.084
496 HB3 ALA 63 HB3 ALA 63 4.863 14.846 12.525
Start of MODEL 10
1 H1 ALA 1 HT1 ALA 1 5.711 2.508 13.195
2 H2 ALA 1 HT2 ALA 1 4.947 3.810 12.414
3 H3 ALA 1 HT3 ALA 1 6.404 4.055 13.252
4 HA ALA 1 HA ALA 1 7.378 3.854 11.269
5 HB1 ALA 1 HB1 ALA 1 6.576 0.976 11.790
6 HB2 ALA 1 HB2 ALA 1 8.046 1.773 12.352
7 HB3 ALA 1 HB3 ALA 1 7.806 1.478 10.630
8 H LEU 2 HN LEU 2 4.133 3.553 11.407
9 HA LEU 2 HA LEU 2 3.744 2.781 8.587
10 HB2 LEU 2 HB2 LEU 2 1.686 3.377 10.730
11 HB3 LEU 2 HB1 LEU 2 1.377 2.685 9.138
12 HG LEU 2 HG LEU 2 3.138 1.398 11.250
13 HD11 LEU 2 HD11 LEU 2 0.285 0.795 10.406
14 HD12 LEU 2 HD12 LEU 2 0.800 1.412 11.976
15 HD13 LEU 2 HD13 LEU 2 1.255 -0.218 11.477
16 HD21 LEU 2 HD21 LEU 2 2.212 0.600 8.485
17 HD22 LEU 2 HD22 LEU 2 2.672 -0.622 9.670
18 HD23 LEU 2 HD23 LEU 2 3.847 0.577 9.143
19 H GLU 3 HN GLU 3 3.495 4.258 7.053
20 HA GLU 3 HA GLU 3 3.298 7.082 7.808
21 HB2 GLU 3 HB2 GLU 3 4.864 5.984 5.967
22 HB3 GLU 3 HB1 GLU 3 3.433 6.144 4.952
23 HG2 GLU 3 HG2 GLU 3 3.321 8.571 5.557
24 HG3 GLU 3 HG1 GLU 3 4.811 8.380 6.474
25 H ASN 4 HN ASN 4 2.086 7.508 5.034
26 HA ASN 4 HA ASN 4 -0.690 7.482 5.917
27 HB2 ASN 4 HB2 ASN 4 0.427 9.462 4.788
28 HB3 ASN 4 HB1 ASN 4 0.394 8.523 3.296
29 HD21 ASN 4 HD21 ASN 4 -1.421 8.957 2.044
30 HD22 ASN 4 HD22 ASN 4 -2.935 9.427 2.652
31 H LEU 5 HN LEU 5 1.195 5.213 4.547
32 HA LEU 5 HA LEU 5 -0.354 4.346 2.330
33 HB2 LEU 5 HB2 LEU 5 1.979 3.644 2.624
34 HB3 LEU 5 HB1 LEU 5 1.547 2.782 4.099
35 HG LEU 5 HG LEU 5 0.064 1.287 2.809
36 HD11 LEU 5 HD11 LEU 5 0.425 1.474 0.206
37 HD12 LEU 5 HD12 LEU 5 0.836 3.149 0.571
38 HD13 LEU 5 HD13 LEU 5 -0.756 2.517 0.992
39 HD21 LEU 5 HD21 LEU 5 1.827 0.140 1.475
40 HD22 LEU 5 HD22 LEU 5 2.399 0.611 3.075
41 HD23 LEU 5 HD23 LEU 5 2.860 1.557 1.660
42 H VAL 6 HN VAL 6 0.138 2.219 5.073
43 HA VAL 6 HA VAL 6 -2.094 0.682 4.890
44 HB VAL 6 HB VAL 6 -0.888 1.711 7.470
45 HG11 VAL 6 HG11 VAL 6 -2.733 -0.612 6.858
46 HG12 VAL 6 HG12 VAL 6 -3.030 0.730 7.964
47 HG13 VAL 6 HG13 VAL 6 -1.809 -0.480 8.354
48 HG21 VAL 6 HG21 VAL 6 0.757 0.619 6.035
49 HG22 VAL 6 HG22 VAL 6 -0.339 -0.736 5.762
50 HG23 VAL 6 HG23 VAL 6 0.344 -0.464 7.364
51 H VAL 7 HN VAL 7 -1.960 3.706 6.764
52 HA VAL 7 HA VAL 7 -4.455 3.892 7.804
53 HB VAL 7 HB VAL 7 -4.015 6.128 8.104
54 HG11 VAL 7 HG11 VAL 7 -1.445 5.385 6.684
55 HG12 VAL 7 HG12 VAL 7 -1.815 4.962 8.356
56 HG13 VAL 7 HG13 VAL 7 -1.649 6.651 7.886
57 HG21 VAL 7 HG21 VAL 7 -4.738 6.912 5.949
58 HG22 VAL 7 HG22 VAL 7 -3.331 6.209 5.158
59 HG23 VAL 7 HG23 VAL 7 -3.140 7.603 6.214
60 H LEU 8 HN LEU 8 -3.665 4.088 4.382
61 HA LEU 8 HA LEU 8 -5.980 5.289 3.397
62 HB2 LEU 8 HB2 LEU 8 -3.779 4.473 2.180
63 HB3 LEU 8 HB1 LEU 8 -4.720 3.018 1.881
64 HG LEU 8 HG LEU 8 -4.996 4.521 -0.014
65 HD11 LEU 8 HD11 LEU 8 -7.004 3.255 0.981
66 HD12 LEU 8 HD12 LEU 8 -7.368 4.577 -0.124
67 HD13 LEU 8 HD13 LEU 8 -7.520 4.820 1.615
68 HD21 LEU 8 HD21 LEU 8 -6.368 6.682 1.512
69 HD22 LEU 8 HD22 LEU 8 -5.265 6.800 0.143
70 HD23 LEU 8 HD23 LEU 8 -4.626 6.587 1.770
71 H ASN 9 HN ASN 9 -5.384 1.772 3.191
72 HA ASN 9 HA ASN 9 -8.155 1.185 2.850
73 HB2 ASN 9 HB2 ASN 9 -7.452 -1.175 3.045
74 HB3 ASN 9 HB1 ASN 9 -6.427 -0.280 1.928
75 HD21 ASN 9 HD21 ASN 9 -5.836 -2.718 3.707
76 HD22 ASN 9 HD22 ASN 9 -4.450 -2.262 4.576
77 H ALA 10 HN ALA 10 -5.966 1.225 5.602
78 HA ALA 10 HA ALA 10 -7.611 -0.150 7.436
79 HB1 ALA 10 HB1 ALA 10 -6.249 1.434 9.098
80 HB2 ALA 10 HB2 ALA 10 -5.309 1.740 7.641
81 HB3 ALA 10 HB3 ALA 10 -5.460 0.100 8.258
82 H ALA 11 HN ALA 11 -7.234 3.354 6.820
83 HA ALA 11 HA ALA 11 -9.188 4.196 8.676
84 HB1 ALA 11 HB1 ALA 11 -9.111 6.332 7.519
85 HB2 ALA 11 HB2 ALA 11 -8.329 5.588 6.131
86 HB3 ALA 11 HB3 ALA 11 -7.477 5.692 7.674
87 H SER 12 HN SER 12 -9.369 3.358 5.254
88 HA SER 12 HA SER 12 -12.035 4.186 4.803
89 HB2 SER 12 HB2 SER 12 -10.481 3.640 2.974
90 HB3 SER 12 HB1 SER 12 -10.481 1.951 3.476
91 HG SER 12 HG SER 12 -12.997 2.911 3.205
92 H VAL 13 HN VAL 13 -10.681 1.029 5.727
93 HA VAL 13 HA VAL 13 -13.264 -0.212 5.956
94 HB VAL 13 HB VAL 13 -10.560 -1.101 6.987
95 HG11 VAL 13 HG11 VAL 13 -11.695 -3.364 6.918
96 HG12 VAL 13 HG12 VAL 13 -13.223 -2.513 6.685
97 HG13 VAL 13 HG13 VAL 13 -12.299 -2.277 8.170
98 HG21 VAL 13 HG21 VAL 13 -12.049 -2.045 4.529
99 HG22 VAL 13 HG22 VAL 13 -10.365 -2.349 4.962
100 HG23 VAL 13 HG23 VAL 13 -10.871 -0.733 4.468
101 H ALA 14 HN ALA 14 -10.867 1.034 8.254
102 HA ALA 14 HA ALA 14 -12.093 0.311 10.640
103 HB1 ALA 14 HB1 ALA 14 -10.920 2.289 11.619
104 HB2 ALA 14 HB2 ALA 14 -10.500 2.796 9.985
105 HB3 ALA 14 HB3 ALA 14 -9.874 1.276 10.624
106 H GLY 15 HN GLY 15 -12.392 3.477 8.992
107 HA2 GLY 15 HA2 GLY 15 -14.354 4.733 8.685
108 HA3 GLY 15 HA1 GLY 15 -15.210 3.629 9.758
109 H ALA 16 HN ALA 16 -12.486 4.195 11.396
110 HA ALA 16 HA ALA 16 -13.696 5.876 13.327
111 HB1 ALA 16 HB1 ALA 16 -10.785 5.154 12.912
112 HB2 ALA 16 HB2 ALA 16 -11.938 4.305 13.942
113 HB3 ALA 16 HB3 ALA 16 -11.433 5.945 14.348
114 H HIS 17 HN HIS 17 -11.460 6.501 10.667
115 HA HIS 17 HA HIS 17 -11.177 9.308 11.379
116 HB2 HIS 17 HB2 HIS 17 -10.027 7.513 9.265
117 HB3 HIS 17 HB1 HIS 17 -9.945 9.259 9.051
118 HD2 HIS 17 HD2 HIS 17 -7.625 10.240 10.153
119 HE1 HIS 17 HE1 HIS 17 -7.132 7.382 13.219
120 HE2 HIS 17 HE2 HIS 17 -6.133 9.455 12.147
121 H GLY 18 HN GLY 18 -13.748 7.863 10.416
122 HA2 GLY 18 HA2 GLY 18 -14.472 8.948 7.896
123 HA3 GLY 18 HA1 GLY 18 -15.594 8.384 9.129
124 H ILE 19 HN ILE 19 -15.215 10.018 11.208
125 HA ILE 19 HA ILE 19 -16.532 12.414 10.426
126 HB ILE 19 HB ILE 19 -15.168 11.893 13.078
127 HG12 ILE 19 HG12 ILE 19 -16.580 9.977 12.671
128 HG13 ILE 19 HG11 ILE 19 -17.469 11.040 13.759
129 HG21 ILE 19 HG21 ILE 19 -17.561 13.564 12.255
130 HG22 ILE 19 HG22 ILE 19 -15.972 14.190 12.694
131 HG23 ILE 19 HG23 ILE 19 -16.967 13.382 13.906
132 HD11 ILE 19 HD11 ILE 19 -17.918 10.560 10.819
133 HD12 ILE 19 HD12 ILE 19 -18.511 12.032 11.591
134 HD13 ILE 19 HD13 ILE 19 -19.081 10.456 12.140
135 H LEU 20 HN LEU 20 -13.227 11.633 11.338
136 HA LEU 20 HA LEU 20 -12.278 14.331 11.363
137 HB2 LEU 20 HB2 LEU 20 -10.967 11.625 11.273
138 HB3 LEU 20 HB1 LEU 20 -10.000 13.074 11.011
139 HG LEU 20 HG LEU 20 -10.804 13.991 13.162
140 HD11 LEU 20 HD11 LEU 20 -11.971 12.290 14.692
141 HD12 LEU 20 HD12 LEU 20 -12.309 11.370 13.227
142 HD13 LEU 20 HD13 LEU 20 -12.953 13.000 13.412
143 HD21 LEU 20 HD21 LEU 20 -9.688 11.179 13.407
144 HD22 LEU 20 HD22 LEU 20 -9.567 12.451 14.623
145 HD23 LEU 20 HD23 LEU 20 -8.731 12.624 13.081
146 H SER 21 HN SER 21 -12.344 11.758 8.929
147 HA SER 21 HA SER 21 -10.907 13.157 6.937
148 HB2 SER 21 HB2 SER 21 -11.898 11.513 5.377
149 HB3 SER 21 HB1 SER 21 -11.241 10.742 6.817
150 HG SER 21 HG SER 21 -13.560 10.321 5.960
151 H PHE 22 HN PHE 22 -14.383 12.864 7.591
152 HA PHE 22 HA PHE 22 -15.195 14.455 5.379
153 HB2 PHE 22 HB2 PHE 22 -16.469 13.268 7.783
154 HB3 PHE 22 HB1 PHE 22 -17.261 14.721 7.182
155 HD1 PHE 22 HD2 PHE 22 -17.685 14.825 4.605
156 HD2 PHE 22 HD1 PHE 22 -16.953 11.190 6.772
157 HE1 PHE 22 HE2 PHE 22 -18.734 13.521 2.774
158 HE2 PHE 22 HE1 PHE 22 -18.002 9.886 4.943
159 HZ PHE 22 HZ PHE 22 -18.893 11.052 2.943
160 H LEU 23 HN LEU 23 -13.994 15.225 8.558
161 HA LEU 23 HA LEU 23 -15.059 17.799 8.868
162 HB2 LEU 23 HB2 LEU 23 -13.708 16.331 10.539
163 HB3 LEU 23 HB1 LEU 23 -12.290 17.060 9.793
164 HG LEU 23 HG LEU 23 -13.605 19.331 10.218
165 HD11 LEU 23 HD11 LEU 23 -15.672 18.299 11.035
166 HD12 LEU 23 HD12 LEU 23 -14.913 19.210 12.337
167 HD13 LEU 23 HD13 LEU 23 -14.776 17.453 12.295
168 HD21 LEU 23 HD21 LEU 23 -11.470 18.916 11.238
169 HD22 LEU 23 HD22 LEU 23 -12.151 17.704 12.322
170 HD23 LEU 23 HD23 LEU 23 -12.562 19.406 12.532
171 H VAL 24 HN VAL 24 -12.137 16.689 7.193
172 HA VAL 24 HA VAL 24 -11.190 19.339 6.612
173 HB VAL 24 HB VAL 24 -9.882 17.034 6.663
174 HG11 VAL 24 HG11 VAL 24 -9.672 15.881 4.613
175 HG12 VAL 24 HG12 VAL 24 -10.379 17.209 3.692
176 HG13 VAL 24 HG13 VAL 24 -11.393 16.212 4.719
177 HG21 VAL 24 HG21 VAL 24 -8.210 18.026 5.041
178 HG22 VAL 24 HG22 VAL 24 -8.744 19.136 6.305
179 HG23 VAL 24 HG23 VAL 24 -9.403 19.272 4.674
180 H PHE 25 HN PHE 25 -13.212 16.971 4.987
181 HA PHE 25 HA PHE 25 -13.258 18.252 2.459
182 HB2 PHE 25 HB2 PHE 25 -14.175 15.840 3.433
183 HB3 PHE 25 HB1 PHE 25 -15.686 16.717 3.213
184 HD1 PHE 25 HD2 PHE 25 -16.383 17.502 0.988
185 HD2 PHE 25 HD1 PHE 25 -12.756 15.265 1.535
186 HE1 PHE 25 HE2 PHE 25 -16.255 17.109 -1.457
187 HE2 PHE 25 HE1 PHE 25 -12.628 14.874 -0.909
188 HZ PHE 25 HZ PHE 25 -14.377 15.796 -2.405
189 H PHE 26 HN PHE 26 -15.449 18.370 5.259
190 HA PHE 26 HA PHE 26 -17.406 20.033 4.177
191 HB2 PHE 26 HB2 PHE 26 -16.468 19.385 6.941
192 HB3 PHE 26 HB1 PHE 26 -17.493 20.808 6.763
193 HD1 PHE 26 HD2 PHE 26 -19.550 20.387 5.046
194 HD2 PHE 26 HD1 PHE 26 -17.581 17.370 7.385
195 HE1 PHE 26 HE2 PHE 26 -21.561 18.947 4.881
196 HE2 PHE 26 HE1 PHE 26 -19.592 15.930 7.220
197 HZ PHE 26 HZ PHE 26 -21.583 16.717 5.967
198 H SER 27 HN SER 27 -14.207 20.767 5.358
199 HA SER 27 HA SER 27 -14.451 23.519 5.804
200 HB2 SER 27 HB2 SER 27 -12.052 22.101 4.627
201 HB3 SER 27 HB1 SER 27 -12.055 23.632 5.493
202 HG SER 27 HG SER 27 -12.440 21.017 6.440
203 H ALA 28 HN ALA 28 -14.048 21.666 2.828
204 HA ALA 28 HA ALA 28 -13.532 23.879 1.127
205 HB1 ALA 28 HB1 ALA 28 -13.052 21.515 0.520
206 HB2 ALA 28 HB2 ALA 28 -14.027 22.343 -0.694
207 HB3 ALA 28 HB3 ALA 28 -14.787 21.214 0.428
208 H ALA 29 HN ALA 29 -16.487 22.215 2.151
209 HA ALA 29 HA ALA 29 -18.356 23.329 0.452
210 HB1 ALA 29 HB1 ALA 29 -18.744 22.909 3.423
211 HB2 ALA 29 HB2 ALA 29 -18.828 21.623 2.217
212 HB3 ALA 29 HB3 ALA 29 -20.000 22.941 2.185
213 H TRP 30 HN TRP 30 -16.763 24.758 3.230
214 HA TRP 30 HA TRP 30 -18.380 27.153 3.207
215 HB2 TRP 30 HB2 TRP 30 -15.708 26.748 4.555
216 HB3 TRP 30 HB1 TRP 30 -16.960 27.920 4.969
217 HD1 TRP 30 HD1 TRP 30 -19.166 25.337 4.381
218 HE1 TRP 30 HE1 TRP 30 -19.603 23.815 6.407
219 HE3 TRP 30 HE3 TRP 30 -15.119 26.523 7.264
220 HZ2 TRP 30 HZ2 TRP 30 -18.400 23.180 8.924
221 HZ3 TRP 30 HZ3 TRP 30 -14.794 25.444 9.468
222 HH2 TRP 30 HH2 TRP 30 -16.424 23.774 10.303
223 H TYR 31 HN TYR 31 -15.283 26.105 1.916
224 HA TYR 31 HA TYR 31 -14.304 28.637 1.131
225 HB2 TYR 31 HB2 TYR 31 -12.849 26.683 1.221
226 HB3 TYR 31 HB1 TYR 31 -13.787 25.899 -0.053
227 HD1 TYR 31 HD2 TYR 31 -13.758 26.782 -2.366
228 HD2 TYR 31 HD1 TYR 31 -11.301 28.470 0.727
229 HE1 TYR 31 HE2 TYR 31 -12.397 27.943 -4.082
230 HE2 TYR 31 HE1 TYR 31 -9.939 29.631 -0.991
231 HH TYR 31 HH TYR 31 -9.731 28.864 -3.997
232 H ILE 32 HN ILE 32 -16.203 26.193 -0.599
233 HA ILE 32 HA ILE 32 -16.373 27.677 -3.036
234 HB ILE 32 HB ILE 32 -16.695 25.258 -3.027
235 HG12 ILE 32 HG12 ILE 32 -19.343 26.573 -3.685
236 HG13 ILE 32 HG11 ILE 32 -17.904 26.766 -4.689
237 HG21 ILE 32 HG21 ILE 32 -18.581 24.217 -1.944
238 HG22 ILE 32 HG22 ILE 32 -19.263 25.783 -1.509
239 HG23 ILE 32 HG23 ILE 32 -17.776 25.227 -0.748
240 HD11 ILE 32 HD11 ILE 32 -17.784 24.380 -5.085
241 HD12 ILE 32 HD12 ILE 32 -19.426 24.911 -5.447
242 HD13 ILE 32 HD13 ILE 32 -19.081 24.079 -3.930
243 H LYS 33 HN LYS 33 -18.478 27.325 -0.208
244 HA LYS 33 HA LYS 33 -20.665 28.798 -1.230
245 HB2 LYS 33 HB2 LYS 33 -20.669 27.304 0.822
246 HB3 LYS 33 HB1 LYS 33 -19.849 28.610 1.676
247 HG2 LYS 33 HG2 LYS 33 -22.078 29.100 2.180
248 HG3 LYS 33 HG1 LYS 33 -21.847 30.081 0.735
249 HD2 LYS 33 HD2 LYS 33 -22.839 28.312 -0.652
250 HD3 LYS 33 HD1 LYS 33 -23.014 27.279 0.765
251 HE2 LYS 33 HE2 LYS 33 -24.318 29.997 0.450
252 HE3 LYS 33 HE1 LYS 33 -25.128 28.457 0.167
253 HZ1 LYS 33 HZ1 LYS 33 -23.815 29.169 2.727
254 HZ2 LYS 33 HZ2 LYS 33 -24.829 27.842 2.420
255 HZ3 LYS 33 HZ3 LYS 33 -25.466 29.416 2.424
256 H GLY 34 HN GLY 34 -17.892 29.773 0.781
257 HA2 GLY 34 HA2 GLY 34 -16.771 31.842 0.638
258 HA3 GLY 34 HA1 GLY 34 -18.140 32.511 -0.245
259 H ARG 35 HN ARG 35 -19.213 30.735 2.395
260 HA ARG 35 HA ARG 35 -20.113 33.098 3.758
261 HB2 ARG 35 HB2 ARG 35 -21.269 30.768 3.598
262 HB3 ARG 35 HB1 ARG 35 -20.213 30.324 4.937
263 HG2 ARG 35 HG2 ARG 35 -22.038 31.137 6.135
264 HG3 ARG 35 HG1 ARG 35 -21.114 32.628 5.963
265 HD2 ARG 35 HD2 ARG 35 -22.440 33.027 3.807
266 HD3 ARG 35 HD1 ARG 35 -23.489 31.715 4.329
267 HE ARG 35 HE ARG 35 -24.354 33.112 5.994
268 HH11 ARG 35 HH21 ARG 35 -21.549 34.468 4.486
269 HH12 ARG 35 HH22 ARG 35 -21.750 36.033 5.202
270 HH21 ARG 35 HH11 ARG 35 -24.625 35.163 6.936
271 HH22 ARG 35 HH12 ARG 35 -23.491 36.426 6.588
272 H LEU 36 HN LEU 36 -17.332 31.097 3.927
273 HA LEU 36 HA LEU 36 -16.547 31.257 6.574
274 HB2 LEU 36 HB2 LEU 36 -14.280 30.982 5.795
275 HB3 LEU 36 HB1 LEU 36 -15.350 30.018 4.779
276 HG LEU 36 HG LEU 36 -15.320 32.486 3.453
277 HD11 LEU 36 HD11 LEU 36 -12.531 31.886 4.484
278 HD12 LEU 36 HD12 LEU 36 -13.497 33.307 4.876
279 HD13 LEU 36 HD13 LEU 36 -12.919 33.062 3.227
280 HD21 LEU 36 HD21 LEU 36 -13.728 29.948 3.057
281 HD22 LEU 36 HD22 LEU 36 -13.668 31.274 1.896
282 HD23 LEU 36 HD23 LEU 36 -15.197 30.459 2.228
283 H ALA 37 HN ALA 37 -17.332 33.852 4.686
284 HA ALA 37 HA ALA 37 -15.505 35.834 4.897
285 HB1 ALA 37 HB1 ALA 37 -18.359 35.696 4.677
286 HB2 ALA 37 HB2 ALA 37 -17.309 37.029 4.207
287 HB3 ALA 37 HB3 ALA 37 -17.979 36.967 5.835
288 HA PRO 38 HA PRO 38 -14.240 36.982 8.942
289 HB2 PRO 38 HB2 PRO 38 -16.024 39.397 8.778
290 HB3 PRO 38 HB1 PRO 38 -14.315 39.290 9.248
291 HG2 PRO 38 HG2 PRO 38 -15.100 40.153 6.812
292 HG3 PRO 38 HG1 PRO 38 -13.578 39.283 7.076
293 HD2 PRO 38 HD2 PRO 38 -16.030 38.350 5.705
294 HD3 PRO 38 HD1 PRO 38 -14.378 37.698 5.628
295 H GLY 39 HN GLY 39 -14.945 36.029 10.770
296 HA2 GLY 39 HA2 GLY 39 -17.159 36.657 12.269
297 HA3 GLY 39 HA1 GLY 39 -17.702 35.378 11.187
298 H ALA 40 HN ALA 40 -17.593 33.415 12.059
299 HA ALA 40 HA ALA 40 -15.721 32.901 14.269
300 HB1 ALA 40 HB1 ALA 40 -18.136 31.413 13.227
301 HB2 ALA 40 HB2 ALA 40 -17.963 32.255 14.768
302 HB3 ALA 40 HB3 ALA 40 -17.066 30.765 14.471
303 H ALA 41 HN ALA 41 -16.009 32.379 10.921
304 HA ALA 41 HA ALA 41 -14.777 29.848 10.651
305 HB1 ALA 41 HB1 ALA 41 -16.000 31.152 8.853
306 HB2 ALA 41 HB2 ALA 41 -14.476 30.416 8.352
307 HB3 ALA 41 HB3 ALA 41 -14.547 32.143 8.702
308 H TYR 42 HN TYR 42 -13.562 32.750 11.817
309 HA TYR 42 HA TYR 42 -10.921 32.756 10.812
310 HB2 TYR 42 HB2 TYR 42 -11.876 34.690 11.965
311 HB3 TYR 42 HB1 TYR 42 -11.983 33.764 13.461
312 HD1 TYR 42 HD1 TYR 42 -9.632 35.199 10.972
313 HD2 TYR 42 HD2 TYR 42 -10.064 33.395 14.846
314 HE1 TYR 42 HE1 TYR 42 -7.285 35.794 11.510
315 HE2 TYR 42 HE2 TYR 42 -7.716 33.990 15.384
316 HH TYR 42 HH TYR 42 -5.477 34.869 13.113
317 H ALA 43 HN ALA 43 -12.427 31.110 13.541
318 HA ALA 43 HA ALA 43 -10.130 30.199 14.855
319 HB1 ALA 43 HB1 ALA 43 -11.570 28.445 15.789
320 HB2 ALA 43 HB2 ALA 43 -12.794 28.790 14.569
321 HB3 ALA 43 HB3 ALA 43 -12.400 30.001 15.789
322 H PHE 44 HN PHE 44 -11.950 28.746 12.171
323 HA PHE 44 HA PHE 44 -10.455 26.352 12.004
324 HB2 PHE 44 HB2 PHE 44 -12.107 27.885 9.998
325 HB3 PHE 44 HB1 PHE 44 -11.309 26.364 9.589
326 HD1 PHE 44 HD2 PHE 44 -13.902 27.952 11.685
327 HD2 PHE 44 HD1 PHE 44 -12.043 24.254 10.540
328 HE1 PHE 44 HE2 PHE 44 -15.758 26.693 12.744
329 HE2 PHE 44 HE1 PHE 44 -13.896 22.994 11.600
330 HZ PHE 44 HZ PHE 44 -15.753 24.213 12.703
331 H TYR 45 HN TYR 45 -10.336 29.051 9.665
332 HA TYR 45 HA TYR 45 -8.011 28.369 8.368
333 HB2 TYR 45 HB2 TYR 45 -9.233 31.051 8.999
334 HB3 TYR 45 HB1 TYR 45 -7.722 30.941 8.095
335 HD1 TYR 45 HD2 TYR 45 -11.296 29.886 8.109
336 HD2 TYR 45 HD1 TYR 45 -7.690 30.276 5.809
337 HE1 TYR 45 HE2 TYR 45 -12.562 29.378 6.040
338 HE2 TYR 45 HE1 TYR 45 -8.957 29.768 3.739
339 HH TYR 45 HH TYR 45 -11.133 28.498 3.183
340 H GLY 46 HN GLY 46 -8.384 29.447 11.590
341 HA2 GLY 46 HA2 GLY 46 -5.820 30.578 12.046
342 HA3 GLY 46 HA1 GLY 46 -6.882 29.914 13.286
343 H VAL 47 HN VAL 47 -7.042 27.301 12.004
344 HA VAL 47 HA VAL 47 -4.303 26.268 12.097
345 HB VAL 47 HB VAL 47 -6.389 25.002 13.872
346 HG11 VAL 47 HG11 VAL 47 -3.387 24.995 14.197
347 HG12 VAL 47 HG12 VAL 47 -4.168 23.887 13.070
348 HG13 VAL 47 HG13 VAL 47 -4.566 23.822 14.787
349 HG21 VAL 47 HG21 VAL 47 -6.156 27.289 14.680
350 HG22 VAL 47 HG22 VAL 47 -4.399 27.183 14.572
351 HG23 VAL 47 HG23 VAL 47 -5.268 26.217 15.761
352 H TRP 48 HN TRP 48 -4.893 25.941 9.816
353 HA TRP 48 HA TRP 48 -6.948 23.972 9.223
354 HB2 TRP 48 HB2 TRP 48 -5.371 25.924 7.716
355 HB3 TRP 48 HB1 TRP 48 -5.370 24.361 6.906
356 HD1 TRP 48 HD1 TRP 48 -8.207 26.083 8.890
357 HE1 TRP 48 HE1 TRP 48 -10.282 26.225 7.369
358 HE3 TRP 48 HE3 TRP 48 -6.273 24.139 4.585
359 HZ2 TRP 48 HZ2 TRP 48 -11.024 25.593 4.679
360 HZ3 TRP 48 HZ3 TRP 48 -7.683 23.918 2.560
361 HH2 TRP 48 HH2 TRP 48 -10.055 24.643 2.601
362 HA PRO 49 HA PRO 49 -2.764 21.578 8.219
363 HB2 PRO 49 HB2 PRO 49 -1.138 22.629 10.495
364 HB3 PRO 49 HB1 PRO 49 -0.646 22.290 8.823
365 HG2 PRO 49 HG2 PRO 49 -0.949 24.790 9.688
366 HG3 PRO 49 HG1 PRO 49 -1.423 24.322 8.043
367 HD2 PRO 49 HD2 PRO 49 -3.165 24.782 10.448
368 HD3 PRO 49 HD1 PRO 49 -3.447 25.229 8.752
369 H LEU 50 HN LEU 50 -4.748 22.035 10.800
370 HA LEU 50 HA LEU 50 -3.743 20.137 12.680
371 HB2 LEU 50 HB2 LEU 50 -5.367 21.904 13.300
372 HB3 LEU 50 HB1 LEU 50 -6.582 21.119 12.298
373 HG LEU 50 HG LEU 50 -6.369 19.063 13.694
374 HD11 LEU 50 HD11 LEU 50 -4.257 19.007 14.655
375 HD12 LEU 50 HD12 LEU 50 -5.177 19.639 16.015
376 HD13 LEU 50 HD13 LEU 50 -4.243 20.736 14.998
377 HD21 LEU 50 HD21 LEU 50 -8.102 20.704 14.245
378 HD22 LEU 50 HD22 LEU 50 -6.952 21.625 15.213
379 HD23 LEU 50 HD23 LEU 50 -7.445 20.012 15.726
380 H LEU 51 HN LEU 51 -6.117 19.982 10.044
381 HA LEU 51 HA LEU 51 -6.610 17.157 10.503
382 HB2 LEU 51 HB2 LEU 51 -7.638 19.160 8.501
383 HB3 LEU 51 HB1 LEU 51 -7.995 17.441 8.352
384 HG LEU 51 HG LEU 51 -9.782 18.712 9.575
385 HD11 LEU 51 HD11 LEU 51 -10.223 16.949 11.002
386 HD12 LEU 51 HD12 LEU 51 -8.593 16.929 11.666
387 HD13 LEU 51 HD13 LEU 51 -8.912 16.207 10.091
388 HD21 LEU 51 HD21 LEU 51 -7.790 18.959 11.830
389 HD22 LEU 51 HD22 LEU 51 -9.355 19.750 11.669
390 HD23 LEU 51 HD23 LEU 51 -8.007 20.255 10.652
391 H LEU 52 HN LEU 52 -4.493 19.105 8.642
392 HA LEU 52 HA LEU 52 -4.009 17.299 6.497
393 HB2 LEU 52 HB2 LEU 52 -3.364 19.834 6.776
394 HB3 LEU 52 HB1 LEU 52 -1.903 19.191 7.520
395 HG LEU 52 HG LEU 52 -2.922 18.437 4.763
396 HD11 LEU 52 HD11 LEU 52 -0.971 19.728 3.956
397 HD12 LEU 52 HD12 LEU 52 -0.615 20.215 5.613
398 HD13 LEU 52 HD13 LEU 52 -2.105 20.755 4.834
399 HD21 LEU 52 HD21 LEU 52 -1.667 16.588 5.463
400 HD22 LEU 52 HD22 LEU 52 -0.582 17.565 6.453
401 HD23 LEU 52 HD23 LEU 52 -0.427 17.576 4.697
402 H LEU 53 HN LEU 53 -2.105 18.000 9.446
403 HA LEU 53 HA LEU 53 -0.341 15.783 9.014
404 HB2 LEU 53 HB2 LEU 53 0.885 16.635 10.784
405 HB3 LEU 53 HB1 LEU 53 -0.056 18.073 10.412
406 HG LEU 53 HG LEU 53 -0.933 16.038 12.493
407 HD11 LEU 53 HD11 LEU 53 -0.106 17.568 14.185
408 HD12 LEU 53 HD12 LEU 53 0.561 18.624 12.940
409 HD13 LEU 53 HD13 LEU 53 1.217 17.002 13.168
410 HD21 LEU 53 HD21 LEU 53 -2.472 17.881 11.277
411 HD22 LEU 53 HD22 LEU 53 -1.736 18.926 12.484
412 HD23 LEU 53 HD23 LEU 53 -2.654 17.509 12.989
413 H LEU 54 HN LEU 54 -3.216 16.332 10.972
414 HA LEU 54 HA LEU 54 -3.025 14.008 12.547
415 HB2 LEU 54 HB2 LEU 54 -4.510 15.852 13.154
416 HB3 LEU 54 HB1 LEU 54 -5.472 15.567 11.708
417 HG LEU 54 HG LEU 54 -6.122 13.351 12.524
418 HD11 LEU 54 HD11 LEU 54 -4.124 14.002 14.685
419 HD12 LEU 54 HD12 LEU 54 -4.305 12.515 13.753
420 HD13 LEU 54 HD13 LEU 54 -5.458 12.899 15.028
421 HD21 LEU 54 HD21 LEU 54 -6.439 15.483 14.661
422 HD22 LEU 54 HD22 LEU 54 -7.447 14.047 14.481
423 HD23 LEU 54 HD23 LEU 54 -7.468 15.297 13.239
424 H LEU 55 HN LEU 55 -4.723 14.631 9.480
425 HA LEU 55 HA LEU 55 -5.783 11.985 9.291
426 HB2 LEU 55 HB2 LEU 55 -6.801 13.962 8.180
427 HB3 LEU 55 HB1 LEU 55 -5.404 14.051 7.112
428 HG LEU 55 HG LEU 55 -6.653 11.349 7.229
429 HD11 LEU 55 HD11 LEU 55 -8.680 12.715 7.373
430 HD12 LEU 55 HD12 LEU 55 -8.554 11.969 5.780
431 HD13 LEU 55 HD13 LEU 55 -8.153 13.675 5.991
432 HD21 LEU 55 HD21 LEU 55 -6.346 11.506 4.783
433 HD22 LEU 55 HD22 LEU 55 -4.867 11.966 5.628
434 HD23 LEU 55 HD23 LEU 55 -5.913 13.208 4.944
435 H ALA 56 HN ALA 56 -2.887 13.605 8.150
436 HA ALA 56 HA ALA 56 -1.958 11.947 6.184
437 HB1 ALA 56 HB1 ALA 56 -0.686 13.886 6.835
438 HB2 ALA 56 HB2 ALA 56 0.345 12.471 7.045
439 HB3 ALA 56 HB3 ALA 56 -0.412 13.226 8.447
440 H LEU 57 HN LEU 57 -2.043 11.331 9.654
441 HA LEU 57 HA LEU 57 -1.689 8.507 9.171
442 HB2 LEU 57 HB2 LEU 57 0.185 8.632 11.107
443 HB3 LEU 57 HB1 LEU 57 0.602 8.707 9.397
444 HG LEU 57 HG LEU 57 0.582 11.168 9.488
445 HD11 LEU 57 HD11 LEU 57 0.507 12.133 11.914
446 HD12 LEU 57 HD12 LEU 57 -0.324 10.631 12.319
447 HD13 LEU 57 HD13 LEU 57 -1.013 11.730 11.130
448 HD21 LEU 57 HD21 LEU 57 2.222 9.973 11.743
449 HD22 LEU 57 HD22 LEU 57 2.572 11.461 10.866
450 HD23 LEU 57 HD23 LEU 57 2.665 9.910 10.036
451 HA PRO 58 HA PRO 58 -4.340 8.250 12.671
452 HB2 PRO 58 HB2 PRO 58 -3.599 5.823 13.764
453 HB3 PRO 58 HB1 PRO 58 -4.576 5.984 12.292
454 HG2 PRO 58 HG2 PRO 58 -1.648 5.462 12.571
455 HG3 PRO 58 HG1 PRO 58 -2.818 4.749 11.446
456 HD2 PRO 58 HD2 PRO 58 -1.108 6.727 10.690
457 HD3 PRO 58 HD1 PRO 58 -2.735 6.564 9.997
458 HA PRO 59 HA PRO 59 -2.592 9.790 16.446
459 HB2 PRO 59 HB2 PRO 59 -3.796 7.431 17.868
460 HB3 PRO 59 HB1 PRO 59 -3.920 9.160 18.251
461 HG2 PRO 59 HG2 PRO 59 -5.929 7.826 17.089
462 HG3 PRO 59 HG1 PRO 59 -5.582 9.522 16.707
463 HD2 PRO 59 HD2 PRO 59 -5.118 7.095 15.040
464 HD3 PRO 59 HD1 PRO 59 -5.370 8.784 14.550
465 H ARG 60 HN ARG 60 -2.172 6.389 15.675
466 HA ARG 60 HA ARG 60 -0.240 5.648 17.556
467 HB2 ARG 60 HB2 ARG 60 -0.517 4.775 14.667
468 HB3 ARG 60 HB1 ARG 60 0.447 3.949 15.892
469 HG2 ARG 60 HG2 ARG 60 -1.560 3.566 17.249
470 HG3 ARG 60 HG1 ARG 60 -2.540 4.435 16.067
471 HD2 ARG 60 HD2 ARG 60 -1.907 2.771 14.340
472 HD3 ARG 60 HD1 ARG 60 -0.977 1.890 15.548
473 HE ARG 60 HE ARG 60 -2.979 1.102 16.468
474 HH11 ARG 60 HH21 ARG 60 -3.514 3.592 14.126
475 HH12 ARG 60 HH22 ARG 60 -5.225 3.339 14.042
476 HH21 ARG 60 HH11 ARG 60 -5.224 0.763 16.365
477 HH22 ARG 60 HH12 ARG 60 -6.194 1.738 15.310
478 H ALA 61 HN ALA 61 0.536 6.318 14.154
479 HA ALA 61 HA ALA 61 3.257 6.948 14.745
480 HB1 ALA 61 HB1 ALA 61 2.893 6.094 12.583
481 HB2 ALA 61 HB2 ALA 61 3.186 7.809 12.308
482 HB3 ALA 61 HB3 ALA 61 1.540 7.181 12.287
483 H TYR 62 HN TYR 62 4.017 9.142 13.498
484 HA TYR 62 HA TYR 62 2.361 11.429 14.058
485 HB2 TYR 62 HB2 TYR 62 4.229 12.356 15.650
486 HB3 TYR 62 HB1 TYR 62 2.989 11.285 16.304
487 HD1 TYR 62 HD1 TYR 62 6.512 11.528 15.215
488 HD2 TYR 62 HD2 TYR 62 3.496 9.001 16.938
489 HE1 TYR 62 HE1 TYR 62 8.260 9.906 15.896
490 HE2 TYR 62 HE2 TYR 62 5.244 7.379 17.618
491 HH TYR 62 HH TYR 62 7.431 6.766 17.228
492 H ALA 63 HN ALA 63 2.877 12.988 12.657
493 HA ALA 63 HA ALA 63 3.944 13.975 10.858
494 HB1 ALA 63 HB1 ALA 63 6.224 13.750 12.836
495 HB2 ALA 63 HB2 ALA 63 5.061 15.071 12.732
496 HB3 ALA 63 HB3 ALA 63 6.211 14.803 11.421