Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
20469 | 2fry RC | 7036 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLY 1 1HT GLY 1 16.860 -8.221 3.311
2 2H GLY 1 2HT GLY 1 15.341 -7.484 3.398
3 3H GLY 1 3HT GLY 1 16.591 -6.741 2.536
4 1HA GLY 1 1HA GLY 1 16.594 -8.470 0.896
5 2HA GLY 1 2HA GLY 1 15.403 -9.365 1.825
6 H SER 2 H SER 2 13.253 -8.824 1.685
7 HA SER 2 HA SER 2 12.595 -6.861 -0.404
8 1HB SER 2 2HB SER 2 11.565 -9.513 0.266
9 2HB SER 2 1HB SER 2 10.276 -8.314 0.090
10 HG SER 2 HG SER 2 11.491 -9.561 -1.833
11 H HIS 3 H HIS 3 11.718 -4.999 0.217
12 HA HIS 3 HA HIS 3 10.754 -4.690 2.928
13 1HB HIS 3 2HB HIS 3 10.107 -2.326 1.832
14 2HB HIS 3 1HB HIS 3 11.721 -2.694 2.417
15 HD1 HIS 3 1HD HIS 3 9.750 -2.324 -0.761
16 HD2 HIS 3 2HD HIS 3 13.694 -2.780 0.464
17 HE1 HIS 3 1HE HIS 3 11.143 -1.900 -2.811
18 HE2 HIS 3 2HE HIS 3 13.523 -2.255 -2.064
19 H VAL 4 H VAL 4 8.715 -4.910 3.548
20 HA VAL 4 HA VAL 4 6.639 -4.845 1.458
21 HB VAL 4 HB VAL 4 5.977 -6.602 3.682
22 1HG1 VAL 4 1HG1 VAL 4 6.118 -6.926 0.687
23 2HG1 VAL 4 2HG1 VAL 4 4.687 -6.576 1.656
24 3HG1 VAL 4 3HG1 VAL 4 5.480 -8.147 1.786
25 1HG2 VAL 4 1HG2 VAL 4 8.274 -7.455 1.926
26 2HG2 VAL 4 2HG2 VAL 4 7.488 -8.406 3.186
27 3HG2 VAL 4 3HG2 VAL 4 8.427 -6.979 3.617
28 H VAL 5 H VAL 5 4.423 -4.602 2.379
29 HA VAL 5 HA VAL 5 4.441 -2.992 4.824
30 HB VAL 5 HB VAL 5 4.181 -1.162 3.601
31 1HG1 VAL 5 1HG1 VAL 5 4.282 -1.095 1.370
32 2HG1 VAL 5 2HG1 VAL 5 2.955 -2.230 1.157
33 3HG1 VAL 5 3HG1 VAL 5 4.571 -2.818 1.530
34 1HG2 VAL 5 1HG2 VAL 5 1.930 -0.581 2.868
35 2HG2 VAL 5 2HG2 VAL 5 1.928 -1.358 4.452
36 3HG2 VAL 5 3HG2 VAL 5 1.450 -2.271 3.019
37 H GLN 6 H GLN 6 2.435 -2.783 5.907
38 HA GLN 6 HA GLN 6 0.455 -4.864 5.252
39 1HB GLN 6 2HB GLN 6 2.304 -5.162 7.251
40 2HB GLN 6 1HB GLN 6 0.958 -4.432 8.122
41 1HG GLN 6 2HG GLN 6 -0.469 -6.209 7.673
42 2HG GLN 6 1HG GLN 6 0.524 -6.790 6.337
43 1HE2 GLN 6 1HE2 GLN 6 0.217 -8.841 7.516
44 2HE2 GLN 6 2HE2 GLN 6 1.336 -9.233 8.773
45 H THR 7 H THR 7 -1.712 -4.487 6.128
46 HA THR 7 HA THR 7 -2.082 -1.626 6.785
47 HB THR 7 HB THR 7 -4.546 -2.273 6.072
48 HG1 THR 7 1HG THR 7 -2.911 -4.062 4.599
49 1HG2 THR 7 1HG2 THR 7 -4.109 -1.472 3.840
50 2HG2 THR 7 2HG2 THR 7 -2.383 -1.756 4.053
51 3HG2 THR 7 3HG2 THR 7 -3.200 -0.533 5.020
52 H LEU 8 H LEU 8 -3.930 -1.080 8.101
53 HA LEU 8 HA LEU 8 -4.625 -3.125 10.082
54 1HB LEU 8 2HB LEU 8 -4.574 -0.865 11.587
55 2HB LEU 8 1HB LEU 8 -3.296 -2.058 11.533
56 HG LEU 8 HG LEU 8 -2.439 0.234 11.367
57 1HD1 LEU 8 1HD1 LEU 8 -1.508 -1.851 10.075
58 2HD1 LEU 8 2HD1 LEU 8 -0.817 -0.243 9.859
59 3HD1 LEU 8 3HD1 LEU 8 -1.945 -0.882 8.670
60 1HD2 LEU 8 1HD2 LEU 8 -4.608 0.854 9.962
61 2HD2 LEU 8 2HD2 LEU 8 -3.484 0.588 8.634
62 3HD2 LEU 8 3HD2 LEU 8 -3.112 1.782 9.871
63 H TYR 9 H TYR 9 -5.448 -0.116 8.462
64 HA TYR 9 HA TYR 9 -8.243 -0.482 9.311
65 1HB TYR 9 2HB TYR 9 -6.740 2.104 8.844
66 2HB TYR 9 1HB TYR 9 -8.476 2.004 9.111
67 HD1 TYR 9 1HD TYR 9 -6.007 3.301 10.721
68 HD2 TYR 9 2HD TYR 9 -8.530 -0.082 11.259
69 HE1 TYR 9 1HE TYR 9 -5.629 3.412 13.148
70 HE2 TYR 9 2HE TYR 9 -8.160 0.020 13.687
71 HH TYR 9 HH TYR 9 -7.311 2.367 15.323
72 HA PRO 10 HA PRO 10 -8.801 -0.802 4.862
73 1HB PRO 10 2HB PRO 10 -11.492 -1.117 4.887
74 2HB PRO 10 1HB PRO 10 -10.381 -2.425 5.309
75 1HG PRO 10 2HG PRO 10 -11.929 -0.600 7.107
76 2HG PRO 10 1HG PRO 10 -11.668 -2.348 7.243
77 1HD PRO 10 2HD PRO 10 -10.258 -0.533 8.687
78 2HD PRO 10 1HD PRO 10 -9.579 -2.091 8.175
79 H PHE 11 H PHE 11 -8.201 1.663 5.446
80 HA PHE 11 HA PHE 11 -10.444 3.449 5.078
81 1HB PHE 11 2HB PHE 11 -7.594 3.756 5.822
82 2HB PHE 11 1HB PHE 11 -8.371 5.116 5.019
83 HD1 PHE 11 1HD PHE 11 -10.770 5.707 6.003
84 HD2 PHE 11 2HD PHE 11 -7.667 3.701 8.115
85 HE1 PHE 11 1HE PHE 11 -11.774 6.408 8.136
86 HE2 PHE 11 2HE PHE 11 -8.667 4.397 10.252
87 HZ PHE 11 HZ PHE 11 -10.724 5.752 10.265
88 H SER 12 H SER 12 -10.558 5.021 3.455
89 HA SER 12 HA SER 12 -9.727 4.019 0.848
90 1HB SER 12 2HB SER 12 -11.796 5.900 1.881
91 2HB SER 12 1HB SER 12 -11.358 5.943 0.170
92 HG SER 12 HG SER 12 -13.140 4.512 0.706
93 H SER 13 H SER 13 -8.834 5.337 -0.765
94 HA SER 13 HA SER 13 -7.035 7.409 0.215
95 1HB SER 13 2HB SER 13 -7.205 5.700 -2.224
96 2HB SER 13 1HB SER 13 -6.416 7.270 -2.384
97 HG SER 13 HG SER 13 -5.675 5.047 -0.840
98 H VAL 14 H VAL 14 -6.754 9.361 -1.392
99 HA VAL 14 HA VAL 14 -9.405 10.212 -2.333
100 HB VAL 14 HB VAL 14 -8.935 12.500 -1.468
101 1HG1 VAL 14 1HG1 VAL 14 -8.894 10.719 0.902
102 2HG1 VAL 14 2HG1 VAL 14 -10.178 10.477 -0.281
103 3HG1 VAL 14 3HG1 VAL 14 -9.984 12.046 0.500
104 1HG2 VAL 14 1HG2 VAL 14 -7.275 12.436 0.536
105 2HG2 VAL 14 2HG2 VAL 14 -6.659 12.668 -1.100
106 3HG2 VAL 14 3HG2 VAL 14 -6.560 11.081 -0.337
107 H THR 15 H THR 15 -5.969 11.269 -2.365
108 HA THR 15 HA THR 15 -6.046 12.994 -4.462
109 HB THR 15 HB THR 15 -3.821 12.997 -4.329
110 HG1 THR 15 1HG THR 15 -2.869 11.493 -5.393
111 1HG2 THR 15 1HG2 THR 15 -4.076 10.822 -2.287
112 2HG2 THR 15 2HG2 THR 15 -4.366 12.532 -1.976
113 3HG2 THR 15 3HG2 THR 15 -2.760 11.981 -2.453
114 H GLU 16 H GLU 16 -5.390 12.816 -6.706
115 HA GLU 16 HA GLU 16 -6.930 10.871 -8.084
116 1HB GLU 16 2HB GLU 16 -5.693 13.344 -8.683
117 2HB GLU 16 1HB GLU 16 -5.073 12.172 -9.837
118 1HG GLU 16 2HG GLU 16 -7.814 11.689 -9.716
119 2HG GLU 16 1HG GLU 16 -7.651 13.444 -9.708
120 H GLU 17 H GLU 17 -3.528 11.127 -7.293
121 HA GLU 17 HA GLU 17 -2.817 8.934 -9.067
122 1HB GLU 17 2HB GLU 17 -0.998 10.105 -6.976
123 2HB GLU 17 1HB GLU 17 -0.571 9.314 -8.485
124 1HG GLU 17 2HG GLU 17 -0.157 11.463 -9.040
125 2HG GLU 17 1HG GLU 17 -1.845 11.352 -9.540
126 H GLU 18 H GLU 18 -4.710 8.538 -6.793
127 HA GLU 18 HA GLU 18 -3.171 6.594 -5.242
128 1HB GLU 18 2HB GLU 18 -5.830 7.832 -4.569
129 2HB GLU 18 1HB GLU 18 -4.911 6.719 -3.567
130 1HG GLU 18 2HG GLU 18 -3.201 8.872 -4.207
131 2HG GLU 18 1HG GLU 18 -4.748 9.559 -3.718
132 H LEU 19 H LEU 19 -4.906 4.925 -4.291
133 HA LEU 19 HA LEU 19 -6.560 3.903 -6.477
134 1HB LEU 19 2HB LEU 19 -4.077 2.781 -5.558
135 2HB LEU 19 1HB LEU 19 -5.389 1.665 -5.229
136 HG LEU 19 HG LEU 19 -6.053 1.991 -7.662
137 1HD1 LEU 19 1HD1 LEU 19 -4.785 3.099 -9.117
138 2HD1 LEU 19 2HD1 LEU 19 -3.282 2.631 -8.322
139 3HD1 LEU 19 3HD1 LEU 19 -4.241 3.961 -7.680
140 1HD2 LEU 19 1HD2 LEU 19 -4.987 0.067 -8.140
141 2HD2 LEU 19 2HD2 LEU 19 -4.557 0.138 -6.430
142 3HD2 LEU 19 3HD2 LEU 19 -3.418 0.702 -7.649
143 H ASN 20 H ASN 20 -8.441 2.956 -5.803
144 HA ASN 20 HA ASN 20 -8.804 2.792 -2.881
145 1HB ASN 20 2HB ASN 20 -11.319 2.991 -3.593
146 2HB ASN 20 1HB ASN 20 -10.311 4.430 -3.501
147 1HD2 ASN 20 1HD2 ASN 20 -11.168 1.890 -5.829
148 2HD2 ASN 20 2HD2 ASN 20 -11.339 2.951 -7.182
149 H PHE 21 H PHE 21 -8.421 0.738 -2.424
150 HA PHE 21 HA PHE 21 -10.200 -1.308 -3.564
151 1HB PHE 21 2HB PHE 21 -7.248 -1.672 -2.988
152 2HB PHE 21 1HB PHE 21 -8.357 -2.945 -3.483
153 HD1 PHE 21 1HD PHE 21 -5.785 -2.157 -4.870
154 HD2 PHE 21 2HD PHE 21 -9.820 -0.956 -5.475
155 HE1 PHE 21 1HE PHE 21 -5.288 -1.665 -7.222
156 HE2 PHE 21 2HE PHE 21 -9.326 -0.448 -7.827
157 HZ PHE 21 HZ PHE 21 -7.053 -0.805 -8.707
158 H GLU 22 H GLU 22 -10.415 -3.206 -1.984
159 HA GLU 22 HA GLU 22 -10.639 -2.092 0.667
160 1HB GLU 22 2HB GLU 22 -12.464 -3.417 0.350
161 2HB GLU 22 1HB GLU 22 -11.626 -4.489 -0.759
162 1HG GLU 22 2HG GLU 22 -12.342 -5.611 1.297
163 2HG GLU 22 1HG GLU 22 -10.596 -5.648 1.068
164 H LYS 23 H LYS 23 -8.647 -1.798 1.498
165 HA LYS 23 HA LYS 23 -6.601 -3.796 1.397
166 1HB LYS 23 2HB LYS 23 -6.767 -1.032 2.054
167 2HB LYS 23 1HB LYS 23 -6.023 -1.872 3.403
168 1HG LYS 23 2HG LYS 23 -5.122 -2.057 0.536
169 2HG LYS 23 1HG LYS 23 -4.386 -1.033 1.771
170 1HD LYS 23 2HD LYS 23 -4.233 -3.302 3.085
171 2HD LYS 23 1HD LYS 23 -4.323 -3.998 1.473
172 1HE LYS 23 2HE LYS 23 -2.346 -2.937 0.786
173 2HE LYS 23 1HE LYS 23 -2.369 -1.824 2.150
174 1HZ LYS 23 1HZ LYS 23 -2.252 -4.639 2.841
175 2HZ LYS 23 2HZ LYS 23 -1.413 -3.328 3.500
176 3HZ LYS 23 3HZ LYS 23 -0.880 -4.033 2.062
177 H GLY 24 H GLY 24 -5.850 -5.108 3.039
178 1HA GLY 24 2HA GLY 24 -6.996 -5.013 5.674
179 2HA GLY 24 1HA GLY 24 -7.611 -6.352 4.716
180 H GLU 25 H GLU 25 -5.257 -6.926 3.286
181 HA GLU 25 HA GLU 25 -3.749 -8.257 5.373
182 1HB GLU 25 2HB GLU 25 -4.780 -9.200 3.061
183 2HB GLU 25 1HB GLU 25 -3.146 -8.810 2.536
184 1HG GLU 25 2HG GLU 25 -2.470 -10.075 4.711
185 2HG GLU 25 1HG GLU 25 -4.077 -10.786 4.541
186 H THR 26 H THR 26 -1.482 -8.618 3.416
187 HA THR 26 HA THR 26 -0.213 -6.033 3.955
188 HB THR 26 HB THR 26 1.642 -7.090 4.607
189 HG1 THR 26 1HG THR 26 2.471 -7.805 2.766
190 1HG2 THR 26 1HG2 THR 26 -0.326 -8.525 5.558
191 2HG2 THR 26 2HG2 THR 26 1.350 -9.034 5.762
192 3HG2 THR 26 3HG2 THR 26 0.353 -9.764 4.502
193 H MET 27 H MET 27 1.039 -5.025 2.482
194 HA MET 27 HA MET 27 1.101 -6.038 -0.265
195 1HB MET 27 2HB MET 27 0.132 -3.329 0.647
196 2HB MET 27 1HB MET 27 0.734 -3.598 -0.982
197 1HG MET 27 2HG MET 27 -1.603 -5.001 0.292
198 2HG MET 27 1HG MET 27 -1.687 -3.714 -0.910
199 1HE MET 27 1HE MET 27 -1.233 -7.971 -0.962
200 2HE MET 27 2HE MET 27 -2.707 -7.467 -1.790
201 3HE MET 27 3HE MET 27 -2.333 -6.831 -0.187
202 H GLU 28 H GLU 28 2.773 -4.775 -1.554
203 HA GLU 28 HA GLU 28 5.008 -4.069 0.233
204 1HB GLU 28 2HB GLU 28 5.536 -4.841 -2.574
205 2HB GLU 28 1HB GLU 28 6.488 -5.132 -1.136
206 1HG GLU 28 2HG GLU 28 4.534 -6.751 -0.522
207 2HG GLU 28 1HG GLU 28 4.216 -6.696 -2.255
208 H VAL 29 H VAL 29 5.674 -2.064 0.185
209 HA VAL 29 HA VAL 29 4.770 -0.301 -1.941
210 HB VAL 29 HB VAL 29 5.773 0.089 0.837
211 1HG1 VAL 29 1HG1 VAL 29 5.813 2.565 0.389
212 2HG1 VAL 29 2HG1 VAL 29 5.893 2.166 -1.328
213 3HG1 VAL 29 3HG1 VAL 29 7.181 1.647 -0.239
214 1HG2 VAL 29 1HG2 VAL 29 3.589 1.653 -0.406
215 2HG2 VAL 29 2HG2 VAL 29 3.724 0.981 1.220
216 3HG2 VAL 29 3HG2 VAL 29 3.323 -0.070 -0.138
217 H ILE 30 H ILE 30 5.997 0.411 -3.494
218 HA ILE 30 HA ILE 30 8.813 -0.327 -3.586
219 HB ILE 30 HB ILE 30 8.521 0.809 -5.952
220 1HG1 ILE 30 2HG1 ILE 30 6.066 1.393 -5.073
221 2HG1 ILE 30 1HG1 ILE 30 6.397 1.083 -6.763
222 1HG2 ILE 30 1HG2 ILE 30 7.907 -1.360 -6.874
223 2HG2 ILE 30 2HG2 ILE 30 7.363 -1.890 -5.283
224 3HG2 ILE 30 3HG2 ILE 30 9.067 -1.530 -5.557
225 1HD1 ILE 30 1HD1 ILE 30 4.405 -0.072 -6.106
226 2HD1 ILE 30 2HD1 ILE 30 5.257 -0.861 -4.780
227 3HD1 ILE 30 3HD1 ILE 30 5.672 -1.247 -6.449
228 H GLU 31 H GLU 31 6.778 2.552 -3.673
229 HA GLU 31 HA GLU 31 9.081 4.306 -3.883
230 1HB GLU 31 2HB GLU 31 7.023 4.848 -5.102
231 2HB GLU 31 1HB GLU 31 6.138 4.928 -3.586
232 1HG GLU 31 2HG GLU 31 7.615 6.796 -2.889
233 2HG GLU 31 1HG GLU 31 8.346 6.755 -4.492
234 H LYS 32 H LYS 32 10.203 4.909 -2.161
235 HA LYS 32 HA LYS 32 8.929 4.795 0.476
236 1HB LYS 32 2HB LYS 32 11.685 4.431 -0.519
237 2HB LYS 32 1HB LYS 32 11.545 5.288 1.009
238 1HG LYS 32 2HG LYS 32 11.869 2.879 1.312
239 2HG LYS 32 1HG LYS 32 10.336 3.439 1.983
240 1HD LYS 32 2HD LYS 32 10.028 1.343 0.788
241 2HD LYS 32 1HD LYS 32 9.179 2.652 -0.036
242 1HE LYS 32 2HE LYS 32 10.490 1.046 -1.500
243 2HE LYS 32 1HE LYS 32 10.792 2.766 -1.743
244 1HZ LYS 32 1HZ LYS 32 12.815 2.615 -0.536
245 2HZ LYS 32 2HZ LYS 32 12.821 1.351 -1.660
246 3HZ LYS 32 3HZ LYS 32 12.486 1.032 -0.033
247 HA PRO 33 HA PRO 33 8.993 9.194 0.797
248 1HB PRO 33 2HB PRO 33 9.120 9.181 3.656
249 2HB PRO 33 1HB PRO 33 7.689 9.312 2.633
250 1HG PRO 33 2HG PRO 33 8.269 7.158 4.265
251 2HG PRO 33 1HG PRO 33 7.177 7.107 2.870
252 1HD PRO 33 2HD PRO 33 10.031 6.232 3.080
253 2HD PRO 33 1HD PRO 33 8.678 5.482 2.204
254 H GLU 34 H GLU 34 11.738 7.535 1.313
255 HA GLU 34 HA GLU 34 13.198 9.635 2.694
256 1HB GLU 34 2HB GLU 34 15.172 7.979 1.979
257 2HB GLU 34 1HB GLU 34 14.180 7.717 3.403
258 1HG GLU 34 2HG GLU 34 14.491 5.668 2.144
259 2HG GLU 34 1HG GLU 34 12.797 6.147 2.176
260 H ASN 35 H ASN 35 12.717 8.435 -0.536
261 HA ASN 35 HA ASN 35 14.495 10.561 -1.539
262 1HB ASN 35 2HB ASN 35 13.880 7.938 -2.917
263 2HB ASN 35 1HB ASN 35 14.995 9.183 -3.475
264 1HD2 ASN 35 1HD2 ASN 35 15.729 6.530 -3.111
265 2HD2 ASN 35 2HD2 ASN 35 16.867 6.441 -1.815
266 H ASP 36 H ASP 36 11.495 8.789 -1.944
267 HA ASP 36 HA ASP 36 10.601 10.645 -4.018
268 1HB ASP 36 2HB ASP 36 9.821 7.921 -3.146
269 2HB ASP 36 1HB ASP 36 8.517 8.955 -3.722
270 HA PRO 37 HA PRO 37 7.862 13.228 -1.757
271 1HB PRO 37 2HB PRO 37 5.348 12.199 -2.617
272 2HB PRO 37 1HB PRO 37 6.204 13.612 -3.235
273 1HG PRO 37 2HG PRO 37 6.091 10.854 -4.306
274 2HG PRO 37 1HG PRO 37 6.341 12.385 -5.160
275 1HD PRO 37 2HD PRO 37 8.347 10.647 -4.769
276 2HD PRO 37 1HD PRO 37 8.617 12.402 -4.722
277 H GLU 38 H GLU 38 5.854 13.161 -0.283
278 HA GLU 38 HA GLU 38 6.350 11.264 1.760
279 1HB GLU 38 2HB GLU 38 4.975 13.714 1.503
280 2HB GLU 38 1HB GLU 38 3.805 12.547 2.104
281 1HG GLU 38 2HG GLU 38 4.626 13.130 4.102
282 2HG GLU 38 1HG GLU 38 5.904 11.986 3.695
283 H TRP 39 H TRP 39 4.662 10.838 -1.077
284 HA TRP 39 HA TRP 39 2.771 8.948 0.143
285 1HB TRP 39 2HB TRP 39 2.556 9.414 -2.755
286 2HB TRP 39 1HB TRP 39 1.300 9.394 -1.524
287 HD1 TRP 39 HD TRP 39 1.301 11.787 0.058
288 HE1 TRP 39 1HE TRP 39 1.506 14.202 -0.811
289 HE3 TRP 39 3HE TRP 39 3.418 10.834 -4.497
290 HZ2 TRP 39 2HZ TRP 39 2.440 15.527 -3.123
291 HZ3 TRP 39 3HZ TRP 39 3.936 12.730 -5.978
292 HH2 TRP 39 HH TRP 39 3.456 15.028 -5.303
293 H TRP 40 H TRP 40 2.678 6.802 -0.532
294 HA TRP 40 HA TRP 40 4.893 5.919 -2.251
295 1HB TRP 40 2HB TRP 40 5.092 3.884 -0.874
296 2HB TRP 40 1HB TRP 40 5.475 5.341 0.024
297 HD1 TRP 40 HD TRP 40 1.802 4.457 -0.402
298 HE1 TRP 40 1HE TRP 40 0.845 3.687 1.861
299 HE3 TRP 40 3HE TRP 40 6.146 4.199 2.249
300 HZ2 TRP 40 2HZ TRP 40 1.829 3.049 4.425
301 HZ3 TRP 40 3HZ TRP 40 6.058 3.507 4.604
302 HH2 TRP 40 HH TRP 40 3.934 2.949 5.671
303 H LYS 41 H LYS 41 4.469 3.586 -3.071
304 HA LYS 41 HA LYS 41 1.647 3.068 -3.496
305 1HB LYS 41 2HB LYS 41 2.027 2.835 -5.961
306 2HB LYS 41 1HB LYS 41 2.011 4.473 -5.338
307 1HG LYS 41 2HG LYS 41 3.814 4.580 -6.696
308 2HG LYS 41 1HG LYS 41 4.611 4.080 -5.213
309 1HD LYS 41 2HD LYS 41 5.494 2.637 -6.786
310 2HD LYS 41 1HD LYS 41 4.180 1.707 -6.079
311 1HE LYS 41 2HE LYS 41 4.618 2.297 -8.792
312 2HE LYS 41 1HE LYS 41 3.270 1.421 -8.071
313 1HZ LYS 41 1HZ LYS 41 3.423 4.347 -8.580
314 2HZ LYS 41 2HZ LYS 41 2.156 3.590 -7.756
315 3HZ LYS 41 3HZ LYS 41 2.439 3.228 -9.381
316 H CYS 42 H CYS 42 1.102 0.985 -3.776
317 HA CYS 42 HA CYS 42 3.252 -0.953 -4.210
318 1HB CYS 42 2HB CYS 42 2.118 -2.448 -2.500
319 2HB CYS 42 1HB CYS 42 2.986 -1.067 -1.839
320 HG CYS 42 HG CYS 42 0.899 -0.276 -0.834
321 H LYS 43 H LYS 43 2.462 -3.042 -4.970
322 HA LYS 43 HA LYS 43 0.128 -2.702 -6.671
323 1HB LYS 43 2HB LYS 43 0.925 -4.876 -7.676
324 2HB LYS 43 1HB LYS 43 2.026 -3.513 -7.829
325 1HG LYS 43 2HG LYS 43 3.451 -4.355 -6.136
326 2HG LYS 43 1HG LYS 43 2.267 -5.570 -5.651
327 1HD LYS 43 2HD LYS 43 2.628 -6.859 -7.569
328 2HD LYS 43 1HD LYS 43 3.401 -5.524 -8.428
329 1HE LYS 43 2HE LYS 43 4.727 -6.336 -5.935
330 2HE LYS 43 1HE LYS 43 4.732 -7.554 -7.210
331 1HZ LYS 43 1HZ LYS 43 6.651 -5.919 -7.157
332 2HZ LYS 43 2HZ LYS 43 5.558 -4.759 -7.723
333 3HZ LYS 43 3HZ LYS 43 5.881 -6.138 -8.648
334 H ASN 44 H ASN 44 -1.703 -3.753 -6.538
335 HA ASN 44 HA ASN 44 -2.115 -5.629 -4.316
336 1HB ASN 44 2HB ASN 44 -3.453 -3.302 -4.795
337 2HB ASN 44 1HB ASN 44 -4.462 -4.445 -5.659
338 1HD2 ASN 44 1HD2 ASN 44 -5.660 -5.919 -4.538
339 2HD2 ASN 44 2HD2 ASN 44 -5.821 -5.899 -2.817
340 H ALA 45 H ALA 45 -4.070 -7.114 -4.854
341 HA ALA 45 HA ALA 45 -3.312 -8.594 -7.187
342 1HB ALA 45 1HB ALA 45 -5.407 -8.952 -5.071
343 2HB ALA 45 2HB ALA 45 -3.997 -9.954 -5.414
344 3HB ALA 45 3HB ALA 45 -5.382 -9.976 -6.507
345 H ARG 46 H ARG 46 -4.816 -5.829 -6.939
346 HA ARG 46 HA ARG 46 -7.139 -6.170 -8.589
347 1HB ARG 46 2HB ARG 46 -5.909 -4.174 -6.901
348 2HB ARG 46 1HB ARG 46 -6.372 -3.468 -8.435
349 1HG ARG 46 2HG ARG 46 -8.096 -3.126 -6.906
350 2HG ARG 46 1HG ARG 46 -8.674 -4.325 -8.059
351 1HD ARG 46 2HD ARG 46 -7.895 -4.634 -5.177
352 2HD ARG 46 1HD ARG 46 -9.392 -5.098 -5.976
353 HE ARG 46 HE ARG 46 -6.929 -6.622 -5.890
354 1HH1 ARG 46 1HH1 ARG 46 -10.057 -6.203 -7.387
355 2HH1 ARG 46 2HH1 ARG 46 -10.159 -7.846 -7.922
356 1HH2 ARG 46 1HH2 ARG 46 -7.074 -8.792 -6.590
357 2HH2 ARG 46 2HH2 ARG 46 -8.469 -9.311 -7.474
358 H GLY 47 H GLY 47 -3.808 -5.939 -9.165
359 1HA GLY 47 2HA GLY 47 -2.729 -5.918 -11.231
360 2HA GLY 47 1HA GLY 47 -4.248 -5.470 -11.993
361 H GLN 48 H GLN 48 -4.325 -3.301 -9.736
362 HA GLN 48 HA GLN 48 -2.597 -1.369 -11.121
363 1HB GLN 48 2HB GLN 48 -4.916 -0.830 -11.567
364 2HB GLN 48 1HB GLN 48 -5.321 -0.960 -9.869
365 1HG GLN 48 2HG GLN 48 -5.039 1.229 -9.741
366 2HG GLN 48 1HG GLN 48 -3.314 0.958 -9.972
367 1HE2 GLN 48 1HE2 GLN 48 -6.308 1.859 -11.496
368 2HE2 GLN 48 2HE2 GLN 48 -5.611 2.523 -12.931
369 H VAL 49 H VAL 49 -1.327 -0.060 -9.905
370 HA VAL 49 HA VAL 49 -1.604 -0.298 -6.984
371 HB VAL 49 HB VAL 49 0.447 -1.246 -7.069
372 1HG1 VAL 49 1HG1 VAL 49 2.134 -0.678 -8.888
373 2HG1 VAL 49 2HG1 VAL 49 0.767 0.072 -9.713
374 3HG1 VAL 49 3HG1 VAL 49 0.725 -1.646 -9.317
375 1HG2 VAL 49 1HG2 VAL 49 2.203 0.306 -6.646
376 2HG2 VAL 49 2HG2 VAL 49 0.709 1.012 -6.029
377 3HG2 VAL 49 3HG2 VAL 49 1.378 1.568 -7.562
378 H GLY 50 H GLY 50 -1.987 1.543 -6.000
379 1HA GLY 50 2HA GLY 50 -1.385 4.030 -7.466
380 2HA GLY 50 1HA GLY 50 -2.788 3.830 -6.436
381 H LEU 51 H LEU 51 -2.036 5.717 -5.357
382 HA LEU 51 HA LEU 51 0.319 5.323 -3.683
383 1HB LEU 51 2HB LEU 51 -1.132 7.654 -4.705
384 2HB LEU 51 1HB LEU 51 -0.662 7.797 -3.024
385 HG LEU 51 HG LEU 51 1.622 7.731 -3.518
386 1HD1 LEU 51 1HD1 LEU 51 0.828 6.025 -5.681
387 2HD1 LEU 51 2HD1 LEU 51 2.424 6.262 -4.969
388 3HD1 LEU 51 3HD1 LEU 51 1.882 7.303 -6.282
389 1HD2 LEU 51 1HD2 LEU 51 1.095 9.847 -4.158
390 2HD2 LEU 51 2HD2 LEU 51 0.007 9.309 -5.438
391 3HD2 LEU 51 3HD2 LEU 51 1.753 9.239 -5.677
392 H VAL 52 H VAL 52 -0.045 4.261 -1.869
393 HA VAL 52 HA VAL 52 -2.652 4.428 -0.588
394 HB VAL 52 HB VAL 52 -1.965 2.197 -0.669
395 1HG1 VAL 52 1HG1 VAL 52 0.629 3.237 -0.720
396 2HG1 VAL 52 2HG1 VAL 52 0.140 1.565 -0.911
397 3HG1 VAL 52 3HG1 VAL 52 0.565 2.179 0.683
398 1HG2 VAL 52 1HG2 VAL 52 -2.380 3.347 1.774
399 2HG2 VAL 52 2HG2 VAL 52 -0.859 2.494 2.030
400 3HG2 VAL 52 3HG2 VAL 52 -2.281 1.612 1.476
401 HA PRO 53 HA PRO 53 -1.201 7.386 2.407
402 1HB PRO 53 2HB PRO 53 -3.312 7.347 4.037
403 2HB PRO 53 1HB PRO 53 -3.468 7.976 2.386
404 1HG PRO 53 2HG PRO 53 -4.029 5.190 3.377
405 2HG PRO 53 1HG PRO 53 -5.144 6.284 2.515
406 1HD PRO 53 2HD PRO 53 -3.794 4.423 1.190
407 2HD PRO 53 1HD PRO 53 -3.966 6.054 0.504
408 H LYS 54 H LYS 54 0.490 6.553 3.534
409 HA LYS 54 HA LYS 54 0.692 4.225 4.973
410 1HB LYS 54 2HB LYS 54 2.527 5.304 6.157
411 2HB LYS 54 1HB LYS 54 2.556 5.681 4.433
412 1HG LYS 54 2HG LYS 54 2.559 7.816 4.930
413 2HG LYS 54 1HG LYS 54 0.949 7.636 5.635
414 1HD LYS 54 2HD LYS 54 1.868 7.197 7.794
415 2HD LYS 54 1HD LYS 54 3.509 7.111 7.147
416 1HE LYS 54 2HE LYS 54 2.873 9.569 6.327
417 2HE LYS 54 1HE LYS 54 1.811 9.470 7.731
418 1HZ LYS 54 1HZ LYS 54 4.700 9.644 7.606
419 2HZ LYS 54 2HZ LYS 54 4.100 8.554 8.751
420 3HZ LYS 54 3HZ LYS 54 3.633 10.178 8.805
421 H ASN 55 H ASN 55 -0.955 7.115 5.812
422 HA ASN 55 HA ASN 55 -0.973 6.838 8.631
423 1HB ASN 55 2HB ASN 55 -1.552 8.902 7.196
424 2HB ASN 55 1HB ASN 55 -3.149 8.174 7.052
425 1HD2 ASN 55 1HD2 ASN 55 -4.300 9.612 8.218
426 2HD2 ASN 55 2HD2 ASN 55 -4.061 9.911 9.903
427 H TYR 56 H TYR 56 -2.441 5.060 6.214
428 HA TYR 56 HA TYR 56 -4.506 4.072 8.059
429 1HB TYR 56 2HB TYR 56 -4.463 4.203 5.040
430 2HB TYR 56 1HB TYR 56 -5.665 3.305 5.956
431 HD1 TYR 56 1HD TYR 56 -5.838 5.398 8.229
432 HD2 TYR 56 2HD TYR 56 -6.040 5.702 3.996
433 HE1 TYR 56 1HE TYR 56 -7.216 7.411 8.455
434 HE2 TYR 56 2HE TYR 56 -7.415 7.724 4.206
435 HH TYR 56 HH TYR 56 -7.688 9.582 6.118
436 H VAL 57 H VAL 57 -1.539 3.356 7.338
437 HA VAL 57 HA VAL 57 -2.005 0.490 7.490
438 HB VAL 57 HB VAL 57 -1.075 -0.160 5.529
439 1HG1 VAL 57 1HG1 VAL 57 -1.667 2.687 4.736
440 2HG1 VAL 57 2HG1 VAL 57 -2.876 1.415 4.905
441 3HG1 VAL 57 3HG1 VAL 57 -1.620 1.280 3.675
442 1HG2 VAL 57 1HG2 VAL 57 1.148 0.469 5.790
443 2HG2 VAL 57 2HG2 VAL 57 0.756 2.188 5.852
444 3HG2 VAL 57 3HG2 VAL 57 0.666 1.319 4.321
445 H VAL 58 H VAL 58 0.209 -0.666 7.508
446 HA VAL 58 HA VAL 58 2.260 0.849 8.939
447 HB VAL 58 HB VAL 58 0.890 -0.200 10.701
448 1HG1 VAL 58 1HG1 VAL 58 0.330 -2.174 9.050
449 2HG1 VAL 58 2HG1 VAL 58 0.340 -2.421 10.796
450 3HG1 VAL 58 3HG1 VAL 58 1.726 -2.919 9.827
451 1HG2 VAL 58 1HG2 VAL 58 2.687 -0.744 11.953
452 2HG2 VAL 58 2HG2 VAL 58 3.575 -0.173 10.541
453 3HG2 VAL 58 3HG2 VAL 58 3.298 -1.899 10.769
454 H VAL 59 H VAL 59 4.130 0.482 7.918
455 HA VAL 59 HA VAL 59 4.379 -1.443 5.883
456 HB VAL 59 HB VAL 59 6.659 -0.020 7.252
457 1HG1 VAL 59 1HG1 VAL 59 6.451 -0.814 4.365
458 2HG1 VAL 59 2HG1 VAL 59 7.066 -1.929 5.588
459 3HG1 VAL 59 3HG1 VAL 59 7.891 -0.399 5.297
460 1HG2 VAL 59 1HG2 VAL 59 6.192 1.485 5.102
461 2HG2 VAL 59 2HG2 VAL 59 5.429 1.801 6.660
462 3HG2 VAL 59 3HG2 VAL 59 4.546 0.931 5.407
463 H LEU 60 H LEU 60 5.543 -3.336 5.740
464 HA LEU 60 HA LEU 60 6.579 -4.506 8.196
465 1HB LEU 60 2HB LEU 60 4.634 -5.621 8.385
466 2HB LEU 60 1HB LEU 60 4.189 -5.315 6.722
467 HG LEU 60 HG LEU 60 6.305 -7.267 6.812
468 1HD1 LEU 60 1HD1 LEU 60 4.421 -8.937 7.826
469 2HD1 LEU 60 2HD1 LEU 60 4.223 -7.518 8.854
470 3HD1 LEU 60 3HD1 LEU 60 5.796 -8.305 8.730
471 1HD2 LEU 60 1HD2 LEU 60 4.524 -6.753 5.044
472 2HD2 LEU 60 2HD2 LEU 60 3.445 -7.728 6.042
473 3HD2 LEU 60 3HD2 LEU 60 4.904 -8.446 5.361
474 H SER 61 H SER 61 8.664 -4.600 7.573
475 HA SER 61 HA SER 61 9.278 -6.035 5.081
476 1HB SER 61 2HB SER 61 11.357 -4.794 4.949
477 2HB SER 61 1HB SER 61 10.022 -3.653 5.117
478 HG SER 61 HG SER 61 11.937 -3.320 6.501
Start of MODEL 2
1 1H GLY 1 1HT GLY 1 15.007 -11.071 -1.083
2 2H GLY 1 2HT GLY 1 14.233 -11.958 0.132
3 3H GLY 1 3HT GLY 1 15.906 -11.721 0.194
4 1HA GLY 1 1HA GLY 1 14.325 -10.282 1.657
5 2HA GLY 1 2HA GLY 1 15.754 -9.581 0.914
6 H SER 2 H SER 2 12.866 -8.679 1.647
7 HA SER 2 HA SER 2 12.657 -6.787 -0.488
8 1HB SER 2 2HB SER 2 11.248 -9.215 -0.828
9 2HB SER 2 1HB SER 2 10.041 -7.998 -0.396
10 HG SER 2 HG SER 2 10.871 -6.705 -2.100
11 H HIS 3 H HIS 3 11.604 -4.977 0.154
12 HA HIS 3 HA HIS 3 10.730 -4.869 2.911
13 1HB HIS 3 2HB HIS 3 10.101 -2.404 1.762
14 2HB HIS 3 1HB HIS 3 11.539 -2.785 2.696
15 HD1 HIS 3 1HD HIS 3 13.705 -2.444 1.528
16 HD2 HIS 3 2HD HIS 3 10.535 -2.795 -1.136
17 HE1 HIS 3 1HE HIS 3 14.682 -1.988 -0.743
18 HE2 HIS 3 2HE HIS 3 12.759 -2.268 -2.346
19 H VAL 4 H VAL 4 8.704 -5.223 3.541
20 HA VAL 4 HA VAL 4 6.578 -4.875 1.527
21 HB VAL 4 HB VAL 4 5.873 -6.754 3.628
22 1HG1 VAL 4 1HG1 VAL 4 4.691 -6.381 1.468
23 2HG1 VAL 4 2HG1 VAL 4 5.109 -8.069 1.762
24 3HG1 VAL 4 3HG1 VAL 4 6.068 -7.107 0.638
25 1HG2 VAL 4 1HG2 VAL 4 8.156 -7.401 3.688
26 2HG2 VAL 4 2HG2 VAL 4 8.283 -7.350 1.929
27 3HG2 VAL 4 3HG2 VAL 4 7.310 -8.599 2.706
28 H VAL 5 H VAL 5 4.379 -4.665 2.558
29 HA VAL 5 HA VAL 5 4.526 -3.191 5.078
30 HB VAL 5 HB VAL 5 4.324 -1.297 3.944
31 1HG1 VAL 5 1HG1 VAL 5 2.892 -2.021 1.533
32 2HG1 VAL 5 2HG1 VAL 5 4.394 -2.911 1.756
33 3HG1 VAL 5 3HG1 VAL 5 4.409 -1.157 1.748
34 1HG2 VAL 5 1HG2 VAL 5 2.089 -0.534 3.454
35 2HG2 VAL 5 2HG2 VAL 5 2.097 -1.495 4.932
36 3HG2 VAL 5 3HG2 VAL 5 1.507 -2.198 3.426
37 H GLN 6 H GLN 6 2.515 -2.942 6.188
38 HA GLN 6 HA GLN 6 0.677 -5.172 5.608
39 1HB GLN 6 2HB GLN 6 2.260 -4.906 7.803
40 2HB GLN 6 1HB GLN 6 0.780 -4.131 8.364
41 1HG GLN 6 2HG GLN 6 -0.410 -6.060 8.357
42 2HG GLN 6 1HG GLN 6 0.500 -6.749 7.015
43 1HE2 GLN 6 1HE2 GLN 6 1.474 -5.479 10.180
44 2HE2 GLN 6 2HE2 GLN 6 2.288 -6.913 10.697
45 H THR 7 H THR 7 -1.523 -4.842 5.672
46 HA THR 7 HA THR 7 -2.384 -2.062 5.561
47 HB THR 7 HB THR 7 -4.332 -2.845 4.548
48 HG1 THR 7 1HG THR 7 -5.295 -4.257 5.772
49 1HG2 THR 7 1HG2 THR 7 -3.268 -5.294 3.593
50 2HG2 THR 7 2HG2 THR 7 -1.966 -4.110 3.681
51 3HG2 THR 7 3HG2 THR 7 -3.422 -3.752 2.757
52 H LEU 8 H LEU 8 -3.594 -1.016 6.987
53 HA LEU 8 HA LEU 8 -4.341 -2.441 9.455
54 1HB LEU 8 2HB LEU 8 -3.683 0.481 9.092
55 2HB LEU 8 1HB LEU 8 -4.100 -0.286 10.605
56 HG LEU 8 HG LEU 8 -1.561 0.234 9.744
57 1HD1 LEU 8 1HD1 LEU 8 -0.857 -1.377 11.513
58 2HD1 LEU 8 2HD1 LEU 8 -2.555 -1.826 11.674
59 3HD1 LEU 8 3HD1 LEU 8 -2.044 -0.169 12.004
60 1HD2 LEU 8 1HD2 LEU 8 -2.068 -2.682 9.202
61 2HD2 LEU 8 2HD2 LEU 8 -0.490 -1.921 9.318
62 3HD2 LEU 8 3HD2 LEU 8 -1.582 -1.464 8.022
63 H TYR 9 H TYR 9 -5.283 -0.036 7.069
64 HA TYR 9 HA TYR 9 -8.085 -0.374 7.882
65 1HB TYR 9 2HB TYR 9 -6.526 2.142 7.653
66 2HB TYR 9 1HB TYR 9 -8.166 2.169 7.013
67 HD1 TYR 9 1HD TYR 9 -6.679 3.475 9.567
68 HD2 TYR 9 2HD TYR 9 -9.521 0.365 8.967
69 HE1 TYR 9 1HE TYR 9 -7.547 3.836 11.839
70 HE2 TYR 9 2HE TYR 9 -10.396 0.718 11.237
71 HH TYR 9 HH TYR 9 -8.782 2.675 13.545
72 HA PRO 10 HA PRO 10 -9.361 -1.101 3.744
73 1HB PRO 10 2HB PRO 10 -10.945 1.206 3.283
74 2HB PRO 10 1HB PRO 10 -11.496 -0.382 3.816
75 1HG PRO 10 2HG PRO 10 -10.933 2.058 5.407
76 2HG PRO 10 1HG PRO 10 -12.097 0.756 5.711
77 1HD PRO 10 2HD PRO 10 -9.838 0.978 7.136
78 2HD PRO 10 1HD PRO 10 -10.497 -0.612 6.690
79 H PHE 11 H PHE 11 -9.514 -0.043 1.520
80 HA PHE 11 HA PHE 11 -7.078 1.511 1.114
81 1HB PHE 11 2HB PHE 11 -7.372 0.915 -1.263
82 2HB PHE 11 1HB PHE 11 -7.375 -0.507 -0.227
83 HD1 PHE 11 1HD PHE 11 -9.447 -1.744 0.182
84 HD2 PHE 11 2HD PHE 11 -9.327 1.582 -2.470
85 HE1 PHE 11 1HE PHE 11 -11.612 -2.427 -0.767
86 HE2 PHE 11 2HE PHE 11 -11.492 0.906 -3.422
87 HZ PHE 11 HZ PHE 11 -12.638 -1.100 -2.569
88 H SER 12 H SER 12 -7.051 3.599 0.557
89 HA SER 12 HA SER 12 -9.517 4.799 -0.505
90 1HB SER 12 2HB SER 12 -9.167 5.321 1.942
91 2HB SER 12 1HB SER 12 -7.699 6.179 1.478
92 HG SER 12 HG SER 12 -10.301 6.956 1.286
93 H SER 13 H SER 13 -9.140 5.603 -2.463
94 HA SER 13 HA SER 13 -6.512 6.831 -2.992
95 1HB SER 13 2HB SER 13 -8.020 4.802 -4.543
96 2HB SER 13 1HB SER 13 -7.265 6.094 -5.477
97 HG SER 13 HG SER 13 -5.907 4.516 -3.550
98 H VAL 14 H VAL 14 -6.591 8.899 -3.620
99 HA VAL 14 HA VAL 14 -9.067 9.904 -4.842
100 HB VAL 14 HB VAL 14 -8.798 12.016 -3.558
101 1HG1 VAL 14 1HG1 VAL 14 -10.234 9.955 -2.899
102 2HG1 VAL 14 2HG1 VAL 14 -10.010 11.263 -1.737
103 3HG1 VAL 14 3HG1 VAL 14 -9.064 9.781 -1.590
104 1HG2 VAL 14 1HG2 VAL 14 -6.616 10.432 -2.246
105 2HG2 VAL 14 2HG2 VAL 14 -7.439 11.739 -1.395
106 3HG2 VAL 14 3HG2 VAL 14 -6.562 12.075 -2.888
107 H THR 15 H THR 15 -5.643 10.646 -4.175
108 HA THR 15 HA THR 15 -5.324 12.733 -5.981
109 HB THR 15 HB THR 15 -3.069 10.818 -5.715
110 HG1 THR 15 1HG THR 15 -2.770 11.480 -3.537
111 1HG2 THR 15 1HG2 THR 15 -3.458 13.746 -5.724
112 2HG2 THR 15 2HG2 THR 15 -2.209 12.759 -6.485
113 3HG2 THR 15 3HG2 THR 15 -2.130 13.105 -4.757
114 H GLU 16 H GLU 16 -3.816 12.540 -7.970
115 HA GLU 16 HA GLU 16 -5.214 11.007 -9.916
116 1HB GLU 16 2HB GLU 16 -4.473 12.820 -11.018
117 2HB GLU 16 1HB GLU 16 -3.172 13.096 -9.872
118 1HG GLU 16 2HG GLU 16 -2.271 12.743 -12.073
119 2HG GLU 16 1HG GLU 16 -1.820 11.402 -11.023
120 H GLU 17 H GLU 17 -2.161 10.603 -8.219
121 HA GLU 17 HA GLU 17 -1.482 8.290 -9.864
122 1HB GLU 17 2HB GLU 17 0.114 9.195 -7.491
123 2HB GLU 17 1HB GLU 17 0.660 8.350 -8.928
124 1HG GLU 17 2HG GLU 17 -0.450 11.076 -9.266
125 2HG GLU 17 1HG GLU 17 1.142 10.914 -8.531
126 H GLU 18 H GLU 18 -3.824 8.140 -8.167
127 HA GLU 18 HA GLU 18 -2.959 5.983 -6.359
128 1HB GLU 18 2HB GLU 18 -5.512 7.487 -5.923
129 2HB GLU 18 1HB GLU 18 -4.552 6.574 -4.768
130 1HG GLU 18 2HG GLU 18 -2.871 8.614 -5.608
131 2HG GLU 18 1HG GLU 18 -4.452 9.368 -5.455
132 H LEU 19 H LEU 19 -4.773 4.360 -5.951
133 HA LEU 19 HA LEU 19 -6.788 4.172 -7.997
134 1HB LEU 19 2HB LEU 19 -6.101 2.296 -9.141
135 2HB LEU 19 1HB LEU 19 -4.618 3.200 -8.961
136 HG LEU 19 HG LEU 19 -3.858 1.112 -8.502
137 1HD1 LEU 19 1HD1 LEU 19 -4.751 1.260 -5.724
138 2HD1 LEU 19 2HD1 LEU 19 -3.922 2.686 -6.346
139 3HD1 LEU 19 3HD1 LEU 19 -3.138 1.112 -6.410
140 1HD2 LEU 19 1HD2 LEU 19 -5.080 -0.723 -7.949
141 2HD2 LEU 19 2HD2 LEU 19 -6.377 0.291 -8.575
142 3HD2 LEU 19 3HD2 LEU 19 -6.120 0.159 -6.835
143 H ASN 20 H ASN 20 -8.428 2.667 -7.543
144 HA ASN 20 HA ASN 20 -8.473 1.907 -4.716
145 1HB ASN 20 2HB ASN 20 -10.977 1.615 -5.196
146 2HB ASN 20 1HB ASN 20 -10.336 3.255 -5.202
147 1HD2 ASN 20 1HD2 ASN 20 -12.053 3.959 -6.486
148 2HD2 ASN 20 2HD2 ASN 20 -12.136 3.599 -8.173
149 H PHE 21 H PHE 21 -7.902 -0.078 -4.289
150 HA PHE 21 HA PHE 21 -8.993 -2.253 -5.935
151 1HB PHE 21 2HB PHE 21 -6.773 -3.478 -5.435
152 2HB PHE 21 1HB PHE 21 -6.803 -2.283 -6.722
153 HD1 PHE 21 1HD PHE 21 -6.745 -1.252 -3.194
154 HD2 PHE 21 2HD PHE 21 -4.427 -2.006 -6.676
155 HE1 PHE 21 1HE PHE 21 -4.837 -0.103 -2.162
156 HE2 PHE 21 2HE PHE 21 -2.511 -0.853 -5.652
157 HZ PHE 21 HZ PHE 21 -2.715 0.099 -3.391
158 H GLU 22 H GLU 22 -8.944 -4.388 -4.795
159 HA GLU 22 HA GLU 22 -10.020 -4.087 -2.182
160 1HB GLU 22 2HB GLU 22 -10.994 -5.925 -3.083
161 2HB GLU 22 1HB GLU 22 -9.621 -6.267 -4.122
162 1HG GLU 22 2HG GLU 22 -10.060 -8.062 -2.524
163 2HG GLU 22 1HG GLU 22 -8.467 -7.343 -2.308
164 H LYS 23 H LYS 23 -8.610 -3.322 -0.705
165 HA LYS 23 HA LYS 23 -5.885 -4.131 -0.560
166 1HB LYS 23 2HB LYS 23 -7.581 -2.167 0.664
167 2HB LYS 23 1HB LYS 23 -6.665 -3.000 1.905
168 1HG LYS 23 2HG LYS 23 -5.571 -1.531 -0.481
169 2HG LYS 23 1HG LYS 23 -5.453 -1.058 1.214
170 1HD LYS 23 2HD LYS 23 -3.601 -2.261 1.467
171 2HD LYS 23 1HD LYS 23 -4.409 -3.714 0.876
172 1HE LYS 23 2HE LYS 23 -3.208 -1.572 -0.877
173 2HE LYS 23 1HE LYS 23 -2.409 -3.082 -0.446
174 1HZ LYS 23 1HZ LYS 23 -3.473 -3.208 -2.617
175 2HZ LYS 23 2HZ LYS 23 -4.975 -2.862 -1.922
176 3HZ LYS 23 3HZ LYS 23 -4.176 -4.300 -1.532
177 H GLY 24 H GLY 24 -4.999 -5.789 0.473
178 1HA GLY 24 2HA GLY 24 -6.729 -7.569 1.999
179 2HA GLY 24 1HA GLY 24 -5.087 -7.911 1.466
180 H GLU 25 H GLU 25 -4.317 -8.566 3.440
181 HA GLU 25 HA GLU 25 -4.469 -6.751 5.694
182 1HB GLU 25 2HB GLU 25 -4.628 -9.497 5.531
183 2HB GLU 25 1HB GLU 25 -2.980 -9.232 6.087
184 1HG GLU 25 2HG GLU 25 -3.653 -8.268 8.056
185 2HG GLU 25 1HG GLU 25 -5.220 -7.793 7.405
186 H THR 26 H THR 26 -2.410 -7.708 3.211
187 HA THR 26 HA THR 26 -0.235 -6.114 4.330
188 HB THR 26 HB THR 26 0.980 -8.275 2.964
189 HG1 THR 26 1HG THR 26 0.024 -10.003 3.670
190 1HG2 THR 26 1HG2 THR 26 1.013 -8.312 5.905
191 2HG2 THR 26 2HG2 THR 26 1.581 -6.832 5.134
192 3HG2 THR 26 3HG2 THR 26 2.342 -8.375 4.747
193 H MET 27 H MET 27 1.026 -5.067 2.864
194 HA MET 27 HA MET 27 0.577 -5.512 0.010
195 1HB MET 27 2HB MET 27 0.832 -2.725 0.273
196 2HB MET 27 1HB MET 27 -0.584 -3.619 -0.250
197 1HG MET 27 2HG MET 27 -1.598 -3.486 1.812
198 2HG MET 27 1HG MET 27 -0.074 -3.229 2.662
199 1HE MET 27 1HE MET 27 -1.472 -0.963 4.036
200 2HE MET 27 2HE MET 27 -2.718 -1.847 3.158
201 3HE MET 27 3HE MET 27 -2.603 -0.095 3.000
202 H GLU 28 H GLU 28 2.276 -4.342 -1.301
203 HA GLU 28 HA GLU 28 4.780 -4.129 0.261
204 1HB GLU 28 2HB GLU 28 5.894 -4.905 -1.898
205 2HB GLU 28 1HB GLU 28 4.980 -6.109 -1.007
206 1HG GLU 28 2HG GLU 28 3.401 -4.702 -3.008
207 2HG GLU 28 1HG GLU 28 4.762 -5.601 -3.678
208 H VAL 29 H VAL 29 5.386 -2.103 0.317
209 HA VAL 29 HA VAL 29 4.642 -0.268 -1.802
210 HB VAL 29 HB VAL 29 5.697 0.065 0.982
211 1HG1 VAL 29 1HG1 VAL 29 5.565 2.566 0.507
212 2HG1 VAL 29 2HG1 VAL 29 5.688 2.125 -1.197
213 3HG1 VAL 29 3HG1 VAL 29 6.987 1.704 -0.081
214 1HG2 VAL 29 1HG2 VAL 29 3.256 -0.246 0.422
215 2HG2 VAL 29 2HG2 VAL 29 3.327 1.338 -0.349
216 3HG2 VAL 29 3HG2 VAL 29 3.659 1.182 1.377
217 H ILE 30 H ILE 30 5.983 0.719 -3.150
218 HA ILE 30 HA ILE 30 8.732 -0.270 -3.305
219 HB ILE 30 HB ILE 30 8.525 1.151 -5.557
220 1HG1 ILE 30 2HG1 ILE 30 6.066 1.663 -4.683
221 2HG1 ILE 30 1HG1 ILE 30 6.404 1.460 -6.389
222 1HG2 ILE 30 1HG2 ILE 30 9.100 -1.180 -5.471
223 2HG2 ILE 30 2HG2 ILE 30 7.850 -0.934 -6.691
224 3HG2 ILE 30 3HG2 ILE 30 7.427 -1.618 -5.121
225 1HD1 ILE 30 1HD1 ILE 30 4.407 0.268 -5.790
226 2HD1 ILE 30 2HD1 ILE 30 5.275 -0.619 -4.539
227 3HD1 ILE 30 3HD1 ILE 30 5.668 -0.877 -6.239
228 H GLU 31 H GLU 31 6.906 2.749 -3.158
229 HA GLU 31 HA GLU 31 9.353 4.318 -3.126
230 1HB GLU 31 2HB GLU 31 7.472 5.173 -4.409
231 2HB GLU 31 1HB GLU 31 6.449 5.139 -2.982
232 1HG GLU 31 2HG GLU 31 7.508 6.960 -2.018
233 2HG GLU 31 1HG GLU 31 8.954 6.765 -3.005
234 H LYS 32 H LYS 32 10.429 4.331 -1.263
235 HA LYS 32 HA LYS 32 9.096 4.070 1.270
236 1HB LYS 32 2HB LYS 32 11.995 4.763 0.867
237 2HB LYS 32 1HB LYS 32 11.251 3.914 2.210
238 1HG LYS 32 2HG LYS 32 11.594 2.861 -0.586
239 2HG LYS 32 1HG LYS 32 12.523 2.384 0.836
240 1HD LYS 32 2HD LYS 32 10.850 1.094 1.663
241 2HD LYS 32 1HD LYS 32 9.583 2.156 1.048
242 1HE LYS 32 2HE LYS 32 9.904 -0.219 0.025
243 2HE LYS 32 1HE LYS 32 9.556 1.154 -1.022
244 1HZ LYS 32 1HZ LYS 32 12.325 0.268 -0.467
245 2HZ LYS 32 2HZ LYS 32 11.775 1.265 -1.717
246 3HZ LYS 32 3HZ LYS 32 11.411 -0.385 -1.732
247 HA PRO 33 HA PRO 33 8.807 8.457 1.916
248 1HB PRO 33 2HB PRO 33 7.812 8.447 4.396
249 2HB PRO 33 1HB PRO 33 6.871 7.849 3.025
250 1HG PRO 33 2HG PRO 33 8.325 6.326 5.135
251 2HG PRO 33 1HG PRO 33 6.786 5.956 4.340
252 1HD PRO 33 2HD PRO 33 9.268 4.846 3.695
253 2HD PRO 33 1HD PRO 33 7.818 4.809 2.674
254 H GLU 34 H GLU 34 11.292 6.706 2.955
255 HA GLU 34 HA GLU 34 12.253 7.943 5.264
256 1HB GLU 34 2HB GLU 34 14.559 7.296 4.260
257 2HB GLU 34 1HB GLU 34 13.425 6.026 4.696
258 1HG GLU 34 2HG GLU 34 14.575 5.674 2.530
259 2HG GLU 34 1HG GLU 34 12.818 5.682 2.418
260 H ASN 35 H ASN 35 12.005 9.131 2.052
261 HA ASN 35 HA ASN 35 13.696 11.439 2.757
262 1HB ASN 35 2HB ASN 35 14.405 10.019 0.769
263 2HB ASN 35 1HB ASN 35 12.951 10.589 -0.043
264 1HD2 ASN 35 1HD2 ASN 35 15.473 12.083 1.962
265 2HD2 ASN 35 2HD2 ASN 35 15.825 13.367 0.861
266 H ASP 36 H ASP 36 10.705 10.408 1.183
267 HA ASP 36 HA ASP 36 9.624 13.111 1.640
268 1HB ASP 36 2HB ASP 36 8.771 11.279 -0.603
269 2HB ASP 36 1HB ASP 36 8.353 12.975 -0.380
270 HA PRO 37 HA PRO 37 6.857 10.371 3.980
271 1HB PRO 37 2HB PRO 37 6.268 12.085 5.944
272 2HB PRO 37 1HB PRO 37 7.839 11.275 5.875
273 1HG PRO 37 2HG PRO 37 7.109 14.064 5.086
274 2HG PRO 37 1HG PRO 37 8.551 13.482 5.934
275 1HD PRO 37 2HD PRO 37 8.432 14.054 3.229
276 2HD PRO 37 1HD PRO 37 9.628 12.983 3.985
277 H GLU 38 H GLU 38 5.719 11.120 1.728
278 HA GLU 38 HA GLU 38 3.351 12.681 2.500
279 1HB GLU 38 2HB GLU 38 3.082 12.973 -0.041
280 2HB GLU 38 1HB GLU 38 4.318 13.908 0.782
281 1HG GLU 38 2HG GLU 38 5.671 11.641 0.025
282 2HG GLU 38 1HG GLU 38 4.571 11.923 -1.320
283 H TRP 39 H TRP 39 3.958 10.395 -0.178
284 HA TRP 39 HA TRP 39 2.034 8.531 0.932
285 1HB TRP 39 2HB TRP 39 1.526 9.582 -1.844
286 2HB TRP 39 1HB TRP 39 0.457 8.626 -0.824
287 HD1 TRP 39 HD TRP 39 -0.700 9.965 1.281
288 HE1 TRP 39 1HE TRP 39 -1.370 12.443 1.487
289 HE3 TRP 39 3HE TRP 39 2.125 11.889 -2.518
290 HZ2 TRP 39 2HZ TRP 39 -0.777 14.889 0.208
291 HZ3 TRP 39 3HZ TRP 39 2.018 14.308 -2.962
292 HH2 TRP 39 HH TRP 39 0.595 15.775 -1.626
293 H TRP 40 H TRP 40 2.190 6.454 0.070
294 HA TRP 40 HA TRP 40 4.325 6.088 -1.920
295 1HB TRP 40 2HB TRP 40 4.889 3.948 -0.835
296 2HB TRP 40 1HB TRP 40 5.135 5.322 0.231
297 HD1 TRP 40 HD TRP 40 1.877 3.302 -0.373
298 HE1 TRP 40 1HE TRP 40 1.057 2.424 1.902
299 HE3 TRP 40 3HE TRP 40 5.699 4.987 2.556
300 HZ2 TRP 40 2HZ TRP 40 1.939 2.440 4.582
301 HZ3 TRP 40 3HZ TRP 40 5.641 4.510 4.969
302 HH2 TRP 40 HH TRP 40 3.793 3.263 5.960
303 H LYS 41 H LYS 41 4.145 3.872 -3.008
304 HA LYS 41 HA LYS 41 1.355 3.161 -3.456
305 1HB LYS 41 2HB LYS 41 1.902 2.963 -5.922
306 2HB LYS 41 1HB LYS 41 1.709 4.584 -5.270
307 1HG LYS 41 2HG LYS 41 3.569 4.784 -6.581
308 2HG LYS 41 1HG LYS 41 4.275 4.516 -4.997
309 1HD LYS 41 2HD LYS 41 5.501 3.052 -6.247
310 2HD LYS 41 1HD LYS 41 4.170 2.016 -5.762
311 1HE LYS 41 2HE LYS 41 5.035 2.709 -8.384
312 2HE LYS 41 1HE LYS 41 3.788 1.564 -7.892
313 1HZ LYS 41 1HZ LYS 41 2.753 3.126 -9.292
314 2HZ LYS 41 2HZ LYS 41 3.473 4.446 -8.519
315 3HZ LYS 41 3HZ LYS 41 2.272 3.557 -7.729
316 H CYS 42 H CYS 42 0.886 1.074 -3.832
317 HA CYS 42 HA CYS 42 3.122 -0.801 -4.084
318 1HB CYS 42 2HB CYS 42 1.515 -2.310 -2.581
319 2HB CYS 42 1HB CYS 42 2.707 -1.241 -1.855
320 HG CYS 42 HG CYS 42 0.481 -0.835 -0.629
321 H LYS 43 H LYS 43 2.469 -2.902 -4.979
322 HA LYS 43 HA LYS 43 0.332 -2.562 -6.932
323 1HB LYS 43 2HB LYS 43 1.280 -4.483 -8.061
324 2HB LYS 43 1HB LYS 43 2.553 -3.331 -7.680
325 1HG LYS 43 2HG LYS 43 3.478 -4.689 -6.054
326 2HG LYS 43 1HG LYS 43 1.985 -5.602 -5.824
327 1HD LYS 43 2HD LYS 43 3.749 -5.705 -8.272
328 2HD LYS 43 1HD LYS 43 3.699 -6.919 -6.992
329 1HE LYS 43 2HE LYS 43 2.120 -7.943 -8.188
330 2HE LYS 43 1HE LYS 43 1.047 -6.621 -7.733
331 1HZ LYS 43 1HZ LYS 43 1.004 -6.870 -10.092
332 2HZ LYS 43 2HZ LYS 43 2.692 -6.810 -10.197
333 3HZ LYS 43 3HZ LYS 43 1.824 -5.432 -9.741
334 H ASN 44 H ASN 44 -1.411 -3.862 -7.185
335 HA ASN 44 HA ASN 44 -1.948 -5.744 -4.979
336 1HB ASN 44 2HB ASN 44 -3.253 -3.485 -5.112
337 2HB ASN 44 1HB ASN 44 -4.131 -4.273 -6.418
338 1HD2 ASN 44 1HD2 ASN 44 -2.875 -5.452 -3.316
339 2HD2 ASN 44 2HD2 ASN 44 -4.390 -6.043 -2.736
340 H ALA 45 H ALA 45 -3.882 -7.200 -5.623
341 HA ALA 45 HA ALA 45 -2.996 -8.771 -7.762
342 1HB ALA 45 1HB ALA 45 -4.224 -9.618 -5.783
343 2HB ALA 45 2HB ALA 45 -4.891 -10.180 -7.315
344 3HB ALA 45 3HB ALA 45 -5.693 -8.884 -6.426
345 H ARG 46 H ARG 46 -4.801 -5.933 -7.811
346 HA ARG 46 HA ARG 46 -6.368 -6.572 -10.158
347 1HB ARG 46 2HB ARG 46 -5.856 -3.793 -9.136
348 2HB ARG 46 1HB ARG 46 -7.263 -4.397 -9.990
349 1HG ARG 46 2HG ARG 46 -6.505 -5.112 -7.166
350 2HG ARG 46 1HG ARG 46 -7.704 -3.908 -7.630
351 1HD ARG 46 2HD ARG 46 -8.983 -5.801 -7.180
352 2HD ARG 46 1HD ARG 46 -8.830 -5.804 -8.935
353 HE ARG 46 HE ARG 46 -6.848 -7.372 -7.531
354 1HH1 ARG 46 1HH1 ARG 46 -9.986 -7.359 -9.064
355 2HH1 ARG 46 2HH1 ARG 46 -9.982 -9.064 -9.366
356 1HH2 ARG 46 1HH2 ARG 46 -6.847 -9.617 -7.930
357 2HH2 ARG 46 2HH2 ARG 46 -8.203 -10.344 -8.723
358 H GLY 47 H GLY 47 -3.165 -6.014 -9.629
359 1HA GLY 47 2HA GLY 47 -1.434 -5.649 -11.102
360 2HA GLY 47 1HA GLY 47 -2.621 -5.507 -12.390
361 H GLN 48 H GLN 48 -3.474 -3.458 -9.903
362 HA GLN 48 HA GLN 48 -2.098 -1.200 -11.177
363 1HB GLN 48 2HB GLN 48 -4.245 -0.001 -10.104
364 2HB GLN 48 1HB GLN 48 -4.186 -0.617 -11.743
365 1HG GLN 48 2HG GLN 48 -5.157 -2.765 -10.840
366 2HG GLN 48 1HG GLN 48 -5.455 -1.882 -9.345
367 1HE2 GLN 48 1HE2 GLN 48 -6.104 0.608 -10.516
368 2HE2 GLN 48 2HE2 GLN 48 -7.636 0.443 -11.296
369 H VAL 49 H VAL 49 -0.645 -0.325 -9.948
370 HA VAL 49 HA VAL 49 -1.062 -0.356 -7.041
371 HB VAL 49 HB VAL 49 1.049 -1.208 -7.194
372 1HG1 VAL 49 1HG1 VAL 49 1.478 0.401 -9.666
373 2HG1 VAL 49 2HG1 VAL 49 1.196 -1.337 -9.547
374 3HG1 VAL 49 3HG1 VAL 49 2.689 -0.640 -8.917
375 1HG2 VAL 49 1HG2 VAL 49 1.850 1.658 -7.521
376 2HG2 VAL 49 2HG2 VAL 49 2.661 0.397 -6.596
377 3HG2 VAL 49 3HG2 VAL 49 1.114 1.039 -6.045
378 H GLY 50 H GLY 50 -1.355 1.486 -5.983
379 1HA GLY 50 2HA GLY 50 -0.766 4.002 -7.360
380 2HA GLY 50 1HA GLY 50 -2.399 3.715 -6.782
381 H LEU 51 H LEU 51 -1.533 5.828 -5.770
382 HA LEU 51 HA LEU 51 0.162 5.555 -3.511
383 1HB LEU 51 2HB LEU 51 -1.447 7.692 -4.755
384 2HB LEU 51 1HB LEU 51 -1.072 7.884 -3.055
385 HG LEU 51 HG LEU 51 1.167 8.184 -3.437
386 1HD1 LEU 51 1HD1 LEU 51 1.979 6.314 -4.454
387 2HD1 LEU 51 2HD1 LEU 51 2.136 7.474 -5.773
388 3HD1 LEU 51 3HD1 LEU 51 0.774 6.356 -5.740
389 1HD2 LEU 51 1HD2 LEU 51 0.571 10.096 -4.454
390 2HD2 LEU 51 2HD2 LEU 51 -0.479 9.274 -5.609
391 3HD2 LEU 51 3HD2 LEU 51 1.264 9.307 -5.871
392 H VAL 52 H VAL 52 -0.379 4.481 -1.788
393 HA VAL 52 HA VAL 52 -3.170 4.401 -0.897
394 HB VAL 52 HB VAL 52 -2.304 2.210 -1.109
395 1HG1 VAL 52 1HG1 VAL 52 -0.157 1.561 0.080
396 2HG1 VAL 52 2HG1 VAL 52 0.138 3.291 0.241
397 3HG1 VAL 52 3HG1 VAL 52 0.003 2.568 -1.361
398 1HG2 VAL 52 1HG2 VAL 52 -2.430 3.168 1.722
399 2HG2 VAL 52 2HG2 VAL 52 -1.876 1.527 1.403
400 3HG2 VAL 52 3HG2 VAL 52 -3.471 2.036 0.859
401 HA PRO 53 HA PRO 53 -2.511 7.106 2.569
402 1HB PRO 53 2HB PRO 53 -4.110 5.879 4.393
403 2HB PRO 53 1HB PRO 53 -4.763 6.811 3.037
404 1HG PRO 53 2HG PRO 53 -4.222 3.847 3.177
405 2HG PRO 53 1HG PRO 53 -5.763 4.660 2.776
406 1HD PRO 53 2HD PRO 53 -4.252 3.839 0.811
407 2HD PRO 53 1HD PRO 53 -4.861 5.509 0.741
408 H LYS 54 H LYS 54 -0.266 6.440 2.841
409 HA LYS 54 HA LYS 54 0.644 4.184 4.116
410 1HB LYS 54 2HB LYS 54 2.608 5.587 4.765
411 2HB LYS 54 1HB LYS 54 2.173 5.614 3.058
412 1HG LYS 54 2HG LYS 54 2.155 7.803 3.181
413 2HG LYS 54 1HG LYS 54 0.717 7.686 4.191
414 1HD LYS 54 2HD LYS 54 2.026 7.712 6.187
415 2HD LYS 54 1HD LYS 54 3.530 7.572 5.272
416 1HE LYS 54 2HE LYS 54 3.510 9.823 5.721
417 2HE LYS 54 1HE LYS 54 2.696 9.793 4.157
418 1HZ LYS 54 1HZ LYS 54 1.739 10.851 6.523
419 2HZ LYS 54 2HZ LYS 54 0.821 9.457 6.254
420 3HZ LYS 54 3HZ LYS 54 0.890 10.663 5.071
421 H ASN 55 H ASN 55 -0.898 6.961 5.483
422 HA ASN 55 HA ASN 55 -0.091 6.386 8.196
423 1HB ASN 55 2HB ASN 55 -0.866 8.671 6.987
424 2HB ASN 55 1HB ASN 55 -2.398 8.168 7.692
425 1HD2 ASN 55 1HD2 ASN 55 -2.268 10.047 9.012
426 2HD2 ASN 55 2HD2 ASN 55 -1.280 10.054 10.429
427 H TYR 56 H TYR 56 -2.154 4.895 6.157
428 HA TYR 56 HA TYR 56 -4.105 4.235 8.264
429 1HB TYR 56 2HB TYR 56 -4.269 4.120 5.250
430 2HB TYR 56 1HB TYR 56 -5.428 3.295 6.285
431 HD1 TYR 56 1HD TYR 56 -3.878 6.687 6.589
432 HD2 TYR 56 2HD TYR 56 -7.429 4.408 6.054
433 HE1 TYR 56 1HE TYR 56 -5.215 8.744 6.758
434 HE2 TYR 56 2HE TYR 56 -8.778 6.459 6.218
435 HH TYR 56 HH TYR 56 -7.984 9.227 5.710
436 H VAL 57 H VAL 57 -1.287 3.223 7.421
437 HA VAL 57 HA VAL 57 -1.894 0.407 7.846
438 HB VAL 57 HB VAL 57 -1.182 -0.413 5.907
439 1HG1 VAL 57 1HG1 VAL 57 -1.760 2.446 5.154
440 2HG1 VAL 57 2HG1 VAL 57 -2.822 1.044 5.024
441 3HG1 VAL 57 3HG1 VAL 57 -1.433 1.204 3.948
442 1HG2 VAL 57 1HG2 VAL 57 1.104 -0.017 6.009
443 2HG2 VAL 57 2HG2 VAL 57 0.900 1.735 5.982
444 3HG2 VAL 57 3HG2 VAL 57 0.640 0.795 4.513
445 H VAL 58 H VAL 58 0.350 -0.817 7.893
446 HA VAL 58 HA VAL 58 2.396 0.877 9.135
447 HB VAL 58 HB VAL 58 1.083 -0.297 10.926
448 1HG1 VAL 58 1HG1 VAL 58 0.686 -2.482 10.915
449 2HG1 VAL 58 2HG1 VAL 58 2.380 -2.860 10.601
450 3HG1 VAL 58 3HG1 VAL 58 1.293 -2.502 9.261
451 1HG2 VAL 58 1HG2 VAL 58 3.042 -1.019 12.178
452 2HG2 VAL 58 2HG2 VAL 58 3.379 0.460 11.278
453 3HG2 VAL 58 3HG2 VAL 58 3.982 -1.088 10.686
454 H VAL 59 H VAL 59 4.264 0.634 8.108
455 HA VAL 59 HA VAL 59 4.575 -1.225 6.030
456 HB VAL 59 HB VAL 59 6.792 0.327 7.351
457 1HG1 VAL 59 1HG1 VAL 59 7.489 0.121 4.773
458 2HG1 VAL 59 2HG1 VAL 59 6.555 -1.365 4.928
459 3HG1 VAL 59 3HG1 VAL 59 7.941 -1.084 5.981
460 1HG2 VAL 59 1HG2 VAL 59 4.585 1.445 6.269
461 2HG2 VAL 59 2HG2 VAL 59 5.591 1.272 4.830
462 3HG2 VAL 59 3HG2 VAL 59 6.185 2.186 6.218
463 H LEU 60 H LEU 60 5.878 -2.934 5.736
464 HA LEU 60 HA LEU 60 6.633 -4.422 8.113
465 1HB LEU 60 2HB LEU 60 5.225 -5.098 5.717
466 2HB LEU 60 1HB LEU 60 6.700 -6.039 5.783
467 HG LEU 60 HG LEU 60 6.063 -7.120 7.773
468 1HD1 LEU 60 1HD1 LEU 60 5.295 -5.565 9.267
469 2HD1 LEU 60 2HD1 LEU 60 3.781 -6.355 8.827
470 3HD1 LEU 60 3HD1 LEU 60 4.215 -4.811 8.095
471 1HD2 LEU 60 1HD2 LEU 60 4.837 -7.847 5.753
472 2HD2 LEU 60 2HD2 LEU 60 3.517 -6.765 6.197
473 3HD2 LEU 60 3HD2 LEU 60 3.935 -8.123 7.242
474 H SER 61 H SER 61 8.526 -5.802 7.795
475 HA SER 61 HA SER 61 10.757 -6.101 7.457
476 1HB SER 61 2HB SER 61 10.016 -6.404 5.100
477 2HB SER 61 1HB SER 61 10.255 -4.678 4.832
478 HG SER 61 HG SER 61 12.249 -6.546 5.607
Start of MODEL 3
1 1H GLY 1 1HT GLY 1 15.189 -8.182 3.091
2 2H GLY 1 2HT GLY 1 14.732 -6.562 2.931
3 3H GLY 1 3HT GLY 1 16.357 -6.961 3.178
4 1HA GLY 1 1HA GLY 1 16.570 -6.796 0.978
5 2HA GLY 1 2HA GLY 1 15.810 -8.380 0.968
6 H SER 2 H SER 2 13.224 -7.903 1.501
7 HA SER 2 HA SER 2 12.404 -6.245 -0.783
8 1HB SER 2 2HB SER 2 11.538 -8.837 0.249
9 2HB SER 2 1HB SER 2 10.183 -7.737 -0.027
10 HG SER 2 HG SER 2 10.751 -8.973 -1.892
11 H HIS 3 H HIS 3 11.364 -4.401 -0.410
12 HA HIS 3 HA HIS 3 10.561 -3.730 2.286
13 1HB HIS 3 2HB HIS 3 9.630 -1.661 0.721
14 2HB HIS 3 1HB HIS 3 11.197 -1.720 1.513
15 HD1 HIS 3 1HD HIS 3 9.668 -2.672 -1.837
16 HD2 HIS 3 2HD HIS 3 13.283 -1.442 -0.199
17 HE1 HIS 3 1HE HIS 3 11.214 -2.345 -3.793
18 HE2 HIS 3 2HE HIS 3 13.420 -1.687 -2.770
19 H VAL 4 H VAL 4 8.649 -4.187 3.091
20 HA VAL 4 HA VAL 4 6.361 -4.360 1.246
21 HB VAL 4 HB VAL 4 6.038 -6.068 3.562
22 1HG1 VAL 4 1HG1 VAL 4 5.952 -6.471 0.583
23 2HG1 VAL 4 2HG1 VAL 4 4.595 -6.283 1.693
24 3HG1 VAL 4 3HG1 VAL 4 5.580 -7.746 1.743
25 1HG2 VAL 4 1HG2 VAL 4 8.284 -6.834 1.702
26 2HG2 VAL 4 2HG2 VAL 4 7.653 -7.776 3.054
27 3HG2 VAL 4 3HG2 VAL 4 8.502 -6.260 3.356
28 H VAL 5 H VAL 5 4.254 -4.252 2.410
29 HA VAL 5 HA VAL 5 4.380 -2.678 4.860
30 HB VAL 5 HB VAL 5 3.986 -0.824 3.712
31 1HG1 VAL 5 1HG1 VAL 5 2.607 -1.228 1.358
32 2HG1 VAL 5 2HG1 VAL 5 3.661 -2.629 1.498
33 3HG1 VAL 5 3HG1 VAL 5 4.341 -1.013 1.559
34 1HG2 VAL 5 1HG2 VAL 5 1.624 -0.323 3.132
35 2HG2 VAL 5 2HG2 VAL 5 1.864 -0.946 4.765
36 3HG2 VAL 5 3HG2 VAL 5 1.230 -2.002 3.500
37 H GLN 6 H GLN 6 2.339 -2.585 6.021
38 HA GLN 6 HA GLN 6 0.582 -4.855 5.365
39 1HB GLN 6 2HB GLN 6 2.499 -4.926 7.350
40 2HB GLN 6 1HB GLN 6 1.036 -4.492 8.231
41 1HG GLN 6 2HG GLN 6 0.038 -6.492 7.856
42 2HG GLN 6 1HG GLN 6 0.832 -6.723 6.299
43 1HE2 GLN 6 1HE2 GLN 6 1.746 -6.389 9.715
44 2HE2 GLN 6 2HE2 GLN 6 2.877 -7.695 9.719
45 H THR 7 H THR 7 -1.563 -4.628 5.824
46 HA THR 7 HA THR 7 -2.347 -2.030 6.960
47 HB THR 7 HB THR 7 -4.542 -3.199 5.612
48 HG1 THR 7 1HG THR 7 -3.719 -3.576 3.599
49 1HG2 THR 7 1HG2 THR 7 -2.878 -1.032 4.415
50 2HG2 THR 7 2HG2 THR 7 -3.802 -0.743 5.889
51 3HG2 THR 7 3HG2 THR 7 -4.630 -1.237 4.412
52 H LEU 8 H LEU 8 -4.487 -2.012 8.008
53 HA LEU 8 HA LEU 8 -4.898 -4.474 9.565
54 1HB LEU 8 2HB LEU 8 -5.808 -2.284 11.084
55 2HB LEU 8 1HB LEU 8 -4.465 -3.347 11.432
56 HG LEU 8 HG LEU 8 -3.752 -1.054 11.580
57 1HD1 LEU 8 1HD1 LEU 8 -2.419 -1.546 9.058
58 2HD1 LEU 8 2HD1 LEU 8 -2.504 -2.996 10.058
59 3HD1 LEU 8 3HD1 LEU 8 -1.771 -1.526 10.698
60 1HD2 LEU 8 1HD2 LEU 8 -4.512 0.552 10.260
61 2HD2 LEU 8 2HD2 LEU 8 -5.520 -0.648 9.454
62 3HD2 LEU 8 3HD2 LEU 8 -3.917 -0.275 8.821
63 H TYR 9 H TYR 9 -6.327 -1.725 7.958
64 HA TYR 9 HA TYR 9 -8.967 -3.000 8.228
65 1HB TYR 9 2HB TYR 9 -8.506 -0.021 8.008
66 2HB TYR 9 1HB TYR 9 -10.021 -0.847 8.352
67 HD1 TYR 9 1HD TYR 9 -7.277 0.839 9.771
68 HD2 TYR 9 2HD TYR 9 -10.018 -2.326 10.526
69 HE1 TYR 9 1HE TYR 9 -6.829 1.033 12.180
70 HE2 TYR 9 2HE TYR 9 -9.578 -2.139 12.937
71 HH TYR 9 HH TYR 9 -8.600 0.115 14.461
72 HA PRO 10 HA PRO 10 -9.634 -3.188 3.884
73 1HB PRO 10 2HB PRO 10 -11.722 -1.070 4.236
74 2HB PRO 10 1HB PRO 10 -11.808 -2.594 3.344
75 1HG PRO 10 2HG PRO 10 -12.930 -2.368 5.747
76 2HG PRO 10 1HG PRO 10 -12.096 -3.858 5.268
77 1HD PRO 10 2HD PRO 10 -11.239 -1.734 7.158
78 2HD PRO 10 1HD PRO 10 -10.852 -3.465 7.152
79 H PHE 11 H PHE 11 -9.094 -2.135 1.972
80 HA PHE 11 HA PHE 11 -7.709 0.410 2.337
81 1HB PHE 11 2HB PHE 11 -6.339 -1.239 1.311
82 2HB PHE 11 1HB PHE 11 -7.613 -1.704 0.189
83 HD1 PHE 11 1HD PHE 11 -6.284 1.660 1.079
84 HD2 PHE 11 2HD PHE 11 -6.796 -1.308 -1.926
85 HE1 PHE 11 1HE PHE 11 -5.375 3.211 -0.602
86 HE2 PHE 11 2HE PHE 11 -5.887 0.235 -3.609
87 HZ PHE 11 HZ PHE 11 -5.173 2.497 -2.951
88 H SER 12 H SER 12 -8.409 2.278 1.514
89 HA SER 12 HA SER 12 -10.551 2.214 -0.503
90 1HB SER 12 2HB SER 12 -10.442 3.730 2.085
91 2HB SER 12 1HB SER 12 -11.349 4.378 0.719
92 HG SER 12 HG SER 12 -12.830 3.149 1.660
93 H SER 13 H SER 13 -10.508 3.827 -2.055
94 HA SER 13 HA SER 13 -8.838 6.108 -1.935
95 1HB SER 13 2HB SER 13 -7.689 3.627 -3.055
96 2HB SER 13 1HB SER 13 -7.495 5.064 -4.057
97 HG SER 13 HG SER 13 -6.260 5.973 -2.556
98 H VAL 14 H VAL 14 -8.818 7.310 -3.998
99 HA VAL 14 HA VAL 14 -10.366 6.505 -6.215
100 HB VAL 14 HB VAL 14 -12.244 6.719 -4.690
101 1HG1 VAL 14 1HG1 VAL 14 -11.862 9.642 -4.418
102 2HG1 VAL 14 2HG1 VAL 14 -10.874 8.584 -3.410
103 3HG1 VAL 14 3HG1 VAL 14 -12.633 8.490 -3.328
104 1HG2 VAL 14 1HG2 VAL 14 -12.463 7.382 -7.090
105 2HG2 VAL 14 2HG2 VAL 14 -12.228 9.058 -6.593
106 3HG2 VAL 14 3HG2 VAL 14 -13.628 8.154 -6.016
107 H THR 15 H THR 15 -8.587 7.373 -7.298
108 HA THR 15 HA THR 15 -8.795 10.173 -7.886
109 HB THR 15 HB THR 15 -6.078 9.354 -6.944
110 HG1 THR 15 1HG THR 15 -8.090 10.407 -5.248
111 1HG2 THR 15 1HG2 THR 15 -6.538 11.911 -6.121
112 2HG2 THR 15 2HG2 THR 15 -7.441 11.835 -7.634
113 3HG2 THR 15 3HG2 THR 15 -5.721 11.448 -7.613
114 H GLU 16 H GLU 16 -6.963 10.810 -9.469
115 HA GLU 16 HA GLU 16 -7.091 9.059 -11.669
116 1HB GLU 16 2HB GLU 16 -6.726 11.098 -12.545
117 2HB GLU 16 1HB GLU 16 -5.981 11.693 -11.070
118 1HG GLU 16 2HG GLU 16 -4.424 11.855 -12.885
119 2HG GLU 16 1HG GLU 16 -3.866 10.634 -11.742
120 H GLU 17 H GLU 17 -4.707 9.526 -9.150
121 HA GLU 17 HA GLU 17 -2.899 7.623 -10.455
122 1HB GLU 17 2HB GLU 17 -2.303 9.045 -7.873
123 2HB GLU 17 1HB GLU 17 -1.181 8.385 -9.052
124 1HG GLU 17 2HG GLU 17 -1.304 10.203 -10.407
125 2HG GLU 17 1HG GLU 17 -2.957 10.587 -9.934
126 H GLU 18 H GLU 18 -4.441 8.175 -7.296
127 HA GLU 18 HA GLU 18 -3.694 5.707 -6.166
128 1HB GLU 18 2HB GLU 18 -6.247 7.112 -5.426
129 2HB GLU 18 1HB GLU 18 -5.148 6.212 -4.394
130 1HG GLU 18 2HG GLU 18 -3.477 8.021 -4.696
131 2HG GLU 18 1HG GLU 18 -4.693 8.935 -5.584
132 H LEU 19 H LEU 19 -5.027 3.806 -5.793
133 HA LEU 19 HA LEU 19 -7.467 3.542 -7.325
134 1HB LEU 19 2HB LEU 19 -6.835 1.876 -8.790
135 2HB LEU 19 1HB LEU 19 -5.479 2.978 -8.837
136 HG LEU 19 HG LEU 19 -4.473 0.902 -8.821
137 1HD1 LEU 19 1HD1 LEU 19 -3.897 2.493 -6.812
138 2HD1 LEU 19 2HD1 LEU 19 -3.142 0.915 -7.019
139 3HD1 LEU 19 3HD1 LEU 19 -4.473 1.109 -5.882
140 1HD2 LEU 19 1HD2 LEU 19 -5.731 -0.375 -6.534
141 2HD2 LEU 19 2HD2 LEU 19 -5.426 -0.996 -8.158
142 3HD2 LEU 19 3HD2 LEU 19 -6.866 -0.036 -7.839
143 H ASN 20 H ASN 20 -8.632 1.509 -6.851
144 HA ASN 20 HA ASN 20 -8.117 0.761 -4.067
145 1HB ASN 20 2HB ASN 20 -10.502 -0.103 -4.183
146 2HB ASN 20 1HB ASN 20 -10.292 1.639 -4.339
147 1HD2 ASN 20 1HD2 ASN 20 -10.598 -1.312 -6.265
148 2HD2 ASN 20 2HD2 ASN 20 -11.467 -0.579 -7.567
149 H PHE 21 H PHE 21 -8.343 -1.340 -3.304
150 HA PHE 21 HA PHE 21 -8.106 -3.527 -5.261
151 1HB PHE 21 2HB PHE 21 -6.438 -3.296 -2.753
152 2HB PHE 21 1HB PHE 21 -6.351 -4.567 -3.961
153 HD1 PHE 21 1HD PHE 21 -5.913 -3.601 -6.429
154 HD2 PHE 21 2HD PHE 21 -4.794 -1.734 -2.776
155 HE1 PHE 21 1HE PHE 21 -4.133 -2.384 -7.591
156 HE2 PHE 21 2HE PHE 21 -3.013 -0.505 -3.938
157 HZ PHE 21 HZ PHE 21 -2.677 -0.836 -6.352
158 H GLU 22 H GLU 22 -8.466 -5.674 -4.239
159 HA GLU 22 HA GLU 22 -10.836 -5.709 -2.685
160 1HB GLU 22 2HB GLU 22 -9.369 -7.563 -4.186
161 2HB GLU 22 1HB GLU 22 -9.304 -8.182 -2.542
162 1HG GLU 22 2HG GLU 22 -11.720 -8.168 -2.408
163 2HG GLU 22 1HG GLU 22 -11.825 -7.456 -4.018
164 H LYS 23 H LYS 23 -10.084 -7.849 -0.778
165 HA LYS 23 HA LYS 23 -9.532 -6.322 1.459
166 1HB LYS 23 2HB LYS 23 -10.011 -8.279 2.428
167 2HB LYS 23 1HB LYS 23 -9.883 -9.083 0.877
168 1HG LYS 23 2HG LYS 23 -8.473 -10.208 2.447
169 2HG LYS 23 1HG LYS 23 -7.459 -9.386 1.267
170 1HD LYS 23 2HD LYS 23 -7.020 -9.290 3.913
171 2HD LYS 23 1HD LYS 23 -6.556 -7.989 2.819
172 1HE LYS 23 2HE LYS 23 -7.681 -7.089 4.769
173 2HE LYS 23 1HE LYS 23 -8.681 -6.843 3.339
174 1HZ LYS 23 1HZ LYS 23 -9.600 -9.190 4.204
175 2HZ LYS 23 2HZ LYS 23 -10.266 -7.702 4.656
176 3HZ LYS 23 3HZ LYS 23 -9.169 -8.483 5.679
177 H GLY 24 H GLY 24 -7.774 -5.367 2.232
178 1HA GLY 24 2HA GLY 24 -5.157 -6.216 1.162
179 2HA GLY 24 1HA GLY 24 -5.590 -4.525 1.355
180 H GLU 25 H GLU 25 -4.777 -7.483 3.023
181 HA GLU 25 HA GLU 25 -4.489 -6.063 5.546
182 1HB GLU 25 2HB GLU 25 -5.329 -8.645 4.936
183 2HB GLU 25 1HB GLU 25 -3.700 -8.865 5.563
184 1HG GLU 25 2HG GLU 25 -4.243 -8.058 7.644
185 2HG GLU 25 1HG GLU 25 -5.624 -7.142 7.042
186 H THR 26 H THR 26 -2.774 -7.290 2.905
187 HA THR 26 HA THR 26 -0.252 -6.417 4.076
188 HB THR 26 HB THR 26 0.784 -8.414 2.780
189 HG1 THR 26 1HG THR 26 -1.170 -9.115 1.840
190 1HG2 THR 26 1HG2 THR 26 1.258 -8.963 4.870
191 2HG2 THR 26 2HG2 THR 26 -0.243 -9.890 4.889
192 3HG2 THR 26 3HG2 THR 26 -0.227 -8.224 5.469
193 H MET 27 H MET 27 0.844 -5.132 2.764
194 HA MET 27 HA MET 27 0.469 -5.310 -0.136
195 1HB MET 27 2HB MET 27 -0.142 -2.964 1.600
196 2HB MET 27 1HB MET 27 0.584 -2.660 0.029
197 1HG MET 27 2HG MET 27 -1.565 -2.579 -0.620
198 2HG MET 27 1HG MET 27 -1.363 -4.328 -0.718
199 1HE MET 27 1HE MET 27 -4.610 -3.573 -0.278
200 2HE MET 27 2HE MET 27 -3.655 -2.093 -0.338
201 3HE MET 27 3HE MET 27 -4.705 -2.409 1.043
202 H GLU 28 H GLU 28 2.164 -4.003 -1.308
203 HA GLU 28 HA GLU 28 4.634 -3.832 0.300
204 1HB GLU 28 2HB GLU 28 4.697 -4.603 -2.582
205 2HB GLU 28 1HB GLU 28 5.901 -4.892 -1.342
206 1HG GLU 28 2HG GLU 28 4.027 -6.398 -0.306
207 2HG GLU 28 1HG GLU 28 3.402 -6.392 -1.954
208 H VAL 29 H VAL 29 5.316 -1.824 0.373
209 HA VAL 29 HA VAL 29 4.639 0.025 -1.779
210 HB VAL 29 HB VAL 29 5.580 0.407 1.052
211 1HG1 VAL 29 1HG1 VAL 29 5.229 2.935 0.344
212 2HG1 VAL 29 2HG1 VAL 29 5.780 2.316 -1.213
213 3HG1 VAL 29 3HG1 VAL 29 6.799 2.144 0.217
214 1HG2 VAL 29 1HG2 VAL 29 3.097 0.164 0.002
215 2HG2 VAL 29 2HG2 VAL 29 3.308 1.915 -0.024
216 3HG2 VAL 29 3HG2 VAL 29 3.474 1.028 1.492
217 H ILE 30 H ILE 30 6.044 0.662 -3.233
218 HA ILE 30 HA ILE 30 8.704 -0.410 -3.242
219 HB ILE 30 HB ILE 30 8.728 1.251 -5.385
220 1HG1 ILE 30 2HG1 ILE 30 6.222 1.746 -4.629
221 2HG1 ILE 30 1HG1 ILE 30 6.667 1.645 -6.323
222 1HG2 ILE 30 1HG2 ILE 30 7.698 -0.866 -6.568
223 2HG2 ILE 30 2HG2 ILE 30 7.912 -1.569 -4.964
224 3HG2 ILE 30 3HG2 ILE 30 9.298 -0.903 -5.827
225 1HD1 ILE 30 1HD1 ILE 30 5.410 -0.541 -4.688
226 2HD1 ILE 30 2HD1 ILE 30 5.898 -0.681 -6.376
227 3HD1 ILE 30 3HD1 ILE 30 4.619 0.438 -5.919
228 H GLU 31 H GLU 31 7.831 2.939 -4.068
229 HA GLU 31 HA GLU 31 10.367 3.832 -3.011
230 1HB GLU 31 2HB GLU 31 9.736 6.022 -3.935
231 2HB GLU 31 1HB GLU 31 9.606 4.736 -5.128
232 1HG GLU 31 2HG GLU 31 7.088 4.807 -4.058
233 2HG GLU 31 1HG GLU 31 7.562 6.506 -4.046
234 H LYS 32 H LYS 32 10.743 4.989 -1.228
235 HA LYS 32 HA LYS 32 8.550 5.332 0.653
236 1HB LYS 32 2HB LYS 32 11.481 5.779 1.183
237 2HB LYS 32 1HB LYS 32 10.204 5.452 2.340
238 1HG LYS 32 2HG LYS 32 11.373 3.532 0.350
239 2HG LYS 32 1HG LYS 32 11.549 3.493 2.105
240 1HD LYS 32 2HD LYS 32 9.348 2.813 2.436
241 2HD LYS 32 1HD LYS 32 8.833 3.374 0.844
242 1HE LYS 32 2HE LYS 32 9.386 0.779 1.509
243 2HE LYS 32 1HE LYS 32 9.349 1.431 -0.128
244 1HZ LYS 32 1HZ LYS 32 11.665 1.627 -0.170
245 2HZ LYS 32 2HZ LYS 32 11.396 0.127 0.561
246 3HZ LYS 32 3HZ LYS 32 11.817 1.463 1.509
247 HA PRO 33 HA PRO 33 8.455 9.715 0.237
248 1HB PRO 33 2HB PRO 33 8.081 10.120 3.096
249 2HB PRO 33 1HB PRO 33 6.908 10.280 1.787
250 1HG PRO 33 2HG PRO 33 6.779 8.297 3.630
251 2HG PRO 33 1HG PRO 33 6.216 8.095 1.959
252 1HD PRO 33 2HD PRO 33 8.806 7.226 3.202
253 2HD PRO 33 1HD PRO 33 7.737 6.337 2.097
254 H GLU 34 H GLU 34 11.032 8.284 1.632
255 HA GLU 34 HA GLU 34 12.302 10.289 3.108
256 1HB GLU 34 2HB GLU 34 14.395 9.095 2.584
257 2HB GLU 34 1HB GLU 34 13.119 7.996 3.088
258 1HG GLU 34 2HG GLU 34 12.756 7.263 0.859
259 2HG GLU 34 1HG GLU 34 13.794 8.532 0.210
260 H ASN 35 H ASN 35 12.044 9.750 -0.342
261 HA ASN 35 HA ASN 35 13.802 12.025 -0.890
262 1HB ASN 35 2HB ASN 35 13.460 11.300 -3.301
263 2HB ASN 35 1HB ASN 35 14.307 10.151 -2.270
264 1HD2 ASN 35 1HD2 ASN 35 13.590 8.141 -2.221
265 2HD2 ASN 35 2HD2 ASN 35 12.058 7.601 -2.811
266 H ASP 36 H ASP 36 10.508 10.876 -1.500
267 HA ASP 36 HA ASP 36 9.717 13.665 -2.027
268 1HB ASP 36 2HB ASP 36 9.064 11.158 -3.486
269 2HB ASP 36 1HB ASP 36 7.765 12.330 -3.296
270 HA PRO 37 HA PRO 37 7.300 12.441 1.627
271 1HB PRO 37 2HB PRO 37 6.978 14.917 2.626
272 2HB PRO 37 1HB PRO 37 8.496 14.028 2.802
273 1HG PRO 37 2HG PRO 37 7.780 16.190 0.860
274 2HG PRO 37 1HG PRO 37 9.282 15.958 1.773
275 1HD PRO 37 2HD PRO 37 8.972 15.239 -0.848
276 2HD PRO 37 1HD PRO 37 10.114 14.454 0.260
277 H GLU 38 H GLU 38 5.919 12.245 -0.661
278 HA GLU 38 HA GLU 38 3.587 13.985 -0.248
279 1HB GLU 38 2HB GLU 38 5.147 13.498 -2.603
280 2HB GLU 38 1HB GLU 38 3.515 12.905 -2.858
281 1HG GLU 38 2HG GLU 38 4.292 15.689 -2.020
282 2HG GLU 38 1HG GLU 38 3.732 15.194 -3.616
283 H TRP 39 H TRP 39 4.089 11.061 -2.207
284 HA TRP 39 HA TRP 39 2.394 9.489 -0.443
285 1HB TRP 39 2HB TRP 39 1.562 9.435 -3.294
286 2HB TRP 39 1HB TRP 39 0.600 9.174 -1.850
287 HD1 TRP 39 HD TRP 39 -0.248 11.462 -0.560
288 HE1 TRP 39 1HE TRP 39 -0.812 13.776 -1.539
289 HE3 TRP 39 3HE TRP 39 2.169 11.056 -5.046
290 HZ2 TRP 39 2HZ TRP 39 -0.297 15.236 -3.904
291 HZ3 TRP 39 3HZ TRP 39 2.085 12.953 -6.610
292 HH2 TRP 39 HH TRP 39 0.877 14.999 -6.049
293 H TRP 40 H TRP 40 2.333 7.211 -1.035
294 HA TRP 40 HA TRP 40 4.577 6.447 -2.781
295 1HB TRP 40 2HB TRP 40 4.566 4.286 -1.352
296 2HB TRP 40 1HB TRP 40 5.319 5.731 -0.693
297 HD1 TRP 40 HD TRP 40 1.640 4.435 -0.568
298 HE1 TRP 40 1HE TRP 40 0.879 4.523 1.879
299 HE3 TRP 40 3HE TRP 40 5.936 6.160 1.554
300 HZ2 TRP 40 2HZ TRP 40 1.970 5.248 4.401
301 HZ3 TRP 40 3HZ TRP 40 6.011 6.527 3.981
302 HH2 TRP 40 HH TRP 40 4.062 6.080 5.377
303 H LYS 41 H LYS 41 4.196 3.900 -3.286
304 HA LYS 41 HA LYS 41 1.438 3.354 -3.881
305 1HB LYS 41 2HB LYS 41 2.050 2.903 -6.330
306 2HB LYS 41 1HB LYS 41 1.749 4.560 -5.838
307 1HG LYS 41 2HG LYS 41 3.624 4.732 -7.136
308 2HG LYS 41 1HG LYS 41 4.299 4.677 -5.515
309 1HD LYS 41 2HD LYS 41 5.634 3.117 -6.517
310 2HD LYS 41 1HD LYS 41 4.296 2.083 -6.044
311 1HE LYS 41 2HE LYS 41 5.314 2.614 -8.655
312 2HE LYS 41 1HE LYS 41 4.093 1.448 -8.147
313 1HZ LYS 41 1HZ LYS 41 3.683 4.254 -9.013
314 2HZ LYS 41 2HZ LYS 41 2.481 3.365 -8.222
315 3HZ LYS 41 3HZ LYS 41 3.071 2.843 -9.718
316 H CYS 42 H CYS 42 0.982 1.220 -4.081
317 HA CYS 42 HA CYS 42 3.273 -0.607 -4.107
318 1HB CYS 42 2HB CYS 42 1.873 -2.026 -2.467
319 2HB CYS 42 1HB CYS 42 2.703 -0.615 -1.821
320 HG CYS 42 HG CYS 42 0.267 0.591 -2.052
321 H LYS 43 H LYS 43 2.793 -2.747 -4.871
322 HA LYS 43 HA LYS 43 0.652 -2.748 -6.841
323 1HB LYS 43 2HB LYS 43 1.768 -4.696 -7.783
324 2HB LYS 43 1HB LYS 43 2.918 -3.388 -7.549
325 1HG LYS 43 2HG LYS 43 3.312 -4.626 -5.248
326 2HG LYS 43 1HG LYS 43 2.710 -6.005 -6.170
327 1HD LYS 43 2HD LYS 43 4.761 -4.325 -7.482
328 2HD LYS 43 1HD LYS 43 5.295 -5.295 -6.109
329 1HE LYS 43 2HE LYS 43 5.575 -6.474 -8.248
330 2HE LYS 43 1HE LYS 43 4.460 -7.308 -7.166
331 1HZ LYS 43 1HZ LYS 43 3.280 -5.415 -9.035
332 2HZ LYS 43 2HZ LYS 43 2.716 -6.924 -8.521
333 3HZ LYS 43 3HZ LYS 43 3.917 -6.831 -9.709
334 H ASN 44 H ASN 44 -1.043 -4.036 -6.850
335 HA ASN 44 HA ASN 44 -1.464 -5.744 -4.501
336 1HB ASN 44 2HB ASN 44 -2.996 -3.695 -5.078
337 2HB ASN 44 1HB ASN 44 -3.697 -4.797 -6.254
338 1HD2 ASN 44 1HD2 ASN 44 -3.281 -4.061 -2.899
339 2HD2 ASN 44 2HD2 ASN 44 -4.437 -5.193 -2.293
340 H ALA 45 H ALA 45 -3.178 -7.507 -5.050
341 HA ALA 45 HA ALA 45 -1.985 -9.129 -7.055
342 1HB ALA 45 1HB ALA 45 -4.483 -9.522 -5.412
343 2HB ALA 45 2HB ALA 45 -2.880 -10.178 -5.083
344 3HB ALA 45 3HB ALA 45 -3.794 -10.742 -6.482
345 H ARG 46 H ARG 46 -4.039 -6.584 -7.279
346 HA ARG 46 HA ARG 46 -5.773 -7.541 -9.374
347 1HB ARG 46 2HB ARG 46 -5.291 -4.883 -8.057
348 2HB ARG 46 1HB ARG 46 -6.281 -5.013 -9.500
349 1HG ARG 46 2HG ARG 46 -7.398 -5.012 -7.186
350 2HG ARG 46 1HG ARG 46 -7.964 -6.149 -8.407
351 1HD ARG 46 2HD ARG 46 -5.869 -6.928 -6.407
352 2HD ARG 46 1HD ARG 46 -7.578 -6.971 -5.987
353 HE ARG 46 HE ARG 46 -6.195 -8.883 -7.529
354 1HH1 ARG 46 1HH1 ARG 46 -9.252 -7.208 -7.379
355 2HH1 ARG 46 2HH1 ARG 46 -10.125 -8.472 -8.180
356 1HH2 ARG 46 1HH2 ARG 46 -7.342 -10.548 -8.575
357 2HH2 ARG 46 2HH2 ARG 46 -9.042 -10.367 -8.856
358 H GLY 47 H GLY 47 -2.561 -6.729 -9.232
359 1HA GLY 47 2HA GLY 47 -1.018 -6.448 -10.931
360 2HA GLY 47 1HA GLY 47 -2.345 -6.430 -12.085
361 H GLN 48 H GLN 48 -3.000 -4.288 -9.634
362 HA GLN 48 HA GLN 48 -1.918 -2.016 -11.151
363 1HB GLN 48 2HB GLN 48 -4.017 -0.930 -9.817
364 2HB GLN 48 1HB GLN 48 -4.085 -1.506 -11.470
365 1HG GLN 48 2HG GLN 48 -4.719 -3.779 -10.316
366 2HG GLN 48 1HG GLN 48 -5.194 -2.711 -8.996
367 1HE2 GLN 48 1HE2 GLN 48 -6.074 -0.533 -10.498
368 2HE2 GLN 48 2HE2 GLN 48 -7.517 -0.988 -11.333
369 H VAL 49 H VAL 49 -0.902 -0.413 -10.093
370 HA VAL 49 HA VAL 49 -0.967 -0.457 -7.168
371 HB VAL 49 HB VAL 49 1.135 -1.356 -7.277
372 1HG1 VAL 49 1HG1 VAL 49 1.178 -1.454 -9.727
373 2HG1 VAL 49 2HG1 VAL 49 2.739 -1.103 -8.982
374 3HG1 VAL 49 3HG1 VAL 49 1.805 0.194 -9.731
375 1HG2 VAL 49 1HG2 VAL 49 2.061 1.429 -7.789
376 2HG2 VAL 49 2HG2 VAL 49 2.644 0.256 -6.608
377 3HG2 VAL 49 3HG2 VAL 49 1.095 1.062 -6.359
378 H GLY 50 H GLY 50 -1.419 1.437 -6.377
379 1HA GLY 50 2HA GLY 50 -0.808 3.814 -7.991
380 2HA GLY 50 1HA GLY 50 -2.409 3.580 -7.315
381 H LEU 51 H LEU 51 -1.931 5.662 -6.339
382 HA LEU 51 HA LEU 51 0.032 5.651 -4.231
383 1HB LEU 51 2HB LEU 51 -1.796 7.682 -5.406
384 2HB LEU 51 1HB LEU 51 -1.079 7.981 -3.834
385 HG LEU 51 HG LEU 51 0.913 8.488 -4.721
386 1HD1 LEU 51 1HD1 LEU 51 0.540 6.112 -6.478
387 2HD1 LEU 51 2HD1 LEU 51 1.729 6.387 -5.206
388 3HD1 LEU 51 3HD1 LEU 51 1.862 7.247 -6.738
389 1HD2 LEU 51 1HD2 LEU 51 -1.030 9.341 -6.383
390 2HD2 LEU 51 2HD2 LEU 51 0.011 8.463 -7.503
391 3HD2 LEU 51 3HD2 LEU 51 0.671 9.781 -6.536
392 H VAL 52 H VAL 52 -0.270 5.277 -2.174
393 HA VAL 52 HA VAL 52 -3.010 5.183 -1.105
394 HB VAL 52 HB VAL 52 -2.375 2.899 -1.595
395 1HG1 VAL 52 1HG1 VAL 52 0.077 3.419 0.087
396 2HG1 VAL 52 2HG1 VAL 52 0.045 3.226 -1.666
397 3HG1 VAL 52 3HG1 VAL 52 -0.383 1.872 -0.622
398 1HG2 VAL 52 1HG2 VAL 52 -2.290 3.598 1.337
399 2HG2 VAL 52 2HG2 VAL 52 -2.375 1.940 0.745
400 3HG2 VAL 52 3HG2 VAL 52 -3.676 3.071 0.385
401 HA PRO 53 HA PRO 53 -1.025 7.359 2.294
402 1HB PRO 53 2HB PRO 53 -3.149 7.879 3.714
403 2HB PRO 53 1HB PRO 53 -3.164 8.402 2.015
404 1HG PRO 53 2HG PRO 53 -4.216 5.830 3.165
405 2HG PRO 53 1HG PRO 53 -5.147 7.056 2.261
406 1HD PRO 53 2HD PRO 53 -4.059 4.884 1.069
407 2HD PRO 53 1HD PRO 53 -4.142 6.458 0.244
408 H LYS 54 H LYS 54 -0.250 4.803 2.564
409 HA LYS 54 HA LYS 54 -1.275 3.070 4.373
410 1HB LYS 54 2HB LYS 54 1.435 3.677 3.448
411 2HB LYS 54 1HB LYS 54 1.365 2.830 4.973
412 1HG LYS 54 2HG LYS 54 1.531 1.531 2.736
413 2HG LYS 54 1HG LYS 54 0.498 0.941 4.028
414 1HD LYS 54 2HD LYS 54 -1.065 2.693 2.459
415 2HD LYS 54 1HD LYS 54 -0.186 1.648 1.348
416 1HE LYS 54 2HE LYS 54 -1.246 0.158 3.589
417 2HE LYS 54 1HE LYS 54 -2.517 1.033 2.737
418 1HZ LYS 54 1HZ LYS 54 -2.202 -1.160 1.803
419 2HZ LYS 54 2HZ LYS 54 -0.567 -0.840 1.507
420 3HZ LYS 54 3HZ LYS 54 -1.761 0.016 0.669
421 H ASN 55 H ASN 55 -0.342 6.234 5.199
422 HA ASN 55 HA ASN 55 0.742 6.117 7.693
423 1HB ASN 55 2HB ASN 55 -0.347 8.102 6.214
424 2HB ASN 55 1HB ASN 55 -1.566 7.955 7.476
425 1HD2 ASN 55 1HD2 ASN 55 -0.170 7.402 9.686
426 2HD2 ASN 55 2HD2 ASN 55 0.928 8.681 10.061
427 H TYR 56 H TYR 56 -2.357 4.910 6.766
428 HA TYR 56 HA TYR 56 -3.207 4.673 9.566
429 1HB TYR 56 2HB TYR 56 -5.415 4.334 8.784
430 2HB TYR 56 1HB TYR 56 -4.761 5.615 7.777
431 HD1 TYR 56 1HD TYR 56 -6.018 2.200 7.843
432 HD2 TYR 56 2HD TYR 56 -4.208 5.192 5.426
433 HE1 TYR 56 1HE TYR 56 -6.637 0.937 5.828
434 HE2 TYR 56 2HE TYR 56 -4.816 3.937 3.403
435 HH TYR 56 HH TYR 56 -6.853 2.084 2.934
436 H VAL 57 H VAL 57 -1.065 3.123 8.423
437 HA VAL 57 HA VAL 57 -2.083 0.450 9.033
438 HB VAL 57 HB VAL 57 -1.542 -0.540 7.043
439 1HG1 VAL 57 1HG1 VAL 57 -2.003 2.263 6.045
440 2HG1 VAL 57 2HG1 VAL 57 -3.270 1.140 6.541
441 3HG1 VAL 57 3HG1 VAL 57 -2.262 0.770 5.142
442 1HG2 VAL 57 1HG2 VAL 57 0.803 0.024 7.022
443 2HG2 VAL 57 2HG2 VAL 57 0.431 1.658 6.481
444 3HG2 VAL 57 3HG2 VAL 57 0.110 0.286 5.427
445 H VAL 58 H VAL 58 -0.096 -1.117 8.911
446 HA VAL 58 HA VAL 58 2.174 0.230 10.221
447 HB VAL 58 HB VAL 58 1.035 -1.428 11.652
448 1HG1 VAL 58 1HG1 VAL 58 0.422 -3.471 10.986
449 2HG1 VAL 58 2HG1 VAL 58 1.967 -3.777 10.195
450 3HG1 VAL 58 3HG1 VAL 58 0.707 -2.879 9.349
451 1HG2 VAL 58 1HG2 VAL 58 2.962 -2.336 12.515
452 2HG2 VAL 58 2HG2 VAL 58 3.621 -1.046 11.508
453 3HG2 VAL 58 3HG2 VAL 58 3.627 -2.709 10.925
454 H VAL 59 H VAL 59 3.808 0.512 8.831
455 HA VAL 59 HA VAL 59 4.003 -0.954 6.408
456 HB VAL 59 HB VAL 59 6.155 0.779 7.611
457 1HG1 VAL 59 1HG1 VAL 59 6.246 1.008 4.873
458 2HG1 VAL 59 2HG1 VAL 59 5.830 -0.691 5.103
459 3HG1 VAL 59 3HG1 VAL 59 7.287 -0.035 5.850
460 1HG2 VAL 59 1HG2 VAL 59 4.005 1.612 5.667
461 2HG2 VAL 59 2HG2 VAL 59 5.213 2.636 6.442
462 3HG2 VAL 59 3HG2 VAL 59 3.924 1.912 7.403
463 H LEU 60 H LEU 60 5.508 -2.400 5.721
464 HA LEU 60 HA LEU 60 6.776 -3.963 7.800
465 1HB LEU 60 2HB LEU 60 5.371 -4.550 5.345
466 2HB LEU 60 1HB LEU 60 6.955 -5.295 5.343
467 HG LEU 60 HG LEU 60 6.443 -6.694 7.126
468 1HD1 LEU 60 1HD1 LEU 60 4.258 -6.286 8.455
469 2HD1 LEU 60 2HD1 LEU 60 4.400 -4.636 7.849
470 3HD1 LEU 60 3HD1 LEU 60 5.690 -5.329 8.832
471 1HD2 LEU 60 1HD2 LEU 60 3.640 -6.600 6.231
472 2HD2 LEU 60 2HD2 LEU 60 4.778 -7.946 6.264
473 3HD2 LEU 60 3HD2 LEU 60 4.847 -6.765 4.957
474 H SER 61 H SER 61 8.860 -4.848 7.255
475 HA SER 61 HA SER 61 10.531 -3.894 5.217
476 1HB SER 61 2HB SER 61 10.100 -1.897 7.006
477 2HB SER 61 1HB SER 61 11.522 -2.662 7.715
478 HG SER 61 HG SER 61 11.249 -1.632 5.086
Start of MODEL 4
1 1H GLY 1 1HT GLY 1 14.503 -10.465 4.668
2 2H GLY 1 2HT GLY 1 13.827 -10.987 3.209
3 3H GLY 1 3HT GLY 1 13.205 -9.621 3.987
4 1HA GLY 1 1HA GLY 1 15.655 -8.766 3.730
5 2HA GLY 1 2HA GLY 1 15.651 -9.917 2.403
6 H SER 2 H SER 2 12.697 -9.427 2.046
7 HA SER 2 HA SER 2 13.003 -7.132 0.286
8 1HB SER 2 2HB SER 2 11.561 -9.545 0.143
9 2HB SER 2 1HB SER 2 10.342 -8.273 0.278
10 HG SER 2 HG SER 2 10.713 -8.140 -1.803
11 H HIS 3 H HIS 3 11.837 -5.249 0.418
12 HA HIS 3 HA HIS 3 10.771 -4.615 3.031
13 1HB HIS 3 2HB HIS 3 10.205 -2.405 1.533
14 2HB HIS 3 1HB HIS 3 11.710 -2.668 2.399
15 HD1 HIS 3 1HD HIS 3 13.802 -2.710 1.023
16 HD2 HIS 3 2HD HIS 3 10.371 -3.087 -1.291
17 HE1 HIS 3 1HE HIS 3 14.585 -2.592 -1.365
18 HE2 HIS 3 2HE HIS 3 12.498 -2.870 -2.748
19 H VAL 4 H VAL 4 8.744 -4.903 3.587
20 HA VAL 4 HA VAL 4 6.695 -4.851 1.473
21 HB VAL 4 HB VAL 4 5.988 -6.591 3.692
22 1HG1 VAL 4 1HG1 VAL 4 6.208 -6.978 0.708
23 2HG1 VAL 4 2HG1 VAL 4 4.756 -6.552 1.614
24 3HG1 VAL 4 3HG1 VAL 4 5.490 -8.142 1.820
25 1HG2 VAL 4 1HG2 VAL 4 8.215 -7.251 3.915
26 2HG2 VAL 4 2HG2 VAL 4 8.516 -7.149 2.180
27 3HG2 VAL 4 3HG2 VAL 4 7.521 -8.454 2.829
28 H VAL 5 H VAL 5 4.469 -4.596 2.382
29 HA VAL 5 HA VAL 5 4.492 -2.941 4.801
30 HB VAL 5 HB VAL 5 4.291 -1.230 3.318
31 1HG1 VAL 5 1HG1 VAL 5 3.677 -1.334 1.128
32 2HG1 VAL 5 2HG1 VAL 5 2.428 -2.534 1.415
33 3HG1 VAL 5 3HG1 VAL 5 4.121 -3.008 1.394
34 1HG2 VAL 5 1HG2 VAL 5 1.950 -0.521 3.061
35 2HG2 VAL 5 2HG2 VAL 5 2.334 -1.064 4.692
36 3HG2 VAL 5 3HG2 VAL 5 1.433 -2.117 3.599
37 H GLN 6 H GLN 6 2.390 -2.634 5.776
38 HA GLN 6 HA GLN 6 0.493 -4.818 5.263
39 1HB GLN 6 2HB GLN 6 2.349 -4.984 7.276
40 2HB GLN 6 1HB GLN 6 0.975 -4.266 8.112
41 1HG GLN 6 2HG GLN 6 -0.380 -6.103 7.751
42 2HG GLN 6 1HG GLN 6 0.597 -6.683 6.404
43 1HE2 GLN 6 1HE2 GLN 6 0.652 -8.739 7.388
44 2HE2 GLN 6 2HE2 GLN 6 1.708 -9.064 8.717
45 H THR 7 H THR 7 -1.661 -4.391 5.883
46 HA THR 7 HA THR 7 -2.151 -1.564 6.574
47 HB THR 7 HB THR 7 -4.535 -2.150 5.771
48 HG1 THR 7 1HG THR 7 -4.778 -4.091 5.086
49 1HG2 THR 7 1HG2 THR 7 -4.099 -1.205 3.785
50 2HG2 THR 7 2HG2 THR 7 -2.792 -2.330 3.411
51 3HG2 THR 7 3HG2 THR 7 -2.499 -0.960 4.484
52 H LEU 8 H LEU 8 -4.083 -1.146 7.902
53 HA LEU 8 HA LEU 8 -4.583 -3.286 9.844
54 1HB LEU 8 2HB LEU 8 -4.731 -0.963 11.329
55 2HB LEU 8 1HB LEU 8 -3.450 -2.153 11.386
56 HG LEU 8 HG LEU 8 -2.573 0.115 11.202
57 1HD1 LEU 8 1HD1 LEU 8 -1.942 -0.961 8.531
58 2HD1 LEU 8 2HD1 LEU 8 -1.656 -2.023 9.909
59 3HD1 LEU 8 3HD1 LEU 8 -0.874 -0.444 9.834
60 1HD2 LEU 8 1HD2 LEU 8 -4.688 0.701 9.682
61 2HD2 LEU 8 2HD2 LEU 8 -3.483 0.443 8.423
62 3HD2 LEU 8 3HD2 LEU 8 -3.200 1.649 9.675
63 H TYR 9 H TYR 9 -5.707 -0.317 8.325
64 HA TYR 9 HA TYR 9 -8.433 -0.970 9.244
65 1HB TYR 9 2HB TYR 9 -6.996 1.636 9.024
66 2HB TYR 9 1HB TYR 9 -8.709 1.622 8.618
67 HD1 TYR 9 1HD TYR 9 -6.356 1.888 11.245
68 HD2 TYR 9 2HD TYR 9 -10.292 0.528 10.378
69 HE1 TYR 9 1HE TYR 9 -6.924 2.031 13.633
70 HE2 TYR 9 2HE TYR 9 -10.873 0.667 12.763
71 HH TYR 9 HH TYR 9 -9.375 0.551 15.032
72 HA PRO 10 HA PRO 10 -9.369 -1.413 4.900
73 1HB PRO 10 2HB PRO 10 -12.075 -1.412 5.074
74 2HB PRO 10 1HB PRO 10 -11.096 -2.802 5.556
75 1HG PRO 10 2HG PRO 10 -12.343 -0.680 7.257
76 2HG PRO 10 1HG PRO 10 -12.249 -2.429 7.536
77 1HD PRO 10 2HD PRO 10 -10.589 -0.640 8.741
78 2HD PRO 10 1HD PRO 10 -10.110 -2.308 8.367
79 H PHE 11 H PHE 11 -8.473 0.989 5.329
80 HA PHE 11 HA PHE 11 -10.362 3.088 5.131
81 1HB PHE 11 2HB PHE 11 -7.407 2.874 5.097
82 2HB PHE 11 1HB PHE 11 -8.134 4.327 4.413
83 HD1 PHE 11 1HD PHE 11 -9.939 5.490 5.886
84 HD2 PHE 11 2HD PHE 11 -7.031 2.763 7.370
85 HE1 PHE 11 1HE PHE 11 -10.252 6.397 8.151
86 HE2 PHE 11 2HE PHE 11 -7.335 3.667 9.638
87 HZ PHE 11 HZ PHE 11 -8.948 5.485 10.032
88 H SER 12 H SER 12 -10.581 4.593 3.468
89 HA SER 12 HA SER 12 -10.746 3.332 0.850
90 1HB SER 12 2HB SER 12 -11.968 5.688 2.220
91 2HB SER 12 1HB SER 12 -11.999 5.610 0.454
92 HG SER 12 HG SER 12 -12.941 3.540 2.152
93 H SER 13 H SER 13 -10.015 4.324 -1.052
94 HA SER 13 HA SER 13 -8.223 6.615 -0.842
95 1HB SER 13 2HB SER 13 -7.388 3.837 -1.616
96 2HB SER 13 1HB SER 13 -6.591 5.227 -2.356
97 HG SER 13 HG SER 13 -6.185 5.966 -0.171
98 H VAL 14 H VAL 14 -9.433 7.883 -2.175
99 HA VAL 14 HA VAL 14 -9.801 6.904 -4.928
100 HB VAL 14 HB VAL 14 -11.862 8.320 -5.049
101 1HG1 VAL 14 1HG1 VAL 14 -12.225 6.011 -4.895
102 2HG1 VAL 14 2HG1 VAL 14 -13.246 6.704 -3.635
103 3HG1 VAL 14 3HG1 VAL 14 -11.708 5.953 -3.211
104 1HG2 VAL 14 1HG2 VAL 14 -11.735 9.843 -3.304
105 2HG2 VAL 14 2HG2 VAL 14 -11.256 8.616 -2.132
106 3HG2 VAL 14 3HG2 VAL 14 -12.920 8.680 -2.712
107 H THR 15 H THR 15 -8.257 7.961 -6.008
108 HA THR 15 HA THR 15 -8.475 10.815 -6.298
109 HB THR 15 HB THR 15 -5.733 9.878 -5.556
110 HG1 THR 15 1HG THR 15 -7.754 10.628 -3.715
111 1HG2 THR 15 1HG2 THR 15 -6.003 12.298 -4.449
112 2HG2 THR 15 2HG2 THR 15 -7.143 12.452 -5.786
113 3HG2 THR 15 3HG2 THR 15 -5.459 12.040 -6.107
114 H GLU 16 H GLU 16 -6.690 11.593 -7.884
115 HA GLU 16 HA GLU 16 -6.925 10.058 -10.235
116 1HB GLU 16 2HB GLU 16 -6.069 12.653 -9.547
117 2HB GLU 16 1HB GLU 16 -4.726 11.908 -10.401
118 1HG GLU 16 2HG GLU 16 -6.771 11.203 -12.008
119 2HG GLU 16 1HG GLU 16 -7.370 12.737 -11.378
120 H GLU 17 H GLU 17 -4.421 10.272 -7.794
121 HA GLU 17 HA GLU 17 -2.840 8.297 -9.310
122 1HB GLU 17 2HB GLU 17 -1.779 10.030 -7.079
123 2HB GLU 17 1HB GLU 17 -0.865 9.073 -8.235
124 1HG GLU 17 2HG GLU 17 -0.595 10.990 -9.324
125 2HG GLU 17 1HG GLU 17 -2.250 10.738 -9.880
126 H GLU 18 H GLU 18 -5.115 8.174 -7.146
127 HA GLU 18 HA GLU 18 -3.731 6.447 -5.228
128 1HB GLU 18 2HB GLU 18 -6.309 7.934 -5.204
129 2HB GLU 18 1HB GLU 18 -6.133 6.520 -4.182
130 1HG GLU 18 2HG GLU 18 -3.859 7.843 -3.579
131 2HG GLU 18 1HG GLU 18 -4.938 9.192 -3.930
132 H LEU 19 H LEU 19 -5.605 4.726 -4.400
133 HA LEU 19 HA LEU 19 -6.824 3.452 -6.714
134 1HB LEU 19 2HB LEU 19 -4.345 2.593 -5.616
135 2HB LEU 19 1HB LEU 19 -5.552 1.376 -5.252
136 HG LEU 19 HG LEU 19 -6.164 1.501 -7.729
137 1HD1 LEU 19 1HD1 LEU 19 -5.060 2.848 -9.082
138 2HD1 LEU 19 2HD1 LEU 19 -3.511 2.204 -8.540
139 3HD1 LEU 19 3HD1 LEU 19 -4.264 3.538 -7.673
140 1HD2 LEU 19 1HD2 LEU 19 -4.828 -0.288 -6.461
141 2HD2 LEU 19 2HD2 LEU 19 -3.415 0.428 -7.227
142 3HD2 LEU 19 3HD2 LEU 19 -4.704 -0.250 -8.216
143 H ASN 20 H ASN 20 -8.210 1.668 -6.164
144 HA ASN 20 HA ASN 20 -9.099 1.545 -3.381
145 1HB ASN 20 2HB ASN 20 -11.503 1.435 -4.465
146 2HB ASN 20 1HB ASN 20 -10.760 2.990 -4.105
147 1HD2 ASN 20 1HD2 ASN 20 -10.921 0.593 -6.717
148 2HD2 ASN 20 2HD2 ASN 20 -11.028 1.745 -7.999
149 H PHE 21 H PHE 21 -8.512 -0.515 -2.997
150 HA PHE 21 HA PHE 21 -9.645 -2.585 -4.749
151 1HB PHE 21 2HB PHE 21 -7.510 -3.925 -4.043
152 2HB PHE 21 1HB PHE 21 -7.422 -2.759 -5.355
153 HD1 PHE 21 1HD PHE 21 -6.552 -3.377 -1.839
154 HD2 PHE 21 2HD PHE 21 -6.127 -0.779 -5.180
155 HE1 PHE 21 1HE PHE 21 -4.731 -2.194 -0.680
156 HE2 PHE 21 2HE PHE 21 -4.302 0.406 -4.033
157 HZ PHE 21 HZ PHE 21 -3.603 -0.301 -1.778
158 H GLU 22 H GLU 22 -9.799 -4.731 -3.682
159 HA GLU 22 HA GLU 22 -11.275 -4.526 -1.306
160 1HB GLU 22 2HB GLU 22 -10.842 -6.448 -3.275
161 2HB GLU 22 1HB GLU 22 -10.255 -7.203 -1.801
162 1HG GLU 22 2HG GLU 22 -12.615 -6.143 -0.965
163 2HG GLU 22 1HG GLU 22 -12.982 -6.560 -2.638
164 H LYS 23 H LYS 23 -10.372 -6.860 0.116
165 HA LYS 23 HA LYS 23 -8.837 -5.740 2.101
166 1HB LYS 23 2HB LYS 23 -9.399 -7.642 3.099
167 2HB LYS 23 1HB LYS 23 -10.036 -8.219 1.574
168 1HG LYS 23 2HG LYS 23 -8.595 -9.903 2.282
169 2HG LYS 23 1HG LYS 23 -7.676 -9.023 1.064
170 1HD LYS 23 2HD LYS 23 -6.437 -9.659 3.174
171 2HD LYS 23 1HD LYS 23 -6.323 -7.972 2.704
172 1HE LYS 23 2HE LYS 23 -8.542 -8.676 4.524
173 2HE LYS 23 1HE LYS 23 -6.920 -8.814 5.196
174 1HZ LYS 23 1HZ LYS 23 -6.632 -6.464 4.189
175 2HZ LYS 23 2HZ LYS 23 -7.456 -6.642 5.654
176 3HZ LYS 23 3HZ LYS 23 -8.324 -6.422 4.219
177 H GLY 24 H GLY 24 -6.764 -5.413 2.504
178 1HA GLY 24 2HA GLY 24 -4.727 -6.782 0.921
179 2HA GLY 24 1HA GLY 24 -4.786 -5.029 0.810
180 H GLU 25 H GLU 25 -5.029 -7.380 3.483
181 HA GLU 25 HA GLU 25 -3.784 -5.781 5.384
182 1HB GLU 25 2HB GLU 25 -5.084 -8.154 5.466
183 2HB GLU 25 1HB GLU 25 -3.422 -8.693 5.661
184 1HG GLU 25 2HG GLU 25 -3.250 -7.848 7.733
185 2HG GLU 25 1HG GLU 25 -4.210 -6.421 7.347
186 H THR 26 H THR 26 -2.552 -7.605 2.811
187 HA THR 26 HA THR 26 0.165 -7.085 3.760
188 HB THR 26 HB THR 26 0.922 -9.053 2.499
189 HG1 THR 26 1HG THR 26 -0.720 -10.579 1.901
190 1HG2 THR 26 1HG2 THR 26 0.132 -9.104 4.988
191 2HG2 THR 26 2HG2 THR 26 0.529 -10.597 4.136
192 3HG2 THR 26 3HG2 THR 26 -1.156 -10.118 4.337
193 H MET 27 H MET 27 1.117 -5.650 2.586
194 HA MET 27 HA MET 27 0.782 -5.654 -0.316
195 1HB MET 27 2HB MET 27 0.503 -3.215 1.449
196 2HB MET 27 1HB MET 27 0.629 -3.171 -0.304
197 1HG MET 27 2HG MET 27 -1.425 -4.750 -0.238
198 2HG MET 27 1HG MET 27 -1.615 -4.140 1.404
199 1HE MET 27 1HE MET 27 -2.213 -1.982 -2.545
200 2HE MET 27 2HE MET 27 -3.127 -3.422 -2.099
201 3HE MET 27 3HE MET 27 -1.372 -3.502 -2.246
202 H GLU 28 H GLU 28 2.493 -4.334 -1.396
203 HA GLU 28 HA GLU 28 4.945 -4.180 0.234
204 1HB GLU 28 2HB GLU 28 4.900 -5.019 -2.654
205 2HB GLU 28 1HB GLU 28 6.242 -5.115 -1.528
206 1HG GLU 28 2HG GLU 28 5.671 -7.226 -1.176
207 2HG GLU 28 1HG GLU 28 4.238 -6.622 -0.344
208 H VAL 29 H VAL 29 5.501 -2.113 0.380
209 HA VAL 29 HA VAL 29 4.748 -0.243 -1.696
210 HB VAL 29 HB VAL 29 5.906 0.039 1.046
211 1HG1 VAL 29 1HG1 VAL 29 5.839 2.566 0.536
212 2HG1 VAL 29 2HG1 VAL 29 6.013 2.065 -1.145
213 3HG1 VAL 29 3HG1 VAL 29 7.249 1.632 0.035
214 1HG2 VAL 29 1HG2 VAL 29 3.353 0.153 -0.075
215 2HG2 VAL 29 2HG2 VAL 29 3.772 1.813 0.345
216 3HG2 VAL 29 3HG2 VAL 29 3.825 0.552 1.577
217 H ILE 30 H ILE 30 5.936 -0.013 -3.407
218 HA ILE 30 HA ILE 30 8.713 -0.761 -3.508
219 HB ILE 30 HB ILE 30 8.470 0.289 -5.885
220 1HG1 ILE 30 2HG1 ILE 30 6.103 1.172 -4.930
221 2HG1 ILE 30 1HG1 ILE 30 6.409 0.900 -6.631
222 1HG2 ILE 30 1HG2 ILE 30 7.482 -1.806 -6.709
223 2HG2 ILE 30 2HG2 ILE 30 7.013 -2.212 -5.058
224 3HG2 ILE 30 3HG2 ILE 30 8.719 -2.074 -5.481
225 1HD1 ILE 30 1HD1 ILE 30 4.252 -0.009 -5.735
226 2HD1 ILE 30 2HD1 ILE 30 5.212 -1.186 -4.842
227 3HD1 ILE 30 3HD1 ILE 30 5.266 -1.160 -6.605
228 H GLU 31 H GLU 31 6.881 2.259 -3.569
229 HA GLU 31 HA GLU 31 9.372 3.785 -3.740
230 1HB GLU 31 2HB GLU 31 7.631 4.478 -5.268
231 2HB GLU 31 1HB GLU 31 6.480 4.636 -3.947
232 1HG GLU 31 2HG GLU 31 7.405 6.786 -4.806
233 2HG GLU 31 1HG GLU 31 7.608 6.528 -3.074
234 H LYS 32 H LYS 32 10.333 4.419 -1.936
235 HA LYS 32 HA LYS 32 8.843 4.505 0.554
236 1HB LYS 32 2HB LYS 32 11.791 4.991 0.154
237 2HB LYS 32 1HB LYS 32 10.964 4.542 1.633
238 1HG LYS 32 2HG LYS 32 11.199 2.791 -0.799
239 2HG LYS 32 1HG LYS 32 12.221 2.682 0.637
240 1HD LYS 32 2HD LYS 32 10.445 1.964 1.986
241 2HD LYS 32 1HD LYS 32 9.231 2.502 0.824
242 1HE LYS 32 2HE LYS 32 9.460 0.061 0.847
243 2HE LYS 32 1HE LYS 32 9.894 0.750 -0.718
244 1HZ LYS 32 1HZ LYS 32 11.686 -0.561 -0.464
245 2HZ LYS 32 2HZ LYS 32 11.548 -0.636 1.221
246 3HZ LYS 32 3HZ LYS 32 12.268 0.708 0.490
247 HA PRO 33 HA PRO 33 8.615 8.940 0.429
248 1HB PRO 33 2HB PRO 33 8.041 9.045 3.249
249 2HB PRO 33 1HB PRO 33 6.918 9.191 1.897
250 1HG PRO 33 2HG PRO 33 6.952 7.079 3.651
251 2HG PRO 33 1HG PRO 33 6.319 6.995 1.999
252 1HD PRO 33 2HD PRO 33 8.971 6.098 3.061
253 2HD PRO 33 1HD PRO 33 7.909 5.319 1.870
254 H GLU 34 H GLU 34 11.123 7.330 1.724
255 HA GLU 34 HA GLU 34 12.269 9.094 3.571
256 1HB GLU 34 2HB GLU 34 12.996 6.692 2.244
257 2HB GLU 34 1HB GLU 34 14.310 7.834 2.011
258 1HG GLU 34 2HG GLU 34 13.422 7.914 4.733
259 2HG GLU 34 1HG GLU 34 13.772 6.254 4.258
260 H ASN 35 H ASN 35 12.809 8.786 0.064
261 HA ASN 35 HA ASN 35 14.178 11.378 0.081
262 1HB ASN 35 2HB ASN 35 13.965 9.864 -2.455
263 2HB ASN 35 1HB ASN 35 15.343 10.709 -1.760
264 1HD2 ASN 35 1HD2 ASN 35 16.475 9.643 0.004
265 2HD2 ASN 35 2HD2 ASN 35 16.545 7.917 0.036
266 H ASP 36 H ASP 36 11.376 9.717 -1.203
267 HA ASP 36 HA ASP 36 10.551 11.838 -2.932
268 1HB ASP 36 2HB ASP 36 9.484 9.218 -2.075
269 2HB ASP 36 1HB ASP 36 8.273 10.417 -2.523
270 HA PRO 37 HA PRO 37 8.260 14.750 -0.577
271 1HB PRO 37 2HB PRO 37 5.747 13.522 -1.650
272 2HB PRO 37 1HB PRO 37 6.199 15.224 -1.527
273 1HG PRO 37 2HG PRO 37 6.380 13.942 -3.852
274 2HG PRO 37 1HG PRO 37 7.608 15.126 -3.362
275 1HD PRO 37 2HD PRO 37 7.776 12.162 -3.476
276 2HD PRO 37 1HD PRO 37 9.057 13.375 -3.658
277 H GLU 38 H GLU 38 5.807 12.165 -0.545
278 HA GLU 38 HA GLU 38 6.452 11.159 2.008
279 1HB GLU 38 2HB GLU 38 5.719 13.548 2.515
280 2HB GLU 38 1HB GLU 38 4.103 13.022 2.069
281 1HG GLU 38 2HG GLU 38 5.400 11.262 3.995
282 2HG GLU 38 1HG GLU 38 5.192 12.914 4.578
283 H TRP 39 H TRP 39 5.151 10.565 -0.754
284 HA TRP 39 HA TRP 39 2.963 8.920 0.336
285 1HB TRP 39 2HB TRP 39 3.017 9.866 -2.519
286 2HB TRP 39 1HB TRP 39 1.653 9.254 -1.591
287 HD1 TRP 39 HD TRP 39 2.120 11.254 0.950
288 HE1 TRP 39 1HE TRP 39 1.423 13.717 0.682
289 HE3 TRP 39 3HE TRP 39 2.105 11.543 -4.155
290 HZ2 TRP 39 2HZ TRP 39 0.931 15.541 -1.416
291 HZ3 TRP 39 3HZ TRP 39 1.509 13.683 -5.213
292 HH2 TRP 39 HH TRP 39 0.935 15.640 -3.871
293 H TRP 40 H TRP 40 2.779 6.803 -0.428
294 HA TRP 40 HA TRP 40 4.959 5.904 -2.179
295 1HB TRP 40 2HB TRP 40 5.062 3.794 -0.860
296 2HB TRP 40 1HB TRP 40 5.593 5.216 0.022
297 HD1 TRP 40 HD TRP 40 1.867 4.417 -0.286
298 HE1 TRP 40 1HE TRP 40 0.953 3.787 2.042
299 HE3 TRP 40 3HE TRP 40 6.266 4.273 2.267
300 HZ2 TRP 40 2HZ TRP 40 2.003 3.276 4.620
301 HZ3 TRP 40 3HZ TRP 40 6.241 3.706 4.657
302 HH2 TRP 40 HH TRP 40 4.146 3.221 5.812
303 H LYS 41 H LYS 41 4.508 3.601 -3.003
304 HA LYS 41 HA LYS 41 1.689 3.107 -3.484
305 1HB LYS 41 2HB LYS 41 2.178 2.819 -5.946
306 2HB LYS 41 1HB LYS 41 2.087 4.463 -5.348
307 1HG LYS 41 2HG LYS 41 3.935 4.558 -6.671
308 2HG LYS 41 1HG LYS 41 4.664 4.213 -5.109
309 1HD LYS 41 2HD LYS 41 5.712 2.607 -6.314
310 2HD LYS 41 1HD LYS 41 4.233 1.734 -5.945
311 1HE LYS 41 2HE LYS 41 5.280 2.605 -8.501
312 2HE LYS 41 1HE LYS 41 4.075 1.371 -8.128
313 1HZ LYS 41 1HZ LYS 41 2.944 2.957 -9.378
314 2HZ LYS 41 2HZ LYS 41 3.666 4.265 -8.587
315 3HZ LYS 41 3HZ LYS 41 2.504 3.330 -7.788
316 H CYS 42 H CYS 42 1.163 1.001 -3.732
317 HA CYS 42 HA CYS 42 3.376 -0.904 -4.024
318 1HB CYS 42 2HB CYS 42 2.177 -2.378 -2.358
319 2HB CYS 42 1HB CYS 42 2.924 -0.936 -1.680
320 HG CYS 42 HG CYS 42 -0.144 -1.131 -2.166
321 H LYS 43 H LYS 43 2.797 -2.925 -4.939
322 HA LYS 43 HA LYS 43 0.473 -2.766 -6.682
323 1HB LYS 43 2HB LYS 43 2.736 -4.765 -6.597
324 2HB LYS 43 1HB LYS 43 1.466 -4.723 -7.811
325 1HG LYS 43 2HG LYS 43 2.359 -2.936 -8.888
326 2HG LYS 43 1HG LYS 43 3.051 -2.253 -7.416
327 1HD LYS 43 2HD LYS 43 5.003 -3.323 -7.703
328 2HD LYS 43 1HD LYS 43 4.210 -4.830 -8.170
329 1HE LYS 43 2HE LYS 43 5.567 -3.949 -9.994
330 2HE LYS 43 1HE LYS 43 3.856 -3.954 -10.421
331 1HZ LYS 43 1HZ LYS 43 3.757 -1.706 -10.440
332 2HZ LYS 43 2HZ LYS 43 5.397 -1.865 -10.820
333 3HZ LYS 43 3HZ LYS 43 4.928 -1.512 -9.234
334 H ASN 44 H ASN 44 -1.208 -4.127 -6.676
335 HA ASN 44 HA ASN 44 -1.424 -6.000 -4.421
336 1HB ASN 44 2HB ASN 44 -2.933 -3.830 -4.685
337 2HB ASN 44 1HB ASN 44 -3.827 -4.857 -5.793
338 1HD2 ASN 44 1HD2 ASN 44 -2.209 -5.423 -2.685
339 2HD2 ASN 44 2HD2 ASN 44 -3.586 -6.110 -1.901
340 H ALA 45 H ALA 45 -3.264 -7.633 -4.906
341 HA ALA 45 HA ALA 45 -2.431 -9.097 -7.205
342 1HB ALA 45 1HB ALA 45 -3.024 -10.437 -5.383
343 2HB ALA 45 2HB ALA 45 -4.384 -10.610 -6.492
344 3HB ALA 45 3HB ALA 45 -4.516 -9.542 -5.095
345 H ARG 46 H ARG 46 -4.348 -6.473 -6.912
346 HA ARG 46 HA ARG 46 -6.426 -7.183 -8.773
347 1HB ARG 46 2HB ARG 46 -7.283 -5.676 -7.299
348 2HB ARG 46 1HB ARG 46 -5.736 -4.886 -7.042
349 1HG ARG 46 2HG ARG 46 -6.056 -3.412 -8.684
350 2HG ARG 46 1HG ARG 46 -7.008 -4.511 -9.679
351 1HD ARG 46 2HD ARG 46 -8.050 -3.378 -7.102
352 2HD ARG 46 1HD ARG 46 -8.219 -2.519 -8.631
353 HE ARG 46 HE ARG 46 -9.161 -5.197 -8.827
354 1HH1 ARG 46 1HH1 ARG 46 -10.016 -2.027 -7.646
355 2HH1 ARG 46 2HH1 ARG 46 -11.720 -2.302 -7.768
356 1HH2 ARG 46 1HH2 ARG 46 -11.406 -5.565 -8.989
357 2HH2 ARG 46 2HH2 ARG 46 -12.511 -4.312 -8.531
358 H GLY 47 H GLY 47 -3.196 -6.371 -9.041
359 1HA GLY 47 2HA GLY 47 -1.978 -6.175 -11.007
360 2HA GLY 47 1HA GLY 47 -3.478 -5.952 -11.887
361 H GLN 48 H GLN 48 -3.952 -3.770 -9.641
362 HA GLN 48 HA GLN 48 -2.417 -1.690 -11.042
363 1HB GLN 48 2HB GLN 48 -5.269 -1.809 -10.205
364 2HB GLN 48 1HB GLN 48 -4.455 -0.263 -10.073
365 1HG GLN 48 2HG GLN 48 -5.690 -0.609 -12.202
366 2HG GLN 48 1HG GLN 48 -3.983 -0.209 -12.396
367 1HE2 GLN 48 1HE2 GLN 48 -2.679 -1.594 -13.453
368 2HE2 GLN 48 2HE2 GLN 48 -3.184 -3.113 -14.103
369 H VAL 49 H VAL 49 -1.332 -0.215 -9.863
370 HA VAL 49 HA VAL 49 -1.634 -0.363 -6.942
371 HB VAL 49 HB VAL 49 0.457 -1.238 -7.009
372 1HG1 VAL 49 1HG1 VAL 49 0.920 0.239 -9.569
373 2HG1 VAL 49 2HG1 VAL 49 0.711 -1.498 -9.336
374 3HG1 VAL 49 3HG1 VAL 49 2.162 -0.695 -8.736
375 1HG2 VAL 49 1HG2 VAL 49 1.300 1.612 -7.433
376 2HG2 VAL 49 2HG2 VAL 49 2.082 0.379 -6.443
377 3HG2 VAL 49 3HG2 VAL 49 0.528 1.051 -5.950
378 H GLY 50 H GLY 50 -2.117 1.464 -6.010
379 1HA GLY 50 2HA GLY 50 -1.767 3.947 -7.558
380 2HA GLY 50 1HA GLY 50 -3.026 3.679 -6.364
381 H LEU 51 H LEU 51 -2.568 5.305 -5.010
382 HA LEU 51 HA LEU 51 0.059 5.199 -3.685
383 1HB LEU 51 2HB LEU 51 -1.499 7.439 -4.740
384 2HB LEU 51 1HB LEU 51 -0.979 7.680 -3.086
385 HG LEU 51 HG LEU 51 1.283 7.710 -3.655
386 1HD1 LEU 51 1HD1 LEU 51 2.210 6.292 -5.072
387 2HD1 LEU 51 2HD1 LEU 51 1.374 7.044 -6.428
388 3HD1 LEU 51 3HD1 LEU 51 0.609 5.731 -5.545
389 1HD2 LEU 51 1HD2 LEU 51 1.452 9.463 -5.136
390 2HD2 LEU 51 2HD2 LEU 51 -0.247 9.547 -4.667
391 3HD2 LEU 51 3HD2 LEU 51 0.207 8.817 -6.207
392 H VAL 52 H VAL 52 -0.178 4.201 -1.824
393 HA VAL 52 HA VAL 52 -2.705 4.329 -0.397
394 HB VAL 52 HB VAL 52 -1.908 2.127 -0.479
395 1HG1 VAL 52 1HG1 VAL 52 0.222 1.584 -0.746
396 2HG1 VAL 52 2HG1 VAL 52 0.658 2.291 0.806
397 3HG1 VAL 52 3HG1 VAL 52 0.624 3.289 -0.641
398 1HG2 VAL 52 1HG2 VAL 52 -2.316 3.317 1.941
399 2HG2 VAL 52 2HG2 VAL 52 -0.747 2.553 2.178
400 3HG2 VAL 52 3HG2 VAL 52 -2.134 1.583 1.688
401 HA PRO 53 HA PRO 53 -1.234 7.420 2.468
402 1HB PRO 53 2HB PRO 53 -3.301 7.371 4.144
403 2HB PRO 53 1HB PRO 53 -3.528 7.934 2.477
404 1HG PRO 53 2HG PRO 53 -3.931 5.157 3.563
405 2HG PRO 53 1HG PRO 53 -5.140 6.179 2.742
406 1HD PRO 53 2HD PRO 53 -3.784 4.366 1.372
407 2HD PRO 53 1HD PRO 53 -4.021 5.987 0.679
408 H LYS 54 H LYS 54 0.502 6.646 3.584
409 HA LYS 54 HA LYS 54 0.802 4.361 5.053
410 1HB LYS 54 2HB LYS 54 2.591 5.522 6.221
411 2HB LYS 54 1HB LYS 54 2.590 5.903 4.497
412 1HG LYS 54 2HG LYS 54 2.520 8.035 5.015
413 2HG LYS 54 1HG LYS 54 0.904 7.785 5.685
414 1HD LYS 54 2HD LYS 54 1.971 7.160 7.844
415 2HD LYS 54 1HD LYS 54 3.537 7.610 7.162
416 1HE LYS 54 2HE LYS 54 3.173 9.747 7.651
417 2HE LYS 54 1HE LYS 54 1.674 9.734 6.725
418 1HZ LYS 54 1HZ LYS 54 1.727 10.216 9.307
419 2HZ LYS 54 2HZ LYS 54 1.610 8.530 9.383
420 3HZ LYS 54 3HZ LYS 54 0.425 9.423 8.572
421 H ASN 55 H ASN 55 -0.918 7.217 5.896
422 HA ASN 55 HA ASN 55 -0.956 6.920 8.712
423 1HB ASN 55 2HB ASN 55 -1.501 9.024 7.480
424 2HB ASN 55 1HB ASN 55 -3.005 8.271 6.956
425 1HD2 ASN 55 1HD2 ASN 55 -1.521 10.123 9.311
426 2HD2 ASN 55 2HD2 ASN 55 -2.760 10.057 10.514
427 H TYR 56 H TYR 56 -2.391 5.158 6.257
428 HA TYR 56 HA TYR 56 -4.449 4.102 8.072
429 1HB TYR 56 2HB TYR 56 -4.372 4.349 5.070
430 2HB TYR 56 1HB TYR 56 -5.523 3.315 5.900
431 HD1 TYR 56 1HD TYR 56 -6.377 5.492 4.095
432 HD2 TYR 56 2HD TYR 56 -5.537 5.550 8.263
433 HE1 TYR 56 1HE TYR 56 -7.941 7.359 4.386
434 HE2 TYR 56 2HE TYR 56 -7.095 7.413 8.567
435 HH TYR 56 HH TYR 56 -9.382 8.223 6.719
436 H VAL 57 H VAL 57 -1.468 3.431 7.370
437 HA VAL 57 HA VAL 57 -1.919 0.556 7.437
438 HB VAL 57 HB VAL 57 -0.937 -0.031 5.481
439 1HG1 VAL 57 1HG1 VAL 57 -1.547 2.816 4.708
440 2HG1 VAL 57 2HG1 VAL 57 -2.771 1.562 4.909
441 3HG1 VAL 57 3HG1 VAL 57 -1.537 1.396 3.664
442 1HG2 VAL 57 1HG2 VAL 57 1.265 0.634 5.768
443 2HG2 VAL 57 2HG2 VAL 57 0.838 2.340 5.898
444 3HG2 VAL 57 3HG2 VAL 57 0.776 1.534 4.331
445 H VAL 58 H VAL 58 0.274 -0.594 7.478
446 HA VAL 58 HA VAL 58 2.319 0.880 8.957
447 HB VAL 58 HB VAL 58 0.889 -0.173 10.676
448 1HG1 VAL 58 1HG1 VAL 58 1.733 -2.897 9.855
449 2HG1 VAL 58 2HG1 VAL 58 0.408 -2.145 8.965
450 3HG1 VAL 58 3HG1 VAL 58 0.285 -2.368 10.710
451 1HG2 VAL 58 1HG2 VAL 58 2.629 -0.954 11.974
452 2HG2 VAL 58 2HG2 VAL 58 3.491 -0.033 10.741
453 3HG2 VAL 58 3HG2 VAL 58 3.400 -1.791 10.626
454 H VAL 59 H VAL 59 4.170 0.526 7.875
455 HA VAL 59 HA VAL 59 4.386 -1.440 5.874
456 HB VAL 59 HB VAL 59 6.834 -0.208 7.088
457 1HG1 VAL 59 1HG1 VAL 59 5.964 -1.058 4.335
458 2HG1 VAL 59 2HG1 VAL 59 7.283 -1.703 5.311
459 3HG1 VAL 59 3HG1 VAL 59 7.408 -0.087 4.620
460 1HG2 VAL 59 1HG2 VAL 59 5.646 1.757 6.963
461 2HG2 VAL 59 2HG2 VAL 59 4.618 1.179 5.653
462 3HG2 VAL 59 3HG2 VAL 59 6.280 1.664 5.321
463 H LEU 60 H LEU 60 5.552 -3.329 5.748
464 HA LEU 60 HA LEU 60 6.622 -4.452 8.213
465 1HB LEU 60 2HB LEU 60 4.674 -5.560 8.444
466 2HB LEU 60 1HB LEU 60 4.212 -5.285 6.779
467 HG LEU 60 HG LEU 60 6.333 -7.227 6.887
468 1HD1 LEU 60 1HD1 LEU 60 4.881 -9.011 7.970
469 2HD1 LEU 60 2HD1 LEU 60 3.986 -7.678 8.697
470 3HD1 LEU 60 3HD1 LEU 60 5.702 -7.881 9.047
471 1HD2 LEU 60 1HD2 LEU 60 3.467 -7.693 6.141
472 2HD2 LEU 60 2HD2 LEU 60 4.916 -8.449 5.480
473 3HD2 LEU 60 3HD2 LEU 60 4.557 -6.761 5.116
474 H SER 61 H SER 61 8.699 -4.547 7.547
475 HA SER 61 HA SER 61 9.270 -6.073 5.097
476 1HB SER 61 2HB SER 61 11.452 -4.783 5.061
477 2HB SER 61 1HB SER 61 10.007 -3.826 4.734
478 HG SER 61 HG SER 61 11.626 -3.880 7.030
Start of MODEL 5
1 1H GLY 1 1HT GLY 1 13.896 -11.271 1.852
2 2H GLY 1 2HT GLY 1 13.986 -9.966 2.925
3 3H GLY 1 3HT GLY 1 15.247 -11.091 2.854
4 1HA GLY 1 1HA GLY 1 16.041 -9.241 1.685
5 2HA GLY 1 2HA GLY 1 15.580 -10.425 0.471
6 H SER 2 H SER 2 12.679 -9.849 1.107
7 HA SER 2 HA SER 2 12.486 -7.459 -0.585
8 1HB SER 2 2HB SER 2 11.092 -9.981 -0.535
9 2HB SER 2 1HB SER 2 9.934 -8.659 -0.332
10 HG SER 2 HG SER 2 10.188 -8.922 -2.502
11 H HIS 3 H HIS 3 11.626 -5.620 0.156
12 HA HIS 3 HA HIS 3 10.772 -5.497 2.917
13 1HB HIS 3 2HB HIS 3 10.267 -3.006 2.078
14 2HB HIS 3 1HB HIS 3 11.880 -3.540 2.527
15 HD1 HIS 3 1HD HIS 3 9.868 -3.692 -0.711
16 HD2 HIS 3 2HD HIS 3 13.630 -2.618 0.692
17 HE1 HIS 3 1HE HIS 3 11.149 -2.931 -2.738
18 HE2 HIS 3 2HE HIS 3 13.390 -2.196 -1.850
19 H VAL 4 H VAL 4 8.726 -5.532 3.620
20 HA VAL 4 HA VAL 4 6.610 -5.182 1.604
21 HB VAL 4 HB VAL 4 5.825 -7.020 3.701
22 1HG1 VAL 4 1HG1 VAL 4 6.055 -7.855 0.867
23 2HG1 VAL 4 2HG1 VAL 4 5.016 -6.470 1.207
24 3HG1 VAL 4 3HG1 VAL 4 4.704 -8.020 1.990
25 1HG2 VAL 4 1HG2 VAL 4 7.193 -8.916 2.997
26 2HG2 VAL 4 2HG2 VAL 4 8.182 -7.635 3.700
27 3HG2 VAL 4 3HG2 VAL 4 8.131 -7.851 1.950
28 H VAL 5 H VAL 5 4.439 -4.872 2.642
29 HA VAL 5 HA VAL 5 4.652 -3.408 5.158
30 HB VAL 5 HB VAL 5 4.527 -1.499 4.036
31 1HG1 VAL 5 1HG1 VAL 5 4.789 -1.461 1.869
32 2HG1 VAL 5 2HG1 VAL 5 3.121 -1.967 1.606
33 3HG1 VAL 5 3HG1 VAL 5 4.387 -3.170 1.812
34 1HG2 VAL 5 1HG2 VAL 5 2.183 -0.860 3.209
35 2HG2 VAL 5 2HG2 VAL 5 2.414 -1.213 4.921
36 3HG2 VAL 5 3HG2 VAL 5 1.693 -2.421 3.857
37 H GLN 6 H GLN 6 2.591 -3.022 6.214
38 HA GLN 6 HA GLN 6 0.642 -5.142 5.579
39 1HB GLN 6 2HB GLN 6 2.284 -5.189 7.737
40 2HB GLN 6 1HB GLN 6 0.912 -4.314 8.402
41 1HG GLN 6 2HG GLN 6 -0.533 -6.099 8.136
42 2HG GLN 6 1HG GLN 6 0.489 -6.873 6.926
43 1HE2 GLN 6 1HE2 GLN 6 0.319 -8.810 8.146
44 2HE2 GLN 6 2HE2 GLN 6 1.276 -9.049 9.564
45 H THR 7 H THR 7 -1.516 -4.638 5.734
46 HA THR 7 HA THR 7 -2.100 -1.807 6.313
47 HB THR 7 HB THR 7 -4.301 -2.647 4.989
48 HG1 THR 7 1HG THR 7 -3.828 -4.135 3.529
49 1HG2 THR 7 1HG2 THR 7 -2.405 -0.798 4.509
50 2HG2 THR 7 2HG2 THR 7 -3.713 -1.188 3.391
51 3HG2 THR 7 3HG2 THR 7 -2.117 -1.906 3.167
52 H LEU 8 H LEU 8 -4.062 -1.280 7.324
53 HA LEU 8 HA LEU 8 -5.343 -3.455 8.804
54 1HB LEU 8 2HB LEU 8 -5.482 -1.337 10.531
55 2HB LEU 8 1HB LEU 8 -4.420 -2.712 10.683
56 HG LEU 8 HG LEU 8 -3.214 -0.642 11.043
57 1HD1 LEU 8 1HD1 LEU 8 -2.128 -1.351 8.412
58 2HD1 LEU 8 2HD1 LEU 8 -2.368 -2.699 9.523
59 3HD1 LEU 8 3HD1 LEU 8 -1.358 -1.333 9.997
60 1HD2 LEU 8 1HD2 LEU 8 -4.815 0.598 9.413
61 2HD2 LEU 8 2HD2 LEU 8 -3.605 0.164 8.211
62 3HD2 LEU 8 3HD2 LEU 8 -3.148 1.140 9.604
63 H TYR 9 H TYR 9 -5.540 -0.131 7.623
64 HA TYR 9 HA TYR 9 -8.450 -0.183 7.943
65 1HB TYR 9 2HB TYR 9 -6.483 1.844 8.254
66 2HB TYR 9 1HB TYR 9 -7.525 2.320 6.918
67 HD1 TYR 9 1HD TYR 9 -8.954 3.962 7.706
68 HD2 TYR 9 2HD TYR 9 -8.280 0.507 10.094
69 HE1 TYR 9 1HE TYR 9 -10.654 4.742 9.302
70 HE2 TYR 9 2HE TYR 9 -9.980 1.275 11.696
71 HH TYR 9 HH TYR 9 -11.076 3.299 12.386
72 HA PRO 10 HA PRO 10 -9.575 -0.651 3.726
73 1HB PRO 10 2HB PRO 10 -10.901 2.012 3.828
74 2HB PRO 10 1HB PRO 10 -11.562 0.441 3.363
75 1HG PRO 10 2HG PRO 10 -12.169 1.515 5.717
76 2HG PRO 10 1HG PRO 10 -11.874 -0.228 5.564
77 1HD PRO 10 2HD PRO 10 -10.095 1.909 6.662
78 2HD PRO 10 1HD PRO 10 -10.329 0.238 7.217
79 H PHE 11 H PHE 11 -9.795 0.744 1.593
80 HA PHE 11 HA PHE 11 -7.349 2.377 1.354
81 1HB PHE 11 2HB PHE 11 -7.148 1.532 -0.942
82 2HB PHE 11 1HB PHE 11 -7.153 0.205 0.219
83 HD1 PHE 11 1HD PHE 11 -9.347 -1.027 0.602
84 HD2 PHE 11 2HD PHE 11 -8.681 1.579 -2.696
85 HE1 PHE 11 1HE PHE 11 -11.221 -2.075 -0.599
86 HE2 PHE 11 2HE PHE 11 -10.555 0.536 -3.903
87 HZ PHE 11 HZ PHE 11 -11.826 -1.294 -2.854
88 H SER 12 H SER 12 -7.545 4.377 0.484
89 HA SER 12 HA SER 12 -10.058 5.033 -0.903
90 1HB SER 12 2HB SER 12 -10.183 5.921 1.374
91 2HB SER 12 1HB SER 12 -8.645 6.752 1.149
92 HG SER 12 HG SER 12 -9.590 8.204 -0.114
93 H SER 13 H SER 13 -9.646 5.664 -2.920
94 HA SER 13 HA SER 13 -7.017 6.737 -3.590
95 1HB SER 13 2HB SER 13 -8.684 5.005 -4.924
96 2HB SER 13 1HB SER 13 -8.987 6.527 -5.757
97 HG SER 13 HG SER 13 -7.270 5.722 -6.794
98 H VAL 14 H VAL 14 -6.650 8.815 -4.346
99 HA VAL 14 HA VAL 14 -8.947 10.568 -4.730
100 HB VAL 14 HB VAL 14 -8.004 12.291 -3.258
101 1HG1 VAL 14 1HG1 VAL 14 -8.875 11.411 -1.270
102 2HG1 VAL 14 2HG1 VAL 14 -8.366 9.771 -1.673
103 3HG1 VAL 14 3HG1 VAL 14 -9.702 10.521 -2.549
104 1HG2 VAL 14 1HG2 VAL 14 -6.072 12.101 -2.102
105 2HG2 VAL 14 2HG2 VAL 14 -5.669 10.964 -3.387
106 3HG2 VAL 14 3HG2 VAL 14 -6.275 10.368 -1.843
107 H THR 15 H THR 15 -5.476 10.038 -5.110
108 HA THR 15 HA THR 15 -5.134 12.466 -6.643
109 HB THR 15 HB THR 15 -3.183 10.187 -6.293
110 HG1 THR 15 1HG THR 15 -2.976 10.855 -4.333
111 1HG2 THR 15 1HG2 THR 15 -2.942 12.960 -7.337
112 2HG2 THR 15 2HG2 THR 15 -2.182 11.470 -7.894
113 3HG2 THR 15 3HG2 THR 15 -1.599 12.262 -6.432
114 H GLU 16 H GLU 16 -4.152 12.421 -8.818
115 HA GLU 16 HA GLU 16 -5.782 11.039 -10.644
116 1HB GLU 16 2HB GLU 16 -3.963 13.143 -10.752
117 2HB GLU 16 1HB GLU 16 -3.245 11.909 -11.778
118 1HG GLU 16 2HG GLU 16 -5.618 11.771 -12.823
119 2HG GLU 16 1HG GLU 16 -5.829 13.362 -12.094
120 H GLU 17 H GLU 17 -2.538 10.395 -9.436
121 HA GLU 17 HA GLU 17 -2.370 7.985 -11.092
122 1HB GLU 17 2HB GLU 17 -0.028 7.902 -10.473
123 2HB GLU 17 1HB GLU 17 -0.420 9.515 -11.049
124 1HG GLU 17 2HG GLU 17 -0.686 10.174 -8.624
125 2HG GLU 17 1HG GLU 17 0.043 8.620 -8.223
126 H GLU 18 H GLU 18 -4.220 8.175 -8.898
127 HA GLU 18 HA GLU 18 -3.071 6.381 -6.898
128 1HB GLU 18 2HB GLU 18 -4.463 8.566 -6.450
129 2HB GLU 18 1HB GLU 18 -5.829 7.492 -6.682
130 1HG GLU 18 2HG GLU 18 -5.638 6.784 -4.604
131 2HG GLU 18 1HG GLU 18 -4.009 6.219 -4.929
132 H LEU 19 H LEU 19 -4.866 4.802 -6.005
133 HA LEU 19 HA LEU 19 -6.438 3.686 -8.193
134 1HB LEU 19 2HB LEU 19 -4.041 2.458 -7.022
135 2HB LEU 19 1HB LEU 19 -5.431 1.397 -7.133
136 HG LEU 19 HG LEU 19 -5.545 2.267 -9.584
137 1HD1 LEU 19 1HD1 LEU 19 -3.796 3.330 -10.456
138 2HD1 LEU 19 2HD1 LEU 19 -2.631 2.391 -9.524
139 3HD1 LEU 19 3HD1 LEU 19 -3.447 3.766 -8.786
140 1HD2 LEU 19 1HD2 LEU 19 -4.945 -0.056 -8.601
141 2HD2 LEU 19 2HD2 LEU 19 -3.288 0.397 -8.990
142 3HD2 LEU 19 3HD2 LEU 19 -4.497 0.305 -10.268
143 H ASN 20 H ASN 20 -7.822 1.915 -7.507
144 HA ASN 20 HA ASN 20 -8.505 1.976 -4.652
145 1HB ASN 20 2HB ASN 20 -10.950 1.956 -5.351
146 2HB ASN 20 1HB ASN 20 -10.106 3.487 -5.567
147 1HD2 ASN 20 1HD2 ASN 20 -12.368 1.771 -6.928
148 2HD2 ASN 20 2HD2 ASN 20 -12.062 2.046 -8.605
149 H PHE 21 H PHE 21 -7.874 -0.037 -4.197
150 HA PHE 21 HA PHE 21 -9.281 -2.216 -5.571
151 1HB PHE 21 2HB PHE 21 -6.952 -3.471 -4.982
152 2HB PHE 21 1HB PHE 21 -7.317 -2.767 -6.551
153 HD1 PHE 21 1HD PHE 21 -6.282 -1.198 -3.333
154 HD2 PHE 21 2HD PHE 21 -5.349 -1.941 -7.418
155 HE1 PHE 21 1HE PHE 21 -4.294 0.236 -3.134
156 HE2 PHE 21 2HE PHE 21 -3.357 -0.510 -7.225
157 HZ PHE 21 HZ PHE 21 -2.828 0.581 -5.082
158 H GLU 22 H GLU 22 -9.479 -4.184 -4.294
159 HA GLU 22 HA GLU 22 -10.164 -3.636 -1.608
160 1HB GLU 22 2HB GLU 22 -9.882 -6.170 -3.187
161 2HB GLU 22 1HB GLU 22 -10.258 -6.210 -1.472
162 1HG GLU 22 2HG GLU 22 -12.380 -6.157 -2.164
163 2HG GLU 22 1HG GLU 22 -12.089 -4.428 -2.353
164 H LYS 23 H LYS 23 -8.537 -2.928 -0.373
165 HA LYS 23 HA LYS 23 -5.925 -4.078 -0.371
166 1HB LYS 23 2HB LYS 23 -7.119 -1.739 0.636
167 2HB LYS 23 1HB LYS 23 -6.491 -2.596 2.036
168 1HG LYS 23 2HG LYS 23 -4.957 -1.712 -0.395
169 2HG LYS 23 1HG LYS 23 -4.820 -1.084 1.247
170 1HD LYS 23 2HD LYS 23 -3.203 -2.566 1.619
171 2HD LYS 23 1HD LYS 23 -4.395 -3.855 1.449
172 1HE LYS 23 2HE LYS 23 -3.721 -3.041 -1.160
173 2HE LYS 23 1HE LYS 23 -2.206 -3.165 -0.269
174 1HZ LYS 23 1HZ LYS 23 -2.523 -5.290 -1.072
175 2HZ LYS 23 2HZ LYS 23 -4.195 -5.263 -0.830
176 3HZ LYS 23 3HZ LYS 23 -3.153 -5.414 0.494
177 H GLY 24 H GLY 24 -5.073 -5.626 0.882
178 1HA GLY 24 2HA GLY 24 -6.897 -7.041 2.685
179 2HA GLY 24 1HA GLY 24 -5.397 -7.678 2.024
180 H GLU 25 H GLU 25 -4.590 -8.297 4.029
181 HA GLU 25 HA GLU 25 -4.188 -6.237 6.032
182 1HB GLU 25 2HB GLU 25 -4.835 -8.897 6.243
183 2HB GLU 25 1HB GLU 25 -3.114 -8.895 6.610
184 1HG GLU 25 2HG GLU 25 -3.377 -7.629 8.497
185 2HG GLU 25 1HG GLU 25 -4.879 -6.906 7.926
186 H THR 26 H THR 26 -2.534 -7.780 3.536
187 HA THR 26 HA THR 26 -0.004 -6.613 4.465
188 HB THR 26 HB THR 26 0.931 -8.678 3.035
189 HG1 THR 26 1HG THR 26 -1.387 -9.692 4.313
190 1HG2 THR 26 1HG2 THR 26 0.230 -8.601 5.944
191 2HG2 THR 26 2HG2 THR 26 1.801 -8.367 5.176
192 3HG2 THR 26 3HG2 THR 26 1.069 -9.972 5.217
193 H MET 27 H MET 27 1.068 -5.439 3.053
194 HA MET 27 HA MET 27 0.546 -5.708 0.190
195 1HB MET 27 2HB MET 27 -0.915 -3.897 1.063
196 2HB MET 27 1HB MET 27 0.516 -3.050 1.634
197 1HG MET 27 2HG MET 27 -0.321 -2.157 -0.483
198 2HG MET 27 1HG MET 27 1.313 -2.800 -0.621
199 1HE MET 27 1HE MET 27 -2.374 -3.589 -2.788
200 2HE MET 27 2HE MET 27 -1.056 -2.760 -3.618
201 3HE MET 27 3HE MET 27 -1.618 -2.176 -2.051
202 H GLU 28 H GLU 28 2.226 -4.495 -1.099
203 HA GLU 28 HA GLU 28 4.781 -4.366 0.389
204 1HB GLU 28 2HB GLU 28 5.825 -5.102 -1.824
205 2HB GLU 28 1HB GLU 28 4.946 -6.325 -0.918
206 1HG GLU 28 2HG GLU 28 2.964 -5.823 -2.385
207 2HG GLU 28 1HG GLU 28 4.053 -4.856 -3.378
208 H VAL 29 H VAL 29 5.599 -2.392 0.378
209 HA VAL 29 HA VAL 29 4.725 -0.470 -1.627
210 HB VAL 29 HB VAL 29 6.052 -0.194 1.054
211 1HG1 VAL 29 1HG1 VAL 29 7.181 1.378 -0.512
212 2HG1 VAL 29 2HG1 VAL 29 6.254 2.189 0.748
213 3HG1 VAL 29 3HG1 VAL 29 5.605 2.073 -0.887
214 1HG2 VAL 29 1HG2 VAL 29 3.684 1.326 0.115
215 2HG2 VAL 29 2HG2 VAL 29 4.101 0.768 1.734
216 3HG2 VAL 29 3HG2 VAL 29 3.501 -0.375 0.534
217 H ILE 30 H ILE 30 5.997 0.509 -3.063
218 HA ILE 30 HA ILE 30 8.681 -0.587 -3.454
219 HB ILE 30 HB ILE 30 8.392 0.893 -5.645
220 1HG1 ILE 30 2HG1 ILE 30 6.058 1.577 -4.615
221 2HG1 ILE 30 1HG1 ILE 30 6.236 1.328 -6.340
222 1HG2 ILE 30 1HG2 ILE 30 8.804 -1.308 -6.045
223 2HG2 ILE 30 2HG2 ILE 30 7.130 -1.212 -6.593
224 3HG2 ILE 30 3HG2 ILE 30 7.499 -1.860 -4.994
225 1HD1 ILE 30 1HD1 ILE 30 5.110 -0.635 -4.368
226 2HD1 ILE 30 2HD1 ILE 30 5.335 -0.935 -6.091
227 3HD1 ILE 30 3HD1 ILE 30 4.209 0.307 -5.553
228 H GLU 31 H GLU 31 6.995 2.521 -3.216
229 HA GLU 31 HA GLU 31 9.596 3.848 -2.834
230 1HB GLU 31 2HB GLU 31 8.022 4.586 -4.724
231 2HB GLU 31 1HB GLU 31 7.001 5.246 -3.454
232 1HG GLU 31 2HG GLU 31 8.406 6.972 -4.383
233 2HG GLU 31 1HG GLU 31 8.850 6.661 -2.706
234 H LYS 32 H LYS 32 10.079 4.396 -0.811
235 HA LYS 32 HA LYS 32 7.928 4.530 1.158
236 1HB LYS 32 2HB LYS 32 10.897 4.120 1.355
237 2HB LYS 32 1HB LYS 32 9.930 4.516 2.765
238 1HG LYS 32 2HG LYS 32 10.257 2.134 2.639
239 2HG LYS 32 1HG LYS 32 8.557 2.517 2.364
240 1HD LYS 32 2HD LYS 32 8.883 2.292 -0.042
241 2HD LYS 32 1HD LYS 32 10.594 1.950 0.210
242 1HE LYS 32 2HE LYS 32 9.220 0.147 1.846
243 2HE LYS 32 1HE LYS 32 8.323 0.180 0.327
244 1HZ LYS 32 1HZ LYS 32 10.920 0.070 -0.465
245 2HZ LYS 32 2HZ LYS 32 9.859 -1.244 -0.393
246 3HZ LYS 32 3HZ LYS 32 10.906 -0.931 0.899
247 HA PRO 33 HA PRO 33 8.595 8.921 1.446
248 1HB PRO 33 2HB PRO 33 6.688 9.396 3.331
249 2HB PRO 33 1HB PRO 33 6.324 9.076 1.635
250 1HG PRO 33 2HG PRO 33 5.836 7.402 3.965
251 2HG PRO 33 1HG PRO 33 5.221 7.224 2.317
252 1HD PRO 33 2HD PRO 33 7.431 5.840 3.612
253 2HD PRO 33 1HD PRO 33 6.648 5.493 2.058
254 H GLU 34 H GLU 34 9.972 6.865 3.408
255 HA GLU 34 HA GLU 34 10.193 8.381 5.843
256 1HB GLU 34 2HB GLU 34 11.872 6.690 6.476
257 2HB GLU 34 1HB GLU 34 10.374 5.957 5.920
258 1HG GLU 34 2HG GLU 34 11.340 5.370 3.832
259 2HG GLU 34 1HG GLU 34 12.782 6.330 4.162
260 H ASN 35 H ASN 35 12.115 7.898 2.934
261 HA ASN 35 HA ASN 35 14.181 9.702 3.954
262 1HB ASN 35 2HB ASN 35 15.460 9.024 1.953
263 2HB ASN 35 1HB ASN 35 14.964 7.636 2.916
264 1HD2 ASN 35 1HD2 ASN 35 13.537 6.174 2.082
265 2HD2 ASN 35 2HD2 ASN 35 13.016 6.191 0.436
266 H ASP 36 H ASP 36 11.922 9.358 1.248
267 HA ASP 36 HA ASP 36 12.221 12.244 0.737
268 1HB ASP 36 2HB ASP 36 13.188 10.774 -1.064
269 2HB ASP 36 1HB ASP 36 11.562 10.160 -1.349
270 HA PRO 37 HA PRO 37 7.871 11.802 2.025
271 1HB PRO 37 2HB PRO 37 8.037 14.754 1.902
272 2HB PRO 37 1HB PRO 37 7.512 13.710 3.227
273 1HG PRO 37 2HG PRO 37 9.858 14.988 3.320
274 2HG PRO 37 1HG PRO 37 9.672 13.351 3.978
275 1HD PRO 37 2HD PRO 37 10.890 14.228 1.386
276 2HD PRO 37 1HD PRO 37 11.434 12.974 2.519
277 H GLU 38 H GLU 38 7.574 11.000 -0.228
278 HA GLU 38 HA GLU 38 6.403 13.097 -1.933
279 1HB GLU 38 2HB GLU 38 8.378 12.191 -2.997
280 2HB GLU 38 1HB GLU 38 7.802 10.549 -2.758
281 1HG GLU 38 2HG GLU 38 7.406 11.049 -5.014
282 2HG GLU 38 1HG GLU 38 5.837 11.160 -4.220
283 H TRP 39 H TRP 39 6.206 9.575 -2.278
284 HA TRP 39 HA TRP 39 3.464 9.550 -1.345
285 1HB TRP 39 2HB TRP 39 4.212 9.417 -4.218
286 2HB TRP 39 1HB TRP 39 2.948 8.323 -3.664
287 HD1 TRP 39 HD TRP 39 1.242 10.042 -1.788
288 HE1 TRP 39 1HE TRP 39 -0.040 12.109 -2.628
289 HE3 TRP 39 3HE TRP 39 3.959 11.028 -6.007
290 HZ2 TRP 39 2HZ TRP 39 0.084 13.920 -4.790
291 HZ3 TRP 39 3HZ TRP 39 3.312 12.946 -7.405
292 HH2 TRP 39 HH TRP 39 1.413 14.361 -6.808
293 H TRP 40 H TRP 40 2.536 7.354 -1.303
294 HA TRP 40 HA TRP 40 4.593 5.261 -1.260
295 1HB TRP 40 2HB TRP 40 4.339 5.678 0.991
296 2HB TRP 40 1HB TRP 40 2.677 6.201 0.827
297 HD1 TRP 40 HD TRP 40 1.799 3.201 -0.467
298 HE1 TRP 40 1HE TRP 40 1.465 1.338 1.259
299 HE3 TRP 40 3HE TRP 40 4.477 5.189 3.399
300 HZ2 TRP 40 2HZ TRP 40 2.211 0.791 3.897
301 HZ3 TRP 40 3HZ TRP 40 4.614 3.921 5.499
302 HH2 TRP 40 HH TRP 40 3.502 1.762 5.736
303 H LYS 41 H LYS 41 4.108 4.044 -2.925
304 HA LYS 41 HA LYS 41 1.314 3.290 -3.386
305 1HB LYS 41 2HB LYS 41 1.983 3.063 -5.822
306 2HB LYS 41 1HB LYS 41 1.776 4.681 -5.189
307 1HG LYS 41 2HG LYS 41 3.696 4.876 -6.392
308 2HG LYS 41 1HG LYS 41 4.333 4.565 -4.786
309 1HD LYS 41 2HD LYS 41 5.565 3.082 -6.020
310 2HD LYS 41 1HD LYS 41 4.183 2.089 -5.589
311 1HE LYS 41 2HE LYS 41 5.154 2.736 -8.172
312 2HE LYS 41 1HE LYS 41 3.812 1.685 -7.729
313 1HZ LYS 41 1HZ LYS 41 2.957 3.327 -9.167
314 2HZ LYS 41 2HZ LYS 41 3.723 4.586 -8.340
315 3HZ LYS 41 3HZ LYS 41 2.431 3.768 -7.620
316 H CYS 42 H CYS 42 0.819 1.216 -3.784
317 HA CYS 42 HA CYS 42 3.049 -0.685 -3.817
318 1HB CYS 42 2HB CYS 42 0.527 -1.554 -2.522
319 2HB CYS 42 1HB CYS 42 2.189 -1.921 -2.095
320 HG CYS 42 HG CYS 42 0.496 0.303 -0.914
321 H LYS 43 H LYS 43 2.538 -2.758 -4.803
322 HA LYS 43 HA LYS 43 0.688 -2.435 -7.023
323 1HB LYS 43 2HB LYS 43 1.794 -4.366 -7.992
324 2HB LYS 43 1HB LYS 43 2.986 -3.186 -7.466
325 1HG LYS 43 2HG LYS 43 3.234 -4.541 -5.360
326 2HG LYS 43 1HG LYS 43 2.253 -5.781 -6.144
327 1HD LYS 43 2HD LYS 43 4.606 -6.287 -6.426
328 2HD LYS 43 1HD LYS 43 3.888 -5.877 -7.985
329 1HE LYS 43 2HE LYS 43 6.134 -4.853 -7.554
330 2HE LYS 43 1HE LYS 43 4.856 -3.702 -7.948
331 1HZ LYS 43 1HZ LYS 43 4.793 -2.905 -5.813
332 2HZ LYS 43 2HZ LYS 43 6.442 -3.249 -5.967
333 3HZ LYS 43 3HZ LYS 43 5.431 -4.316 -5.131
334 H ASN 44 H ASN 44 -0.979 -3.723 -7.501
335 HA ASN 44 HA ASN 44 -1.844 -5.659 -5.465
336 1HB ASN 44 2HB ASN 44 -3.084 -3.297 -5.895
337 2HB ASN 44 1HB ASN 44 -3.903 -4.286 -7.099
338 1HD2 ASN 44 1HD2 ASN 44 -4.073 -3.213 -4.026
339 2HD2 ASN 44 2HD2 ASN 44 -5.050 -4.454 -3.328
340 H ALA 45 H ALA 45 -3.698 -7.034 -6.472
341 HA ALA 45 HA ALA 45 -2.509 -8.490 -8.579
342 1HB ALA 45 1HB ALA 45 -5.341 -9.031 -8.101
343 2HB ALA 45 2HB ALA 45 -4.343 -9.050 -6.647
344 3HB ALA 45 3HB ALA 45 -3.945 -10.105 -8.004
345 H ARG 46 H ARG 46 -4.070 -5.603 -8.801
346 HA ARG 46 HA ARG 46 -5.620 -6.151 -11.183
347 1HB ARG 46 2HB ARG 46 -4.888 -3.369 -10.377
348 2HB ARG 46 1HB ARG 46 -6.386 -3.969 -11.064
349 1HG ARG 46 2HG ARG 46 -5.534 -4.600 -8.256
350 2HG ARG 46 1HG ARG 46 -6.465 -3.166 -8.676
351 1HD ARG 46 2HD ARG 46 -8.039 -4.797 -8.006
352 2HD ARG 46 1HD ARG 46 -8.138 -4.699 -9.762
353 HE ARG 46 HE ARG 46 -6.377 -6.758 -8.765
354 1HH1 ARG 46 1HH1 ARG 46 -9.631 -5.958 -9.747
355 2HH1 ARG 46 2HH1 ARG 46 -10.061 -7.597 -10.097
356 1HH2 ARG 46 1HH2 ARG 46 -6.946 -8.918 -9.227
357 2HH2 ARG 46 2HH2 ARG 46 -8.540 -9.277 -9.802
358 H GLY 47 H GLY 47 -2.370 -5.716 -10.513
359 1HA GLY 47 2HA GLY 47 -0.609 -5.676 -12.040
360 2HA GLY 47 1HA GLY 47 -1.760 -5.318 -13.320
361 H GLN 48 H GLN 48 -2.707 -3.171 -11.214
362 HA GLN 48 HA GLN 48 -0.745 -1.133 -11.997
363 1HB GLN 48 2HB GLN 48 -3.711 -1.178 -12.063
364 2HB GLN 48 1HB GLN 48 -2.967 0.322 -11.529
365 1HG GLN 48 2HG GLN 48 -3.474 0.242 -13.954
366 2HG GLN 48 1HG GLN 48 -1.778 0.548 -13.584
367 1HE2 GLN 48 1HE2 GLN 48 -0.706 -0.299 -15.242
368 2HE2 GLN 48 2HE2 GLN 48 -0.862 -1.923 -15.811
369 H VAL 49 H VAL 49 0.014 0.212 -10.427
370 HA VAL 49 HA VAL 49 -1.066 -0.210 -7.719
371 HB VAL 49 HB VAL 49 1.010 -0.944 -7.272
372 1HG1 VAL 49 1HG1 VAL 49 1.963 0.575 -9.653
373 2HG1 VAL 49 2HG1 VAL 49 1.807 -1.171 -9.455
374 3HG1 VAL 49 3HG1 VAL 49 3.044 -0.288 -8.559
375 1HG2 VAL 49 1HG2 VAL 49 1.862 1.921 -7.453
376 2HG2 VAL 49 2HG2 VAL 49 2.430 0.683 -6.335
377 3HG2 VAL 49 3HG2 VAL 49 0.793 1.321 -6.187
378 H GLY 50 H GLY 50 -1.774 1.500 -6.642
379 1HA GLY 50 2HA GLY 50 -1.237 4.153 -7.813
380 2HA GLY 50 1HA GLY 50 -2.748 3.719 -7.044
381 H LEU 51 H LEU 51 -2.427 5.595 -5.761
382 HA LEU 51 HA LEU 51 -0.306 5.366 -3.765
383 1HB LEU 51 2HB LEU 51 -1.834 7.592 -4.922
384 2HB LEU 51 1HB LEU 51 -1.533 7.722 -3.201
385 HG LEU 51 HG LEU 51 0.757 7.942 -3.469
386 1HD1 LEU 51 1HD1 LEU 51 0.403 6.066 -5.637
387 2HD1 LEU 51 2HD1 LEU 51 1.829 6.413 -4.660
388 3HD1 LEU 51 3HD1 LEU 51 1.485 7.381 -6.091
389 1HD2 LEU 51 1HD2 LEU 51 -0.552 9.117 -5.903
390 2HD2 LEU 51 2HD2 LEU 51 1.123 9.442 -5.460
391 3HD2 LEU 51 3HD2 LEU 51 -0.185 9.910 -4.372
392 H VAL 52 H VAL 52 -0.652 4.901 -1.753
393 HA VAL 52 HA VAL 52 -3.426 4.474 -0.830
394 HB VAL 52 HB VAL 52 -2.370 2.368 -1.082
395 1HG1 VAL 52 1HG1 VAL 52 -0.095 2.191 0.363
396 2HG1 VAL 52 2HG1 VAL 52 -0.017 3.871 -0.169
397 3HG1 VAL 52 3HG1 VAL 52 -0.148 2.577 -1.359
398 1HG2 VAL 52 1HG2 VAL 52 -2.487 3.300 1.777
399 2HG2 VAL 52 2HG2 VAL 52 -1.837 1.702 1.403
400 3HG2 VAL 52 3HG2 VAL 52 -3.481 2.113 0.927
401 HA PRO 53 HA PRO 53 -2.814 7.186 2.656
402 1HB PRO 53 2HB PRO 53 -4.199 5.792 4.532
403 2HB PRO 53 1HB PRO 53 -5.004 6.689 3.238
404 1HG PRO 53 2HG PRO 53 -4.218 3.771 3.292
405 2HG PRO 53 1HG PRO 53 -5.836 4.469 2.979
406 1HD PRO 53 2HD PRO 53 -4.360 3.800 0.930
407 2HD PRO 53 1HD PRO 53 -5.115 5.409 0.922
408 H LYS 54 H LYS 54 -0.478 6.569 2.684
409 HA LYS 54 HA LYS 54 0.654 4.415 3.929
410 1HB LYS 54 2HB LYS 54 2.533 6.029 4.527
411 2HB LYS 54 1HB LYS 54 2.102 5.837 2.833
412 1HG LYS 54 2HG LYS 54 1.985 8.033 2.754
413 2HG LYS 54 1HG LYS 54 0.482 7.897 3.657
414 1HD LYS 54 2HD LYS 54 1.937 7.926 5.752
415 2HD LYS 54 1HD LYS 54 3.239 8.486 4.697
416 1HE LYS 54 2HE LYS 54 1.208 10.147 3.980
417 2HE LYS 54 1HE LYS 54 0.863 9.898 5.691
418 1HZ LYS 54 1HZ LYS 54 2.450 11.791 4.939
419 2HZ LYS 54 2HZ LYS 54 3.603 10.556 4.863
420 3HZ LYS 54 3HZ LYS 54 2.814 10.887 6.322
421 H ASN 55 H ASN 55 -0.952 7.096 5.430
422 HA ASN 55 HA ASN 55 0.119 6.592 8.059
423 1HB ASN 55 2HB ASN 55 -1.158 8.744 6.830
424 2HB ASN 55 1HB ASN 55 -2.321 8.170 8.021
425 1HD2 ASN 55 1HD2 ASN 55 -1.965 10.203 9.077
426 2HD2 ASN 55 2HD2 ASN 55 -0.595 10.408 10.110
427 H TYR 56 H TYR 56 -2.313 5.240 6.163
428 HA TYR 56 HA TYR 56 -3.855 4.291 8.472
429 1HB TYR 56 2HB TYR 56 -4.411 4.117 5.502
430 2HB TYR 56 1HB TYR 56 -5.467 3.488 6.758
431 HD1 TYR 56 1HD TYR 56 -7.390 4.733 6.674
432 HD2 TYR 56 2HD TYR 56 -3.653 6.759 6.515
433 HE1 TYR 56 1HE TYR 56 -8.563 6.892 6.809
434 HE2 TYR 56 2HE TYR 56 -4.813 8.922 6.655
435 HH TYR 56 HH TYR 56 -7.576 9.576 5.927
436 H VAL 57 H VAL 57 -1.155 3.313 7.830
437 HA VAL 57 HA VAL 57 -1.801 0.469 7.683
438 HB VAL 57 HB VAL 57 -0.414 -0.045 5.858
439 1HG1 VAL 57 1HG1 VAL 57 -1.673 2.582 5.075
440 2HG1 VAL 57 2HG1 VAL 57 -2.550 1.060 5.212
441 3HG1 VAL 57 3HG1 VAL 57 -1.271 1.236 4.009
442 1HG2 VAL 57 1HG2 VAL 57 1.552 1.000 5.783
443 2HG2 VAL 57 2HG2 VAL 57 0.922 2.428 6.604
444 3HG2 VAL 57 3HG2 VAL 57 0.724 2.256 4.862
445 H VAL 58 H VAL 58 0.361 -0.820 7.758
446 HA VAL 58 HA VAL 58 2.348 0.452 9.496
447 HB VAL 58 HB VAL 58 0.879 -0.718 11.044
448 1HG1 VAL 58 1HG1 VAL 58 0.428 -2.483 9.017
449 2HG1 VAL 58 2HG1 VAL 58 -0.040 -2.729 10.699
450 3HG1 VAL 58 3HG1 VAL 58 1.465 -3.420 10.092
451 1HG2 VAL 58 1HG2 VAL 58 2.563 -1.571 12.278
452 2HG2 VAL 58 2HG2 VAL 58 3.567 -0.938 10.974
453 3HG2 VAL 58 3HG2 VAL 58 3.110 -2.641 10.986
454 H VAL 59 H VAL 59 4.203 0.264 8.417
455 HA VAL 59 HA VAL 59 4.589 -1.490 6.256
456 HB VAL 59 HB VAL 59 6.811 -0.105 7.737
457 1HG1 VAL 59 1HG1 VAL 59 7.264 -0.127 4.984
458 2HG1 VAL 59 2HG1 VAL 59 6.636 -1.731 5.349
459 3HG1 VAL 59 3HG1 VAL 59 8.061 -1.132 6.196
460 1HG2 VAL 59 1HG2 VAL 59 4.807 1.340 6.999
461 2HG2 VAL 59 2HG2 VAL 59 5.381 1.022 5.363
462 3HG2 VAL 59 3HG2 VAL 59 6.428 1.841 6.520
463 H LEU 60 H LEU 60 5.905 -3.183 5.908
464 HA LEU 60 HA LEU 60 6.612 -4.804 8.216
465 1HB LEU 60 2HB LEU 60 5.222 -5.376 5.793
466 2HB LEU 60 1HB LEU 60 6.727 -6.275 5.781
467 HG LEU 60 HG LEU 60 6.156 -7.386 7.836
468 1HD1 LEU 60 1HD1 LEU 60 3.555 -6.781 8.445
469 2HD1 LEU 60 2HD1 LEU 60 4.239 -5.202 8.063
470 3HD1 LEU 60 3HD1 LEU 60 4.975 -6.202 9.315
471 1HD2 LEU 60 1HD2 LEU 60 5.240 -8.691 6.222
472 2HD2 LEU 60 2HD2 LEU 60 4.239 -7.388 5.582
473 3HD2 LEU 60 3HD2 LEU 60 3.753 -8.232 7.053
474 H SER 61 H SER 61 8.532 -6.144 7.853
475 HA SER 61 HA SER 61 10.811 -4.629 7.384
476 1HB SER 61 2HB SER 61 10.893 -7.615 7.097
477 2HB SER 61 1HB SER 61 12.049 -6.538 7.880
478 HG SER 61 HG SER 61 10.666 -6.315 9.598
Start of MODEL 6
1 1H GLY 1 1HT GLY 1 13.670 -9.669 5.737
2 2H GLY 1 2HT GLY 1 13.383 -11.269 5.268
3 3H GLY 1 3HT GLY 1 12.335 -10.041 4.767
4 1HA GLY 1 1HA GLY 1 15.140 -9.736 4.043
5 2HA GLY 1 2HA GLY 1 14.248 -11.006 3.219
6 H SER 2 H SER 2 12.159 -10.339 2.217
7 HA SER 2 HA SER 2 12.580 -8.133 0.497
8 1HB SER 2 2HB SER 2 10.842 -10.345 0.590
9 2HB SER 2 1HB SER 2 9.796 -8.922 0.589
10 HG SER 2 HG SER 2 10.707 -8.266 -1.317
11 H HIS 3 H HIS 3 11.646 -6.110 0.430
12 HA HIS 3 HA HIS 3 10.701 -5.090 2.968
13 1HB HIS 3 2HB HIS 3 10.399 -3.139 0.898
14 2HB HIS 3 1HB HIS 3 11.530 -3.146 2.241
15 HD1 HIS 3 1HD HIS 3 11.397 -3.255 -1.370
16 HD2 HIS 3 2HD HIS 3 14.018 -4.600 1.560
17 HE1 HIS 3 1HE HIS 3 13.570 -3.690 -2.560
18 HE2 HIS 3 2HE HIS 3 15.117 -4.580 -0.781
19 H VAL 4 H VAL 4 8.670 -5.376 3.523
20 HA VAL 4 HA VAL 4 6.601 -5.069 1.447
21 HB VAL 4 HB VAL 4 5.880 -6.864 3.657
22 1HG1 VAL 4 1HG1 VAL 4 4.833 -6.258 1.257
23 2HG1 VAL 4 2HG1 VAL 4 4.526 -7.782 2.090
24 3HG1 VAL 4 3HG1 VAL 4 5.754 -7.699 0.826
25 1HG2 VAL 4 1HG2 VAL 4 8.221 -7.527 3.365
26 2HG2 VAL 4 2HG2 VAL 4 7.935 -7.763 1.641
27 3HG2 VAL 4 3HG2 VAL 4 7.113 -8.786 2.818
28 H VAL 5 H VAL 5 4.405 -4.690 2.423
29 HA VAL 5 HA VAL 5 4.607 -3.176 4.917
30 HB VAL 5 HB VAL 5 4.381 -1.282 3.804
31 1HG1 VAL 5 1HG1 VAL 5 4.659 -1.159 1.643
32 2HG1 VAL 5 2HG1 VAL 5 3.118 -1.950 1.311
33 3HG1 VAL 5 3HG1 VAL 5 4.559 -2.914 1.621
34 1HG2 VAL 5 1HG2 VAL 5 2.149 -0.581 3.074
35 2HG2 VAL 5 2HG2 VAL 5 2.137 -1.382 4.648
36 3HG2 VAL 5 3HG2 VAL 5 1.607 -2.255 3.211
37 H GLN 6 H GLN 6 2.709 -2.974 6.126
38 HA GLN 6 HA GLN 6 0.753 -5.093 5.529
39 1HB GLN 6 2HB GLN 6 2.412 -5.063 7.638
40 2HB GLN 6 1HB GLN 6 1.074 -4.144 8.312
41 1HG GLN 6 2HG GLN 6 -0.433 -5.934 8.029
42 2HG GLN 6 1HG GLN 6 0.699 -6.820 7.008
43 1HE2 GLN 6 1HE2 GLN 6 -0.202 -5.984 10.235
44 2HE2 GLN 6 2HE2 GLN 6 0.878 -7.061 11.045
45 H THR 7 H THR 7 -1.432 -4.712 5.834
46 HA THR 7 HA THR 7 -2.135 -1.882 6.283
47 HB THR 7 HB THR 7 -4.285 -2.737 4.992
48 HG1 THR 7 1HG THR 7 -3.735 -4.800 4.563
49 1HG2 THR 7 1HG2 THR 7 -1.692 -1.925 3.704
50 2HG2 THR 7 2HG2 THR 7 -3.047 -0.891 4.155
51 3HG2 THR 7 3HG2 THR 7 -3.221 -2.050 2.837
52 H LEU 8 H LEU 8 -4.080 -1.412 7.339
53 HA LEU 8 HA LEU 8 -5.238 -3.606 8.896
54 1HB LEU 8 2HB LEU 8 -5.407 -1.344 10.508
55 2HB LEU 8 1HB LEU 8 -4.433 -2.766 10.783
56 HG LEU 8 HG LEU 8 -3.085 -0.797 11.044
57 1HD1 LEU 8 1HD1 LEU 8 -2.394 -2.926 9.509
58 2HD1 LEU 8 2HD1 LEU 8 -1.289 -1.659 10.047
59 3HD1 LEU 8 3HD1 LEU 8 -2.017 -1.572 8.442
60 1HD2 LEU 8 1HD2 LEU 8 -3.662 -0.063 8.204
61 2HD2 LEU 8 2HD2 LEU 8 -2.802 0.878 9.418
62 3HD2 LEU 8 3HD2 LEU 8 -4.541 0.620 9.567
63 H TYR 9 H TYR 9 -5.622 -0.259 7.767
64 HA TYR 9 HA TYR 9 -8.527 -0.505 8.089
65 1HB TYR 9 2HB TYR 9 -6.720 1.873 7.654
66 2HB TYR 9 1HB TYR 9 -8.475 1.986 7.560
67 HD1 TYR 9 1HD TYR 9 -5.816 2.585 9.640
68 HD2 TYR 9 2HD TYR 9 -9.635 0.708 9.703
69 HE1 TYR 9 1HE TYR 9 -5.916 2.883 12.079
70 HE2 TYR 9 2HE TYR 9 -9.745 1.002 12.144
71 HH TYR 9 HH TYR 9 -8.793 2.328 13.887
72 HA PRO 10 HA PRO 10 -9.495 -0.966 3.823
73 1HB PRO 10 2HB PRO 10 -11.481 0.923 3.494
74 2HB PRO 10 1HB PRO 10 -11.726 -0.681 4.190
75 1HG PRO 10 2HG PRO 10 -11.350 1.943 5.568
76 2HG PRO 10 1HG PRO 10 -12.452 0.612 5.970
77 1HD PRO 10 2HD PRO 10 -10.174 1.006 7.329
78 2HD PRO 10 1HD PRO 10 -10.780 -0.629 6.991
79 H PHE 11 H PHE 11 -9.444 0.103 1.728
80 HA PHE 11 HA PHE 11 -7.808 2.549 1.803
81 1HB PHE 11 2HB PHE 11 -7.751 0.123 0.071
82 2HB PHE 11 1HB PHE 11 -7.268 1.660 -0.638
83 HD1 PHE 11 1HD PHE 11 -4.980 1.172 -0.979
84 HD2 PHE 11 2HD PHE 11 -6.708 0.694 2.877
85 HE1 PHE 11 1HE PHE 11 -2.735 0.914 -0.004
86 HE2 PHE 11 2HE PHE 11 -4.473 0.438 3.859
87 HZ PHE 11 HZ PHE 11 -2.481 0.546 2.419
88 H SER 12 H SER 12 -8.404 4.313 0.710
89 HA SER 12 HA SER 12 -10.716 4.139 -1.100
90 1HB SER 12 2HB SER 12 -10.339 5.852 1.305
91 2HB SER 12 1HB SER 12 -11.097 6.599 -0.101
92 HG SER 12 HG SER 12 -12.242 5.065 1.684
93 H SER 13 H SER 13 -10.161 4.811 -3.062
94 HA SER 13 HA SER 13 -7.891 6.653 -3.329
95 1HB SER 13 2HB SER 13 -9.102 4.597 -5.156
96 2HB SER 13 1HB SER 13 -8.067 5.874 -5.796
97 HG SER 13 HG SER 13 -7.306 4.172 -3.664
98 H VAL 14 H VAL 14 -8.016 8.540 -4.480
99 HA VAL 14 HA VAL 14 -10.626 9.299 -5.584
100 HB VAL 14 HB VAL 14 -10.400 11.549 -4.587
101 1HG1 VAL 14 1HG1 VAL 14 -10.745 9.089 -2.971
102 2HG1 VAL 14 2HG1 VAL 14 -11.892 10.379 -3.332
103 3HG1 VAL 14 3HG1 VAL 14 -10.648 10.623 -2.107
104 1HG2 VAL 14 1HG2 VAL 14 -8.070 11.749 -4.219
105 2HG2 VAL 14 2HG2 VAL 14 -8.030 10.295 -3.222
106 3HG2 VAL 14 3HG2 VAL 14 -8.823 11.752 -2.624
107 H THR 15 H THR 15 -7.191 10.147 -5.270
108 HA THR 15 HA THR 15 -7.146 11.959 -7.444
109 HB THR 15 HB THR 15 -4.698 10.436 -6.662
110 HG1 THR 15 1HG THR 15 -4.707 11.152 -4.685
111 1HG2 THR 15 1HG2 THR 15 -4.289 13.176 -6.439
112 2HG2 THR 15 2HG2 THR 15 -5.295 12.974 -7.873
113 3HG2 THR 15 3HG2 THR 15 -3.760 12.117 -7.746
114 H GLU 16 H GLU 16 -5.567 11.535 -9.341
115 HA GLU 16 HA GLU 16 -6.659 9.364 -10.851
116 1HB GLU 16 2HB GLU 16 -5.295 11.799 -11.395
117 2HB GLU 16 1HB GLU 16 -4.387 10.501 -12.155
118 1HG GLU 16 2HG GLU 16 -5.998 10.072 -13.668
119 2HG GLU 16 1HG GLU 16 -7.305 10.429 -12.538
120 H GLU 17 H GLU 17 -3.573 10.034 -9.290
121 HA GLU 17 HA GLU 17 -2.124 7.876 -10.377
122 1HB GLU 17 2HB GLU 17 -1.664 8.950 -7.601
123 2HB GLU 17 1HB GLU 17 -0.488 8.298 -8.732
124 1HG GLU 17 2HG GLU 17 -0.962 10.275 -10.202
125 2HG GLU 17 1HG GLU 17 -1.888 10.950 -8.862
126 H GLU 18 H GLU 18 -3.931 8.182 -7.337
127 HA GLU 18 HA GLU 18 -3.468 5.674 -6.269
128 1HB GLU 18 2HB GLU 18 -5.512 7.764 -5.979
129 2HB GLU 18 1HB GLU 18 -6.065 6.161 -5.542
130 1HG GLU 18 2HG GLU 18 -4.845 6.109 -3.675
131 2HG GLU 18 1HG GLU 18 -3.453 6.872 -4.441
132 H LEU 19 H LEU 19 -5.763 4.281 -5.934
133 HA LEU 19 HA LEU 19 -7.427 3.850 -8.107
134 1HB LEU 19 2HB LEU 19 -6.549 2.136 -9.371
135 2HB LEU 19 1HB LEU 19 -5.139 3.127 -9.074
136 HG LEU 19 HG LEU 19 -4.327 1.001 -8.782
137 1HD1 LEU 19 1HD1 LEU 19 -4.267 2.600 -6.694
138 2HD1 LEU 19 2HD1 LEU 19 -3.501 1.012 -6.729
139 3HD1 LEU 19 3HD1 LEU 19 -5.079 1.216 -5.969
140 1HD2 LEU 19 1HD2 LEU 19 -6.500 0.048 -6.980
141 2HD2 LEU 19 2HD2 LEU 19 -5.443 -0.869 -8.052
142 3HD2 LEU 19 3HD2 LEU 19 -6.780 0.065 -8.722
143 H ASN 20 H ASN 20 -8.783 1.913 -7.849
144 HA ASN 20 HA ASN 20 -8.903 1.200 -5.009
145 1HB ASN 20 2HB ASN 20 -11.252 0.418 -5.649
146 2HB ASN 20 1HB ASN 20 -10.942 2.150 -5.694
147 1HD2 ASN 20 1HD2 ASN 20 -10.795 3.196 -7.678
148 2HD2 ASN 20 2HD2 ASN 20 -11.389 2.482 -9.136
149 H PHE 21 H PHE 21 -8.150 -0.665 -4.390
150 HA PHE 21 HA PHE 21 -8.577 -3.040 -6.064
151 1HB PHE 21 2HB PHE 21 -6.297 -3.833 -5.188
152 2HB PHE 21 1HB PHE 21 -6.295 -2.624 -6.466
153 HD1 PHE 21 1HD PHE 21 -4.618 -1.094 -6.237
154 HD2 PHE 21 2HD PHE 21 -6.557 -2.535 -2.733
155 HE1 PHE 21 1HE PHE 21 -3.205 0.370 -4.854
156 HE2 PHE 21 2HE PHE 21 -5.154 -1.069 -1.345
157 HZ PHE 21 HZ PHE 21 -3.472 0.386 -2.406
158 H GLU 22 H GLU 22 -8.411 -5.082 -4.771
159 HA GLU 22 HA GLU 22 -9.966 -4.873 -2.422
160 1HB GLU 22 2HB GLU 22 -9.939 -7.214 -2.334
161 2HB GLU 22 1HB GLU 22 -9.797 -6.856 -4.048
162 1HG GLU 22 2HG GLU 22 -7.329 -7.162 -3.821
163 2HG GLU 22 1HG GLU 22 -7.616 -7.718 -2.172
164 H LYS 23 H LYS 23 -9.210 -3.957 -0.641
165 HA LYS 23 HA LYS 23 -6.448 -3.956 0.053
166 1HB LYS 23 2HB LYS 23 -7.739 -2.045 0.665
167 2HB LYS 23 1HB LYS 23 -8.916 -3.033 1.513
168 1HG LYS 23 2HG LYS 23 -7.278 -1.699 2.920
169 2HG LYS 23 1HG LYS 23 -7.494 -3.398 3.325
170 1HD LYS 23 2HD LYS 23 -5.113 -2.418 3.276
171 2HD LYS 23 1HD LYS 23 -5.380 -3.986 2.526
172 1HE LYS 23 2HE LYS 23 -5.823 -2.145 0.482
173 2HE LYS 23 1HE LYS 23 -4.455 -1.492 1.374
174 1HZ LYS 23 1HZ LYS 23 -3.222 -2.923 0.235
175 2HZ LYS 23 2HZ LYS 23 -4.568 -3.762 -0.350
176 3HZ LYS 23 3HZ LYS 23 -3.912 -4.159 1.157
177 H GLY 24 H GLY 24 -5.352 -5.479 1.040
178 1HA GLY 24 2HA GLY 24 -6.824 -7.506 2.583
179 2HA GLY 24 1HA GLY 24 -5.233 -7.729 1.866
180 H GLU 25 H GLU 25 -4.387 -8.412 3.876
181 HA GLU 25 HA GLU 25 -4.339 -6.497 6.034
182 1HB GLU 25 2HB GLU 25 -4.781 -9.048 6.255
183 2HB GLU 25 1HB GLU 25 -3.033 -9.193 6.105
184 1HG GLU 25 2HG GLU 25 -2.660 -8.404 8.156
185 2HG GLU 25 1HG GLU 25 -3.926 -7.187 8.008
186 H THR 26 H THR 26 -2.577 -7.023 3.314
187 HA THR 26 HA THR 26 -0.423 -5.449 4.234
188 HB THR 26 HB THR 26 0.905 -6.983 5.090
189 HG1 THR 26 1HG THR 26 2.202 -7.165 3.451
190 1HG2 THR 26 1HG2 THR 26 -0.641 -8.633 5.614
191 2HG2 THR 26 2HG2 THR 26 0.582 -9.485 4.670
192 3HG2 THR 26 3HG2 THR 26 -0.943 -9.017 3.920
193 H MET 27 H MET 27 0.918 -4.703 2.713
194 HA MET 27 HA MET 27 0.615 -5.597 -0.051
195 1HB MET 27 2HB MET 27 0.805 -2.798 -0.215
196 2HB MET 27 1HB MET 27 -0.579 -3.793 -0.639
197 1HG MET 27 2HG MET 27 -1.656 -3.382 1.366
198 2HG MET 27 1HG MET 27 -0.165 -2.924 2.188
199 1HE MET 27 1HE MET 27 -1.481 -0.315 -1.279
200 2HE MET 27 2HE MET 27 -2.813 -1.302 -0.685
201 3HE MET 27 3HE MET 27 -1.328 -2.071 -1.246
202 H GLU 28 H GLU 28 2.371 -4.592 -1.426
203 HA GLU 28 HA GLU 28 4.800 -4.210 0.209
204 1HB GLU 28 2HB GLU 28 5.937 -5.018 -1.977
205 2HB GLU 28 1HB GLU 28 5.170 -6.202 -0.934
206 1HG GLU 28 2HG GLU 28 3.466 -5.052 -3.036
207 2HG GLU 28 1HG GLU 28 4.796 -6.070 -3.587
208 H VAL 29 H VAL 29 5.421 -2.166 0.182
209 HA VAL 29 HA VAL 29 4.693 -0.430 -2.019
210 HB VAL 29 HB VAL 29 5.823 0.086 0.724
211 1HG1 VAL 29 1HG1 VAL 29 5.416 2.096 -1.486
212 2HG1 VAL 29 2HG1 VAL 29 6.947 1.656 -0.727
213 3HG1 VAL 29 3HG1 VAL 29 5.709 2.496 0.206
214 1HG2 VAL 29 1HG2 VAL 29 3.329 -0.359 0.153
215 2HG2 VAL 29 2HG2 VAL 29 3.360 1.300 -0.442
216 3HG2 VAL 29 3HG2 VAL 29 3.757 0.959 1.242
217 H ILE 30 H ILE 30 6.011 0.347 -3.486
218 HA ILE 30 HA ILE 30 8.678 -0.720 -3.703
219 HB ILE 30 HB ILE 30 8.562 0.982 -5.792
220 1HG1 ILE 30 2HG1 ILE 30 6.136 1.517 -4.846
221 2HG1 ILE 30 1HG1 ILE 30 6.449 1.450 -6.570
222 1HG2 ILE 30 1HG2 ILE 30 7.795 -0.933 -7.128
223 2HG2 ILE 30 2HG2 ILE 30 7.324 -1.757 -5.642
224 3HG2 ILE 30 3HG2 ILE 30 9.020 -1.379 -5.940
225 1HD1 ILE 30 1HD1 ILE 30 5.586 -0.815 -6.660
226 2HD1 ILE 30 2HD1 ILE 30 4.396 0.288 -5.978
227 3HD1 ILE 30 3HD1 ILE 30 5.306 -0.788 -4.921
228 H GLU 31 H GLU 31 7.773 2.608 -4.497
229 HA GLU 31 HA GLU 31 10.280 3.595 -3.549
230 1HB GLU 31 2HB GLU 31 8.637 4.470 -5.444
231 2HB GLU 31 1HB GLU 31 8.011 5.441 -4.119
232 1HG GLU 31 2HG GLU 31 10.942 5.418 -4.486
233 2HG GLU 31 1HG GLU 31 9.985 6.249 -5.711
234 H LYS 32 H LYS 32 10.798 4.361 -1.614
235 HA LYS 32 HA LYS 32 8.649 4.696 0.356
236 1HB LYS 32 2HB LYS 32 11.256 3.474 0.447
237 2HB LYS 32 1HB LYS 32 11.143 4.739 1.663
238 1HG LYS 32 2HG LYS 32 10.493 2.437 2.419
239 2HG LYS 32 1HG LYS 32 9.298 3.700 2.712
240 1HD LYS 32 2HD LYS 32 7.934 2.961 0.931
241 2HD LYS 32 1HD LYS 32 9.213 1.940 0.271
242 1HE LYS 32 2HE LYS 32 8.462 1.322 3.039
243 2HE LYS 32 1HE LYS 32 7.173 1.074 1.861
244 1HZ LYS 32 1HZ LYS 32 9.828 -0.217 1.983
245 2HZ LYS 32 2HZ LYS 32 8.931 -0.195 0.549
246 3HZ LYS 32 3HZ LYS 32 8.300 -0.943 1.928
247 HA PRO 33 HA PRO 33 9.502 9.088 -0.077
248 1HB PRO 33 2HB PRO 33 7.585 9.365 2.138
249 2HB PRO 33 1HB PRO 33 7.500 10.002 0.494
250 1HG PRO 33 2HG PRO 33 5.910 7.999 1.322
251 2HG PRO 33 1HG PRO 33 6.520 8.086 -0.341
252 1HD PRO 33 2HD PRO 33 7.479 6.406 1.944
253 2HD PRO 33 1HD PRO 33 7.272 5.974 0.232
254 H GLU 34 H GLU 34 11.577 8.054 1.106
255 HA GLU 34 HA GLU 34 11.738 8.863 3.890
256 1HB GLU 34 2HB GLU 34 13.081 6.978 2.237
257 2HB GLU 34 1HB GLU 34 14.283 8.110 2.839
258 1HG GLU 34 2HG GLU 34 13.427 7.691 5.138
259 2HG GLU 34 1HG GLU 34 12.385 6.438 4.465
260 H ASN 35 H ASN 35 13.444 9.628 0.855
261 HA ASN 35 HA ASN 35 14.689 11.945 2.073
262 1HB ASN 35 2HB ASN 35 15.737 10.356 0.313
263 2HB ASN 35 1HB ASN 35 14.797 11.278 -0.857
264 1HD2 ASN 35 1HD2 ASN 35 15.660 13.062 -1.645
265 2HD2 ASN 35 2HD2 ASN 35 17.029 13.893 -0.998
266 H ASP 36 H ASP 36 12.296 11.275 -0.457
267 HA ASP 36 HA ASP 36 11.585 14.130 -0.458
268 1HB ASP 36 2HB ASP 36 11.179 11.974 -2.533
269 2HB ASP 36 1HB ASP 36 10.411 13.556 -2.629
270 HA PRO 37 HA PRO 37 8.071 12.425 1.892
271 1HB PRO 37 2HB PRO 37 7.505 15.283 2.327
272 2HB PRO 37 1HB PRO 37 7.766 13.999 3.510
273 1HG PRO 37 2HG PRO 37 9.590 15.924 3.093
274 2HG PRO 37 1HG PRO 37 10.060 14.258 3.484
275 1HD PRO 37 2HD PRO 37 10.036 15.650 0.831
276 2HD PRO 37 1HD PRO 37 11.245 14.538 1.509
277 H GLU 38 H GLU 38 6.529 11.721 0.517
278 HA GLU 38 HA GLU 38 4.682 13.663 -0.562
279 1HB GLU 38 2HB GLU 38 6.284 13.552 -2.368
280 2HB GLU 38 1HB GLU 38 6.239 11.796 -2.359
281 1HG GLU 38 2HG GLU 38 4.063 11.750 -3.258
282 2HG GLU 38 1HG GLU 38 3.817 13.468 -2.949
283 H TRP 39 H TRP 39 4.866 10.503 -2.004
284 HA TRP 39 HA TRP 39 3.038 9.307 -0.093
285 1HB TRP 39 2HB TRP 39 2.118 9.305 -2.943
286 2HB TRP 39 1HB TRP 39 1.176 9.095 -1.475
287 HD1 TRP 39 HD TRP 39 0.953 11.515 0.033
288 HE1 TRP 39 1HE TRP 39 0.464 13.868 -0.888
289 HE3 TRP 39 3HE TRP 39 2.315 10.779 -4.839
290 HZ2 TRP 39 2HZ TRP 39 0.632 15.230 -3.355
291 HZ3 TRP 39 3HZ TRP 39 2.117 12.657 -6.418
292 HH2 TRP 39 HH TRP 39 1.291 14.837 -5.688
293 H TRP 40 H TRP 40 2.608 6.989 -0.630
294 HA TRP 40 HA TRP 40 4.726 5.928 -2.364
295 1HB TRP 40 2HB TRP 40 5.019 4.030 -0.906
296 2HB TRP 40 1HB TRP 40 5.255 5.512 -0.005
297 HD1 TRP 40 HD TRP 40 1.667 4.287 -0.500
298 HE1 TRP 40 1HE TRP 40 0.762 3.434 1.746
299 HE3 TRP 40 3HE TRP 40 5.974 4.473 2.212
300 HZ2 TRP 40 2HZ TRP 40 1.763 2.894 4.327
301 HZ3 TRP 40 3HZ TRP 40 5.921 3.775 4.570
302 HH2 TRP 40 HH TRP 40 3.847 3.009 5.605
303 H LYS 41 H LYS 41 4.298 3.804 -3.309
304 HA LYS 41 HA LYS 41 1.466 3.197 -3.628
305 1HB LYS 41 2HB LYS 41 1.910 2.875 -6.118
306 2HB LYS 41 1HB LYS 41 1.711 4.513 -5.523
307 1HG LYS 41 2HG LYS 41 3.508 4.686 -6.933
308 2HG LYS 41 1HG LYS 41 4.279 4.523 -5.363
309 1HD LYS 41 2HD LYS 41 5.494 3.009 -6.580
310 2HD LYS 41 1HD LYS 41 4.207 1.981 -5.977
311 1HE LYS 41 2HE LYS 41 4.945 2.513 -8.668
312 2HE LYS 41 1HE LYS 41 3.731 1.393 -8.051
313 1HZ LYS 41 1HZ LYS 41 2.623 2.856 -9.502
314 2HZ LYS 41 2HZ LYS 41 3.365 4.227 -8.850
315 3HZ LYS 41 3HZ LYS 41 2.206 3.385 -7.952
316 H CYS 42 H CYS 42 0.947 1.100 -3.927
317 HA CYS 42 HA CYS 42 3.145 -0.802 -4.237
318 1HB CYS 42 2HB CYS 42 1.360 -2.099 -2.529
319 2HB CYS 42 1HB CYS 42 2.924 -1.439 -2.088
320 HG CYS 42 HG CYS 42 1.566 0.790 -1.414
321 H LYS 43 H LYS 43 2.393 -2.962 -4.922
322 HA LYS 43 HA LYS 43 0.202 -2.664 -6.815
323 1HB LYS 43 2HB LYS 43 2.323 -3.555 -7.626
324 2HB LYS 43 1HB LYS 43 2.222 -4.880 -6.476
325 1HG LYS 43 2HG LYS 43 -0.171 -4.825 -8.025
326 2HG LYS 43 1HG LYS 43 1.220 -4.769 -9.109
327 1HD LYS 43 2HD LYS 43 2.000 -6.670 -7.322
328 2HD LYS 43 1HD LYS 43 0.257 -6.938 -7.381
329 1HE LYS 43 2HE LYS 43 1.186 -8.321 -9.053
330 2HE LYS 43 1HE LYS 43 0.474 -6.949 -9.900
331 1HZ LYS 43 1HZ LYS 43 2.634 -7.433 -10.801
332 2HZ LYS 43 2HZ LYS 43 3.352 -7.330 -9.273
333 3HZ LYS 43 3HZ LYS 43 2.699 -5.947 -9.995
334 H ASN 44 H ASN 44 -1.558 -3.885 -6.967
335 HA ASN 44 HA ASN 44 -2.209 -5.607 -4.670
336 1HB ASN 44 2HB ASN 44 -3.542 -3.293 -5.617
337 2HB ASN 44 1HB ASN 44 -4.569 -4.663 -6.004
338 1HD2 ASN 44 1HD2 ASN 44 -2.776 -3.124 -3.396
339 2HD2 ASN 44 2HD2 ASN 44 -3.811 -3.660 -2.123
340 H ALA 45 H ALA 45 -4.156 -7.066 -5.294
341 HA ALA 45 HA ALA 45 -3.218 -8.752 -7.365
342 1HB ALA 45 1HB ALA 45 -5.044 -10.193 -6.815
343 2HB ALA 45 2HB ALA 45 -5.905 -8.880 -6.014
344 3HB ALA 45 3HB ALA 45 -4.419 -9.517 -5.311
345 H ARG 46 H ARG 46 -4.889 -5.916 -7.522
346 HA ARG 46 HA ARG 46 -6.667 -6.542 -9.706
347 1HB ARG 46 2HB ARG 46 -5.937 -4.123 -8.122
348 2HB ARG 46 1HB ARG 46 -6.653 -3.888 -9.707
349 1HG ARG 46 2HG ARG 46 -8.152 -3.903 -7.638
350 2HG ARG 46 1HG ARG 46 -8.683 -4.780 -9.069
351 1HD ARG 46 2HD ARG 46 -7.388 -6.748 -7.799
352 2HD ARG 46 1HD ARG 46 -7.845 -5.777 -6.408
353 HE ARG 46 HE ARG 46 -10.160 -5.957 -7.729
354 1HH1 ARG 46 1HH1 ARG 46 -7.820 -8.391 -6.837
355 2HH1 ARG 46 2HH1 ARG 46 -8.994 -9.659 -6.740
356 1HH2 ARG 46 1HH2 ARG 46 -11.701 -7.622 -7.604
357 2HH2 ARG 46 2HH2 ARG 46 -11.198 -9.224 -7.174
358 H GLY 47 H GLY 47 -3.368 -6.022 -9.401
359 1HA GLY 47 2HA GLY 47 -1.757 -5.876 -11.062
360 2HA GLY 47 1HA GLY 47 -3.044 -5.697 -12.249
361 H GLN 48 H GLN 48 -3.651 -3.567 -9.795
362 HA GLN 48 HA GLN 48 -2.258 -1.372 -11.172
363 1HB GLN 48 2HB GLN 48 -5.047 -1.708 -10.538
364 2HB GLN 48 1HB GLN 48 -4.408 -0.357 -9.660
365 1HG GLN 48 2HG GLN 48 -5.434 0.039 -11.978
366 2HG GLN 48 1HG GLN 48 -3.946 0.868 -11.522
367 1HE2 GLN 48 1HE2 GLN 48 -2.236 0.667 -12.812
368 2HE2 GLN 48 2HE2 GLN 48 -2.098 -0.440 -14.132
369 H VAL 49 H VAL 49 -0.681 -0.555 -9.947
370 HA VAL 49 HA VAL 49 -1.054 -0.622 -7.035
371 HB VAL 49 HB VAL 49 1.087 -1.367 -7.170
372 1HG1 VAL 49 1HG1 VAL 49 1.557 0.184 -9.671
373 2HG1 VAL 49 2HG1 VAL 49 1.047 -1.504 -9.593
374 3HG1 VAL 49 3HG1 VAL 49 2.620 -1.025 -8.951
375 1HG2 VAL 49 1HG2 VAL 49 1.785 1.500 -7.672
376 2HG2 VAL 49 2HG2 VAL 49 2.653 0.319 -6.693
377 3HG2 VAL 49 3HG2 VAL 49 1.097 0.942 -6.149
378 H GLY 50 H GLY 50 -1.610 1.182 -6.049
379 1HA GLY 50 2HA GLY 50 -1.128 3.710 -7.475
380 2HA GLY 50 1HA GLY 50 -2.659 3.361 -6.700
381 H LEU 51 H LEU 51 -1.790 5.537 -5.910
382 HA LEU 51 HA LEU 51 0.163 5.469 -3.847
383 1HB LEU 51 2HB LEU 51 -1.699 7.452 -5.014
384 2HB LEU 51 1HB LEU 51 -1.114 7.773 -3.396
385 HG LEU 51 HG LEU 51 1.000 8.216 -4.099
386 1HD1 LEU 51 1HD1 LEU 51 0.550 6.059 -6.068
387 2HD1 LEU 51 2HD1 LEU 51 1.890 6.317 -4.952
388 3HD1 LEU 51 3HD1 LEU 51 1.777 7.269 -6.432
389 1HD2 LEU 51 1HD2 LEU 51 0.673 9.866 -5.545
390 2HD2 LEU 51 2HD2 LEU 51 -0.968 9.256 -5.753
391 3HD2 LEU 51 3HD2 LEU 51 0.312 8.731 -6.846
392 H VAL 52 H VAL 52 -0.051 5.232 -1.714
393 HA VAL 52 HA VAL 52 -2.756 5.007 -0.588
394 HB VAL 52 HB VAL 52 -2.324 2.749 -0.657
395 1HG1 VAL 52 1HG1 VAL 52 0.357 2.368 0.200
396 2HG1 VAL 52 2HG1 VAL 52 0.346 3.561 -1.092
397 3HG1 VAL 52 3HG1 VAL 52 -0.378 1.983 -1.353
398 1HG2 VAL 52 1HG2 VAL 52 -2.696 3.212 1.667
399 2HG2 VAL 52 2HG2 VAL 52 -1.010 3.631 1.913
400 3HG2 VAL 52 3HG2 VAL 52 -1.458 1.970 1.549
401 HA PRO 53 HA PRO 53 -1.020 7.578 2.597
402 1HB PRO 53 2HB PRO 53 -3.045 7.576 4.302
403 2HB PRO 53 1HB PRO 53 -3.276 8.251 2.679
404 1HG PRO 53 2HG PRO 53 -3.912 5.473 3.648
405 2HG PRO 53 1HG PRO 53 -5.008 6.628 2.851
406 1HD PRO 53 2HD PRO 53 -3.739 4.703 1.471
407 2HD PRO 53 1HD PRO 53 -4.001 6.315 0.776
408 H LYS 54 H LYS 54 0.621 6.743 3.765
409 HA LYS 54 HA LYS 54 0.758 4.239 4.956
410 1HB LYS 54 2HB LYS 54 2.656 5.142 6.203
411 2HB LYS 54 1HB LYS 54 2.699 5.609 4.504
412 1HG LYS 54 2HG LYS 54 2.912 7.686 5.178
413 2HG LYS 54 1HG LYS 54 1.233 7.610 5.715
414 1HD LYS 54 2HD LYS 54 2.105 6.678 7.892
415 2HD LYS 54 1HD LYS 54 3.724 7.124 7.343
416 1HE LYS 54 2HE LYS 54 2.014 9.361 6.961
417 2HE LYS 54 1HE LYS 54 1.758 8.752 8.596
418 1HZ LYS 54 1HZ LYS 54 4.470 9.227 7.515
419 2HZ LYS 54 2HZ LYS 54 3.999 9.056 9.130
420 3HZ LYS 54 3HZ LYS 54 3.584 10.453 8.274
421 H ASN 55 H ASN 55 -0.981 6.956 5.931
422 HA ASN 55 HA ASN 55 -0.876 6.578 8.762
423 1HB ASN 55 2HB ASN 55 -1.517 8.701 7.416
424 2HB ASN 55 1HB ASN 55 -3.116 7.963 7.337
425 1HD2 ASN 55 1HD2 ASN 55 -1.171 10.000 9.059
426 2HD2 ASN 55 2HD2 ASN 55 -2.014 9.985 10.568
427 H TYR 56 H TYR 56 -2.343 4.839 6.335
428 HA TYR 56 HA TYR 56 -4.399 3.821 8.180
429 1HB TYR 56 2HB TYR 56 -4.432 3.756 5.158
430 2HB TYR 56 1HB TYR 56 -5.715 3.211 6.232
431 HD1 TYR 56 1HD TYR 56 -3.694 6.299 5.588
432 HD2 TYR 56 2HD TYR 56 -7.477 4.627 6.576
433 HE1 TYR 56 1HE TYR 56 -4.697 8.545 5.550
434 HE2 TYR 56 2HE TYR 56 -8.492 6.864 6.541
435 HH TYR 56 HH TYR 56 -8.102 9.051 5.654
436 H VAL 57 H VAL 57 -1.461 3.119 7.499
437 HA VAL 57 HA VAL 57 -1.905 0.239 7.544
438 HB VAL 57 HB VAL 57 -0.928 -0.328 5.581
439 1HG1 VAL 57 1HG1 VAL 57 -2.694 1.111 4.830
440 2HG1 VAL 57 2HG1 VAL 57 -1.302 1.336 3.770
441 3HG1 VAL 57 3HG1 VAL 57 -1.670 2.537 5.007
442 1HG2 VAL 57 1HG2 VAL 57 1.286 0.310 5.952
443 2HG2 VAL 57 2HG2 VAL 57 0.881 2.026 6.009
444 3HG2 VAL 57 3HG2 VAL 57 0.849 1.161 4.472
445 H VAL 58 H VAL 58 0.337 -0.882 7.623
446 HA VAL 58 HA VAL 58 2.275 0.673 9.173
447 HB VAL 58 HB VAL 58 0.918 -0.517 10.837
448 1HG1 VAL 58 1HG1 VAL 58 0.483 -2.425 9.068
449 2HG1 VAL 58 2HG1 VAL 58 0.424 -2.743 10.802
450 3HG1 VAL 58 3HG1 VAL 58 1.865 -3.164 9.877
451 1HG2 VAL 58 1HG2 VAL 58 2.764 -1.826 11.910
452 2HG2 VAL 58 2HG2 VAL 58 3.210 -0.195 11.409
453 3HG2 VAL 58 3HG2 VAL 58 3.707 -1.582 10.440
454 H VAL 59 H VAL 59 4.132 0.525 8.097
455 HA VAL 59 HA VAL 59 4.552 -1.299 6.008
456 HB VAL 59 HB VAL 59 6.699 0.274 7.415
457 1HG1 VAL 59 1HG1 VAL 59 7.133 0.084 4.642
458 2HG1 VAL 59 2HG1 VAL 59 6.697 -1.534 5.182
459 3HG1 VAL 59 3HG1 VAL 59 8.053 -0.695 5.931
460 1HG2 VAL 59 1HG2 VAL 59 4.530 1.080 5.573
461 2HG2 VAL 59 2HG2 VAL 59 6.133 1.741 5.251
462 3HG2 VAL 59 3HG2 VAL 59 5.367 2.009 6.816
463 H LEU 60 H LEU 60 5.892 -2.983 5.728
464 HA LEU 60 HA LEU 60 6.696 -4.449 8.105
465 1HB LEU 60 2HB LEU 60 5.337 -5.138 5.631
466 2HB LEU 60 1HB LEU 60 6.739 -6.148 5.894
467 HG LEU 60 HG LEU 60 5.813 -7.202 7.713
468 1HD1 LEU 60 1HD1 LEU 60 3.803 -6.161 8.944
469 2HD1 LEU 60 2HD1 LEU 60 4.300 -4.660 8.164
470 3HD1 LEU 60 3HD1 LEU 60 5.411 -5.502 9.244
471 1HD2 LEU 60 1HD2 LEU 60 3.378 -6.316 6.172
472 2HD2 LEU 60 2HD2 LEU 60 3.488 -7.731 7.221
473 3HD2 LEU 60 3HD2 LEU 60 4.441 -7.656 5.738
474 H SER 61 H SER 61 8.609 -5.785 7.761
475 HA SER 61 HA SER 61 10.539 -4.793 5.816
476 1HB SER 61 2HB SER 61 10.599 -3.720 8.298
477 2HB SER 61 1HB SER 61 11.628 -5.130 8.551
478 HG SER 61 HG SER 61 12.319 -2.858 7.469
Start of MODEL 7
1 1H GLY 1 1HT GLY 1 15.838 -8.939 3.001
2 2H GLY 1 2HT GLY 1 15.067 -10.411 3.313
3 3H GLY 1 3HT GLY 1 14.149 -9.015 3.053
4 1HA GLY 1 1HA GLY 1 15.991 -9.910 0.953
5 2HA GLY 1 2HA GLY 1 14.464 -10.756 1.156
6 H SER 2 H SER 2 12.585 -9.032 1.549
7 HA SER 2 HA SER 2 12.892 -6.872 -0.425
8 1HB SER 2 2HB SER 2 11.457 -9.197 -0.914
9 2HB SER 2 1HB SER 2 10.212 -8.048 -0.412
10 HG SER 2 HG SER 2 10.456 -7.041 -2.236
11 H HIS 3 H HIS 3 11.638 -5.033 -0.073
12 HA HIS 3 HA HIS 3 10.801 -4.657 2.671
13 1HB HIS 3 2HB HIS 3 10.136 -2.490 0.815
14 2HB HIS 3 1HB HIS 3 11.076 -2.445 2.299
15 HD1 HIS 3 1HD HIS 3 13.643 -2.739 2.090
16 HD2 HIS 3 2HD HIS 3 11.621 -2.731 -1.541
17 HE1 HIS 3 1HE HIS 3 15.420 -2.464 0.332
18 HE2 HIS 3 2HE HIS 3 14.182 -2.553 -1.860
19 H VAL 4 H VAL 4 8.802 -5.037 3.374
20 HA VAL 4 HA VAL 4 6.615 -4.938 1.402
21 HB VAL 4 HB VAL 4 6.038 -6.723 3.609
22 1HG1 VAL 4 1HG1 VAL 4 4.728 -6.706 1.599
23 2HG1 VAL 4 2HG1 VAL 4 5.543 -8.266 1.711
24 3HG1 VAL 4 3HG1 VAL 4 6.153 -7.030 0.612
25 1HG2 VAL 4 1HG2 VAL 4 7.566 -8.550 2.808
26 2HG2 VAL 4 2HG2 VAL 4 8.350 -7.251 3.707
27 3HG2 VAL 4 3HG2 VAL 4 8.477 -7.309 1.949
28 H VAL 5 H VAL 5 4.441 -4.754 2.495
29 HA VAL 5 HA VAL 5 4.612 -3.175 4.945
30 HB VAL 5 HB VAL 5 4.307 -1.329 3.752
31 1HG1 VAL 5 1HG1 VAL 5 4.643 -1.563 1.603
32 2HG1 VAL 5 2HG1 VAL 5 2.900 -1.732 1.418
33 3HG1 VAL 5 3HG1 VAL 5 3.913 -3.162 1.578
34 1HG2 VAL 5 1HG2 VAL 5 2.002 -0.685 3.289
35 2HG2 VAL 5 2HG2 VAL 5 2.146 -1.513 4.840
36 3HG2 VAL 5 3HG2 VAL 5 1.503 -2.369 3.439
37 H GLN 6 H GLN 6 2.638 -2.935 6.100
38 HA GLN 6 HA GLN 6 0.767 -5.159 5.606
39 1HB GLN 6 2HB GLN 6 2.486 -5.129 7.661
40 2HB GLN 6 1HB GLN 6 1.197 -4.170 8.377
41 1HG GLN 6 2HG GLN 6 -0.351 -5.918 8.231
42 2HG GLN 6 1HG GLN 6 0.660 -6.829 7.112
43 1HE2 GLN 6 1HE2 GLN 6 0.087 -8.488 8.796
44 2HE2 GLN 6 2HE2 GLN 6 1.173 -8.655 10.129
45 H THR 7 H THR 7 -1.408 -4.721 5.772
46 HA THR 7 HA THR 7 -2.072 -1.904 6.345
47 HB THR 7 HB THR 7 -4.257 -2.794 5.033
48 HG1 THR 7 1HG THR 7 -2.059 -4.082 3.783
49 1HG2 THR 7 1HG2 THR 7 -3.616 -1.517 3.219
50 2HG2 THR 7 2HG2 THR 7 -1.909 -1.920 3.405
51 3HG2 THR 7 3HG2 THR 7 -2.685 -0.818 4.542
52 H LEU 8 H LEU 8 -4.091 -1.448 7.320
53 HA LEU 8 HA LEU 8 -5.236 -3.647 8.876
54 1HB LEU 8 2HB LEU 8 -5.495 -1.462 10.523
55 2HB LEU 8 1HB LEU 8 -4.375 -2.785 10.734
56 HG LEU 8 HG LEU 8 -3.253 -0.659 11.011
57 1HD1 LEU 8 1HD1 LEU 8 -2.136 -1.411 8.407
58 2HD1 LEU 8 2HD1 LEU 8 -2.326 -2.732 9.560
59 3HD1 LEU 8 3HD1 LEU 8 -1.370 -1.314 9.993
60 1HD2 LEU 8 1HD2 LEU 8 -3.262 1.070 9.509
61 2HD2 LEU 8 2HD2 LEU 8 -4.906 0.454 9.345
62 3HD2 LEU 8 3HD2 LEU 8 -3.681 0.027 8.154
63 H TYR 9 H TYR 9 -5.637 -0.367 7.612
64 HA TYR 9 HA TYR 9 -8.528 -0.524 7.983
65 1HB TYR 9 2HB TYR 9 -6.579 1.662 7.446
66 2HB TYR 9 1HB TYR 9 -8.217 1.871 6.834
67 HD1 TYR 9 1HD TYR 9 -6.294 2.955 9.335
68 HD2 TYR 9 2HD TYR 9 -9.933 0.804 8.857
69 HE1 TYR 9 1HE TYR 9 -7.024 3.706 11.560
70 HE2 TYR 9 2HE TYR 9 -10.673 1.550 11.080
71 HH TYR 9 HH TYR 9 -8.843 2.590 13.375
72 HA PRO 10 HA PRO 10 -9.763 -1.537 3.888
73 1HB PRO 10 2HB PRO 10 -11.194 1.068 3.716
74 2HB PRO 10 1HB PRO 10 -11.804 -0.570 3.463
75 1HG PRO 10 2HG PRO 10 -12.386 0.759 5.692
76 2HG PRO 10 1HG PRO 10 -12.032 -0.978 5.737
77 1HD PRO 10 2HD PRO 10 -10.305 1.330 6.522
78 2HD PRO 10 1HD PRO 10 -10.458 -0.272 7.271
79 H PHE 11 H PHE 11 -10.265 -0.105 1.661
80 HA PHE 11 HA PHE 11 -7.650 1.098 1.076
81 1HB PHE 11 2HB PHE 11 -8.199 0.628 -1.290
82 2HB PHE 11 1HB PHE 11 -8.224 -0.826 -0.299
83 HD1 PHE 11 1HD PHE 11 -10.207 1.500 -2.276
84 HD2 PHE 11 2HD PHE 11 -10.325 -1.933 0.236
85 HE1 PHE 11 1HE PHE 11 -12.491 1.016 -3.052
86 HE2 PHE 11 2HE PHE 11 -12.609 -2.423 -0.536
87 HZ PHE 11 HZ PHE 11 -13.695 -0.948 -2.181
88 H SER 12 H SER 12 -7.464 3.192 0.583
89 HA SER 12 HA SER 12 -9.883 4.671 -0.201
90 1HB SER 12 2HB SER 12 -9.266 5.055 2.216
91 2HB SER 12 1HB SER 12 -7.758 5.772 1.649
92 HG SER 12 HG SER 12 -8.834 7.539 1.357
93 H SER 13 H SER 13 -9.618 5.539 -2.141
94 HA SER 13 HA SER 13 -7.070 6.795 -2.815
95 1HB SER 13 2HB SER 13 -7.947 4.288 -3.920
96 2HB SER 13 1HB SER 13 -7.896 5.508 -5.193
97 HG SER 13 HG SER 13 -5.851 4.295 -3.863
98 H VAL 14 H VAL 14 -7.503 8.790 -3.451
99 HA VAL 14 HA VAL 14 -9.734 9.283 -5.259
100 HB VAL 14 HB VAL 14 -10.697 9.673 -3.061
101 1HG1 VAL 14 1HG1 VAL 14 -9.069 10.193 -1.566
102 2HG1 VAL 14 2HG1 VAL 14 -9.676 11.814 -1.903
103 3HG1 VAL 14 3HG1 VAL 14 -8.209 11.239 -2.695
104 1HG2 VAL 14 1HG2 VAL 14 -11.013 11.245 -5.158
105 2HG2 VAL 14 2HG2 VAL 14 -10.274 12.434 -4.086
106 3HG2 VAL 14 3HG2 VAL 14 -11.764 11.622 -3.607
107 H THR 15 H THR 15 -7.302 9.284 -6.220
108 HA THR 15 HA THR 15 -6.786 12.087 -6.785
109 HB THR 15 HB THR 15 -4.421 10.379 -6.090
110 HG1 THR 15 1HG THR 15 -5.718 10.360 -4.241
111 1HG2 THR 15 1HG2 THR 15 -3.644 12.325 -7.027
112 2HG2 THR 15 2HG2 THR 15 -3.647 12.725 -5.309
113 3HG2 THR 15 3HG2 THR 15 -4.949 13.300 -6.350
114 H GLU 16 H GLU 16 -4.973 12.228 -8.512
115 HA GLU 16 HA GLU 16 -5.774 10.548 -10.683
116 1HB GLU 16 2HB GLU 16 -5.283 12.549 -11.608
117 2HB GLU 16 1HB GLU 16 -4.189 12.990 -10.308
118 1HG GLU 16 2HG GLU 16 -3.017 12.903 -12.417
119 2HG GLU 16 1HG GLU 16 -2.429 11.644 -11.331
120 H GLU 17 H GLU 17 -3.010 10.736 -8.534
121 HA GLU 17 HA GLU 17 -1.676 8.576 -9.996
122 1HB GLU 17 2HB GLU 17 0.192 9.048 -8.317
123 2HB GLU 17 1HB GLU 17 -0.140 10.291 -9.515
124 1HG GLU 17 2HG GLU 17 -1.403 11.560 -7.873
125 2HG GLU 17 1HG GLU 17 -1.121 10.305 -6.670
126 H GLU 18 H GLU 18 -4.107 8.179 -8.417
127 HA GLU 18 HA GLU 18 -3.054 6.239 -6.457
128 1HB GLU 18 2HB GLU 18 -5.017 8.364 -6.148
129 2HB GLU 18 1HB GLU 18 -5.664 6.805 -5.674
130 1HG GLU 18 2HG GLU 18 -4.682 7.081 -3.718
131 2HG GLU 18 1HG GLU 18 -3.134 6.899 -4.539
132 H LEU 19 H LEU 19 -5.388 4.905 -5.882
133 HA LEU 19 HA LEU 19 -7.117 4.295 -7.957
134 1HB LEU 19 2HB LEU 19 -6.306 2.463 -9.085
135 2HB LEU 19 1HB LEU 19 -4.868 3.443 -8.916
136 HG LEU 19 HG LEU 19 -4.072 1.343 -8.445
137 1HD1 LEU 19 1HD1 LEU 19 -4.053 3.099 -6.419
138 2HD1 LEU 19 2HD1 LEU 19 -3.212 1.553 -6.413
139 3HD1 LEU 19 3HD1 LEU 19 -4.781 1.700 -5.635
140 1HD2 LEU 19 1HD2 LEU 19 -6.214 0.506 -6.566
141 2HD2 LEU 19 2HD2 LEU 19 -5.233 -0.454 -7.670
142 3HD2 LEU 19 3HD2 LEU 19 -6.578 0.497 -8.291
143 H ASN 20 H ASN 20 -8.634 2.687 -7.399
144 HA ASN 20 HA ASN 20 -8.516 2.006 -4.553
145 1HB ASN 20 2HB ASN 20 -11.015 1.532 -4.926
146 2HB ASN 20 1HB ASN 20 -10.480 3.209 -4.970
147 1HD2 ASN 20 1HD2 ASN 20 -12.040 0.712 -6.634
148 2HD2 ASN 20 2HD2 ASN 20 -12.261 1.525 -8.143
149 H PHE 21 H PHE 21 -7.944 0.053 -4.007
150 HA PHE 21 HA PHE 21 -8.887 -2.224 -5.599
151 1HB PHE 21 2HB PHE 21 -6.604 -3.309 -4.892
152 2HB PHE 21 1HB PHE 21 -6.694 -2.289 -6.321
153 HD1 PHE 21 1HD PHE 21 -4.422 -1.671 -6.393
154 HD2 PHE 21 2HD PHE 21 -6.686 -1.003 -2.860
155 HE1 PHE 21 1HE PHE 21 -2.610 -0.265 -5.503
156 HE2 PHE 21 2HE PHE 21 -4.884 0.403 -1.959
157 HZ PHE 21 HZ PHE 21 -2.840 0.776 -3.283
158 H GLU 22 H GLU 22 -8.819 -4.297 -4.348
159 HA GLU 22 HA GLU 22 -9.903 -3.838 -1.728
160 1HB GLU 22 2HB GLU 22 -10.206 -6.275 -1.664
161 2HB GLU 22 1HB GLU 22 -10.818 -5.592 -3.166
162 1HG GLU 22 2HG GLU 22 -9.477 -6.873 -4.368
163 2HG GLU 22 1HG GLU 22 -8.069 -6.315 -3.463
164 H LYS 23 H LYS 23 -8.378 -3.115 -0.352
165 HA LYS 23 HA LYS 23 -5.751 -4.205 -0.174
166 1HB LYS 23 2HB LYS 23 -7.150 -1.955 0.876
167 2HB LYS 23 1HB LYS 23 -6.425 -2.821 2.220
168 1HG LYS 23 2HG LYS 23 -5.029 -1.691 -0.192
169 2HG LYS 23 1HG LYS 23 -4.889 -1.156 1.483
170 1HD LYS 23 2HD LYS 23 -3.067 -2.463 1.545
171 2HD LYS 23 1HD LYS 23 -4.208 -3.802 1.670
172 1HE LYS 23 2HE LYS 23 -4.026 -3.222 -1.061
173 2HE LYS 23 1HE LYS 23 -2.375 -3.142 -0.452
174 1HZ LYS 23 1HZ LYS 23 -4.222 -5.427 -0.511
175 2HZ LYS 23 2HZ LYS 23 -3.027 -5.366 0.685
176 3HZ LYS 23 3HZ LYS 23 -2.591 -5.357 -0.949
177 H GLY 24 H GLY 24 -4.882 -5.575 1.338
178 1HA GLY 24 2HA GLY 24 -6.843 -7.048 2.980
179 2HA GLY 24 1HA GLY 24 -5.401 -7.770 2.275
180 H GLU 25 H GLU 25 -4.465 -8.455 4.158
181 HA GLU 25 HA GLU 25 -3.980 -6.518 6.265
182 1HB GLU 25 2HB GLU 25 -4.621 -9.190 6.338
183 2HB GLU 25 1HB GLU 25 -2.886 -9.204 6.637
184 1HG GLU 25 2HG GLU 25 -3.074 -8.052 8.604
185 2HG GLU 25 1HG GLU 25 -4.603 -7.308 8.140
186 H THR 26 H THR 26 -2.444 -7.882 3.604
187 HA THR 26 HA THR 26 0.114 -6.735 4.463
188 HB THR 26 HB THR 26 1.043 -8.777 3.012
189 HG1 THR 26 1HG THR 26 -0.767 -9.899 2.629
190 1HG2 THR 26 1HG2 THR 26 1.874 -8.398 5.199
191 2HG2 THR 26 2HG2 THR 26 1.328 -10.073 5.126
192 3HG2 THR 26 3HG2 THR 26 0.336 -8.856 5.929
193 H MET 27 H MET 27 1.117 -5.549 3.012
194 HA MET 27 HA MET 27 0.489 -5.805 0.168
195 1HB MET 27 2HB MET 27 -0.945 -4.002 1.114
196 2HB MET 27 1HB MET 27 0.507 -3.156 1.630
197 1HG MET 27 2HG MET 27 -0.444 -2.262 -0.447
198 2HG MET 27 1HG MET 27 1.201 -2.860 -0.652
199 1HE MET 27 1HE MET 27 -2.019 -3.533 -3.405
200 2HE MET 27 2HE MET 27 -0.562 -2.546 -3.512
201 3HE MET 27 3HE MET 27 -1.716 -2.275 -2.208
202 H GLU 28 H GLU 28 2.118 -4.560 -1.168
203 HA GLU 28 HA GLU 28 4.708 -4.407 0.247
204 1HB GLU 28 2HB GLU 28 5.674 -5.151 -2.028
205 2HB GLU 28 1HB GLU 28 4.925 -6.358 -1.000
206 1HG GLU 28 2HG GLU 28 3.057 -5.121 -2.851
207 2HG GLU 28 1HG GLU 28 4.390 -5.953 -3.651
208 H VAL 29 H VAL 29 5.392 -2.406 0.240
209 HA VAL 29 HA VAL 29 4.575 -0.578 -1.877
210 HB VAL 29 HB VAL 29 5.735 -0.164 0.868
211 1HG1 VAL 29 1HG1 VAL 29 5.483 1.856 -1.347
212 2HG1 VAL 29 2HG1 VAL 29 6.914 1.450 -0.397
213 3HG1 VAL 29 3HG1 VAL 29 5.567 2.301 0.359
214 1HG2 VAL 29 1HG2 VAL 29 3.166 -0.403 -0.005
215 2HG2 VAL 29 2HG2 VAL 29 3.391 1.345 -0.008
216 3HG2 VAL 29 3HG2 VAL 29 3.665 0.423 1.471
217 H ILE 30 H ILE 30 5.923 0.382 -3.262
218 HA ILE 30 HA ILE 30 8.594 -0.722 -3.520
219 HB ILE 30 HB ILE 30 8.492 1.021 -5.568
220 1HG1 ILE 30 2HG1 ILE 30 6.060 1.548 -4.652
221 2HG1 ILE 30 1HG1 ILE 30 6.390 1.499 -6.372
222 1HG2 ILE 30 1HG2 ILE 30 7.557 -0.913 -6.913
223 2HG2 ILE 30 2HG2 ILE 30 7.401 -1.767 -5.378
224 3HG2 ILE 30 3HG2 ILE 30 8.988 -1.238 -5.936
225 1HD1 ILE 30 1HD1 ILE 30 4.336 0.348 -5.882
226 2HD1 ILE 30 2HD1 ILE 30 5.165 -0.701 -4.737
227 3HD1 ILE 30 3HD1 ILE 30 5.542 -0.799 -6.456
228 H GLU 31 H GLU 31 7.563 2.621 -4.141
229 HA GLU 31 HA GLU 31 10.052 3.682 -3.285
230 1HB GLU 31 2HB GLU 31 8.477 4.715 -4.973
231 2HB GLU 31 1HB GLU 31 7.465 5.202 -3.621
232 1HG GLU 31 2HG GLU 31 10.242 5.981 -3.277
233 2HG GLU 31 1HG GLU 31 9.516 6.657 -4.734
234 H LYS 32 H LYS 32 10.727 4.015 -1.281
235 HA LYS 32 HA LYS 32 8.744 4.134 0.875
236 1HB LYS 32 2HB LYS 32 11.424 3.014 0.615
237 2HB LYS 32 1HB LYS 32 11.245 3.991 2.063
238 1HG LYS 32 2HG LYS 32 10.768 1.568 2.376
239 2HG LYS 32 1HG LYS 32 9.453 2.642 2.854
240 1HD LYS 32 2HD LYS 32 8.279 1.075 1.668
241 2HD LYS 32 1HD LYS 32 8.657 2.211 0.374
242 1HE LYS 32 2HE LYS 32 9.903 -0.446 0.979
243 2HE LYS 32 1HE LYS 32 9.186 0.126 -0.526
244 1HZ LYS 32 1HZ LYS 32 11.582 0.060 -0.691
245 2HZ LYS 32 2HZ LYS 32 11.742 1.071 0.655
246 3HZ LYS 32 3HZ LYS 32 11.047 1.665 -0.769
247 HA PRO 33 HA PRO 33 9.616 8.406 1.580
248 1HB PRO 33 2HB PRO 33 8.944 8.151 4.390
249 2HB PRO 33 1HB PRO 33 7.995 8.865 3.088
250 1HG PRO 33 2HG PRO 33 7.304 6.554 4.358
251 2HG PRO 33 1HG PRO 33 6.851 6.924 2.685
252 1HD PRO 33 2HD PRO 33 9.065 5.186 3.709
253 2HD PRO 33 1HD PRO 33 7.956 4.918 2.347
254 H GLU 34 H GLU 34 11.999 7.161 1.513
255 HA GLU 34 HA GLU 34 13.390 7.560 4.030
256 1HB GLU 34 2HB GLU 34 15.383 6.770 2.704
257 2HB GLU 34 1HB GLU 34 14.061 5.618 2.832
258 1HG GLU 34 2HG GLU 34 13.447 5.879 0.614
259 2HG GLU 34 1HG GLU 34 14.265 7.433 0.468
260 H ASN 35 H ASN 35 13.149 9.037 0.853
261 HA ASN 35 HA ASN 35 14.932 11.194 1.771
262 1HB ASN 35 2HB ASN 35 14.858 9.705 -0.679
263 2HB ASN 35 1HB ASN 35 14.523 11.398 -1.028
264 1HD2 ASN 35 1HD2 ASN 35 16.589 11.180 -2.180
265 2HD2 ASN 35 2HD2 ASN 35 18.051 11.444 -1.297
266 H ASP 36 H ASP 36 11.861 10.442 0.223
267 HA ASP 36 HA ASP 36 11.041 13.237 0.673
268 1HB ASP 36 2HB ASP 36 11.186 11.920 -1.781
269 2HB ASP 36 1HB ASP 36 9.474 11.884 -1.367
270 HA PRO 37 HA PRO 37 8.159 10.818 3.233
271 1HB PRO 37 2HB PRO 37 7.722 13.313 4.665
272 2HB PRO 37 1HB PRO 37 8.446 11.814 5.247
273 1HG PRO 37 2HG PRO 37 9.863 14.105 4.883
274 2HG PRO 37 1HG PRO 37 10.574 12.488 4.728
275 1HD PRO 37 2HD PRO 37 9.649 14.367 2.585
276 2HD PRO 37 1HD PRO 37 11.102 13.345 2.638
277 H GLU 38 H GLU 38 7.146 11.364 0.854
278 HA GLU 38 HA GLU 38 4.868 13.162 1.246
279 1HB GLU 38 2HB GLU 38 4.623 12.597 -1.329
280 2HB GLU 38 1HB GLU 38 5.739 13.824 -0.754
281 1HG GLU 38 2HG GLU 38 7.583 12.590 -1.250
282 2HG GLU 38 1HG GLU 38 6.754 11.052 -1.023
283 H TRP 39 H TRP 39 4.935 10.417 -0.975
284 HA TRP 39 HA TRP 39 3.117 8.884 0.689
285 1HB TRP 39 2HB TRP 39 2.197 9.554 -2.091
286 2HB TRP 39 1HB TRP 39 1.259 8.922 -0.745
287 HD1 TRP 39 HD TRP 39 0.586 10.723 1.206
288 HE1 TRP 39 1HE TRP 39 0.207 13.266 1.055
289 HE3 TRP 39 3HE TRP 39 2.933 11.632 -3.243
290 HZ2 TRP 39 2HZ TRP 39 0.823 15.376 -0.716
291 HZ3 TRP 39 3HZ TRP 39 2.993 13.940 -4.097
292 HH2 TRP 39 HH TRP 39 1.959 15.772 -2.859
293 H TRP 40 H TRP 40 2.828 6.708 -0.045
294 HA TRP 40 HA TRP 40 4.808 5.927 -2.075
295 1HB TRP 40 2HB TRP 40 5.020 3.771 -0.903
296 2HB TRP 40 1HB TRP 40 5.491 5.131 0.103
297 HD1 TRP 40 HD TRP 40 1.974 3.551 -0.418
298 HE1 TRP 40 1HE TRP 40 1.039 2.931 1.903
299 HE3 TRP 40 3HE TRP 40 5.966 4.926 2.440
300 HZ2 TRP 40 2HZ TRP 40 1.913 3.011 4.594
301 HZ3 TRP 40 3HZ TRP 40 5.846 4.625 4.876
302 HH2 TRP 40 HH TRP 40 3.855 3.687 5.931
303 H LYS 41 H LYS 41 4.287 3.661 -2.979
304 HA LYS 41 HA LYS 41 1.450 3.244 -3.381
305 1HB LYS 41 2HB LYS 41 1.891 3.039 -5.891
306 2HB LYS 41 1HB LYS 41 1.742 4.652 -5.209
307 1HG LYS 41 2HG LYS 41 3.552 4.832 -6.602
308 2HG LYS 41 1HG LYS 41 4.306 4.569 -5.039
309 1HD LYS 41 2HD LYS 41 5.485 3.078 -6.307
310 2HD LYS 41 1HD LYS 41 4.151 2.061 -5.793
311 1HE LYS 41 2HE LYS 41 4.963 2.739 -8.435
312 2HE LYS 41 1HE LYS 41 3.713 1.610 -7.910
313 1HZ LYS 41 1HZ LYS 41 3.419 4.498 -8.527
314 2HZ LYS 41 2HZ LYS 41 2.225 3.616 -7.717
315 3HZ LYS 41 3HZ LYS 41 2.669 3.188 -9.290
316 H CYS 42 H CYS 42 0.871 1.157 -3.783
317 HA CYS 42 HA CYS 42 3.049 -0.772 -4.134
318 1HB CYS 42 2HB CYS 42 1.207 -2.136 -2.572
319 2HB CYS 42 1HB CYS 42 2.725 -1.459 -2.002
320 HG CYS 42 HG CYS 42 1.164 -0.354 -0.424
321 H LYS 43 H LYS 43 2.342 -2.851 -5.001
322 HA LYS 43 HA LYS 43 0.163 -2.484 -6.903
323 1HB LYS 43 2HB LYS 43 1.061 -4.674 -7.837
324 2HB LYS 43 1HB LYS 43 2.126 -3.278 -7.936
325 1HG LYS 43 2HG LYS 43 2.435 -4.906 -5.512
326 2HG LYS 43 1HG LYS 43 2.867 -5.710 -7.021
327 1HD LYS 43 2HD LYS 43 4.058 -3.304 -7.371
328 2HD LYS 43 1HD LYS 43 4.177 -3.477 -5.619
329 1HE LYS 43 2HE LYS 43 5.668 -5.158 -5.759
330 2HE LYS 43 1HE LYS 43 4.874 -5.882 -7.157
331 1HZ LYS 43 1HZ LYS 43 5.857 -3.719 -8.290
332 2HZ LYS 43 2HZ LYS 43 6.753 -5.148 -8.152
333 3HZ LYS 43 3HZ LYS 43 6.999 -3.886 -7.052
334 H ASN 44 H ASN 44 -1.600 -3.754 -7.103
335 HA ASN 44 HA ASN 44 -2.109 -5.630 -4.887
336 1HB ASN 44 2HB ASN 44 -3.392 -3.318 -5.086
337 2HB ASN 44 1HB ASN 44 -4.371 -4.232 -6.229
338 1HD2 ASN 44 1HD2 ASN 44 -5.861 -5.608 -5.476
339 2HD2 ASN 44 2HD2 ASN 44 -6.115 -5.971 -3.807
340 H ALA 45 H ALA 45 -4.081 -7.048 -5.480
341 HA ALA 45 HA ALA 45 -3.277 -8.646 -7.629
342 1HB ALA 45 1HB ALA 45 -6.053 -9.031 -6.836
343 2HB ALA 45 2HB ALA 45 -4.944 -8.949 -5.467
344 3HB ALA 45 3HB ALA 45 -4.684 -10.139 -6.742
345 H ARG 46 H ARG 46 -5.029 -5.770 -7.641
346 HA ARG 46 HA ARG 46 -6.624 -6.354 -9.982
347 1HB ARG 46 2HB ARG 46 -6.043 -3.643 -8.793
348 2HB ARG 46 1HB ARG 46 -7.404 -4.093 -9.805
349 1HG ARG 46 2HG ARG 46 -6.903 -4.758 -6.926
350 2HG ARG 46 1HG ARG 46 -8.264 -3.895 -7.639
351 1HD ARG 46 2HD ARG 46 -9.388 -5.808 -7.707
352 2HD ARG 46 1HD ARG 46 -8.216 -6.417 -8.874
353 HE ARG 46 HE ARG 46 -7.003 -6.865 -6.503
354 1HH1 ARG 46 1HH1 ARG 46 -10.171 -7.645 -7.743
355 2HH1 ARG 46 2HH1 ARG 46 -10.330 -9.078 -6.785
356 1HH2 ARG 46 1HH2 ARG 46 -7.212 -8.751 -5.240
357 2HH2 ARG 46 2HH2 ARG 46 -8.651 -9.708 -5.364
358 H GLY 47 H GLY 47 -3.411 -5.927 -9.536
359 1HA GLY 47 2HA GLY 47 -1.694 -5.512 -11.003
360 2HA GLY 47 1HA GLY 47 -2.897 -5.376 -12.278
361 H GLN 48 H GLN 48 -3.671 -3.322 -9.749
362 HA GLN 48 HA GLN 48 -2.362 -1.056 -11.084
363 1HB GLN 48 2HB GLN 48 -4.424 0.174 -9.979
364 2HB GLN 48 1HB GLN 48 -4.530 -0.584 -11.555
365 1HG GLN 48 2HG GLN 48 -5.517 -2.572 -10.536
366 2HG GLN 48 1HG GLN 48 -5.430 -1.792 -8.958
367 1HE2 GLN 48 1HE2 GLN 48 -7.734 -2.150 -8.893
368 2HE2 GLN 48 2HE2 GLN 48 -8.794 -1.036 -9.678
369 H VAL 49 H VAL 49 -0.834 -0.206 -9.903
370 HA VAL 49 HA VAL 49 -1.170 -0.212 -6.984
371 HB VAL 49 HB VAL 49 0.909 -1.140 -7.186
372 1HG1 VAL 49 1HG1 VAL 49 2.538 -0.603 -8.923
373 2HG1 VAL 49 2HG1 VAL 49 1.349 0.483 -9.644
374 3HG1 VAL 49 3HG1 VAL 49 1.017 -1.246 -9.542
375 1HG2 VAL 49 1HG2 VAL 49 2.567 0.417 -6.590
376 2HG2 VAL 49 2HG2 VAL 49 1.045 1.100 -6.023
377 3HG2 VAL 49 3HG2 VAL 49 1.785 1.705 -7.503
378 H GLY 50 H GLY 50 -1.400 1.636 -5.956
379 1HA GLY 50 2HA GLY 50 -0.760 4.119 -7.368
380 2HA GLY 50 1HA GLY 50 -2.385 3.885 -6.743
381 H LEU 51 H LEU 51 -1.677 5.909 -5.660
382 HA LEU 51 HA LEU 51 0.166 5.635 -3.495
383 1HB LEU 51 2HB LEU 51 -1.443 7.766 -4.730
384 2HB LEU 51 1HB LEU 51 -1.076 7.976 -3.033
385 HG LEU 51 HG LEU 51 1.172 8.249 -3.410
386 1HD1 LEU 51 1HD1 LEU 51 2.105 7.524 -5.777
387 2HD1 LEU 51 2HD1 LEU 51 0.767 6.383 -5.664
388 3HD1 LEU 51 3HD1 LEU 51 2.013 6.406 -4.417
389 1HD2 LEU 51 1HD2 LEU 51 1.328 9.975 -4.858
390 2HD2 LEU 51 2HD2 LEU 51 -0.428 9.802 -4.859
391 3HD2 LEU 51 3HD2 LEU 51 0.529 9.091 -6.159
392 H VAL 52 H VAL 52 -0.373 4.426 -1.841
393 HA VAL 52 HA VAL 52 -3.124 4.323 -0.886
394 HB VAL 52 HB VAL 52 -2.141 2.174 -1.030
395 1HG1 VAL 52 1HG1 VAL 52 0.235 3.502 0.164
396 2HG1 VAL 52 2HG1 VAL 52 0.125 2.485 -1.271
397 3HG1 VAL 52 3HG1 VAL 52 0.035 1.761 0.336
398 1HG2 VAL 52 1HG2 VAL 52 -2.333 3.206 1.771
399 2HG2 VAL 52 2HG2 VAL 52 -1.702 1.584 1.500
400 3HG2 VAL 52 3HG2 VAL 52 -3.316 2.004 0.936
401 HA PRO 53 HA PRO 53 -2.644 7.148 2.515
402 1HB PRO 53 2HB PRO 53 -4.199 5.884 4.349
403 2HB PRO 53 1HB PRO 53 -4.891 6.722 2.950
404 1HG PRO 53 2HG PRO 53 -4.125 3.811 3.177
405 2HG PRO 53 1HG PRO 53 -5.733 4.485 2.767
406 1HD PRO 53 2HD PRO 53 -4.189 3.756 0.804
407 2HD PRO 53 1HD PRO 53 -4.891 5.389 0.720
408 H LYS 54 H LYS 54 -0.374 6.616 2.842
409 HA LYS 54 HA LYS 54 0.630 4.424 4.149
410 1HB LYS 54 2HB LYS 54 2.487 5.976 4.870
411 2HB LYS 54 1HB LYS 54 2.140 5.876 3.147
412 1HG LYS 54 2HG LYS 54 2.037 8.069 3.155
413 2HG LYS 54 1HG LYS 54 0.513 7.921 4.019
414 1HD LYS 54 2HD LYS 54 1.613 8.121 6.135
415 2HD LYS 54 1HD LYS 54 3.204 8.053 5.371
416 1HE LYS 54 2HE LYS 54 1.622 10.161 4.215
417 2HE LYS 54 1HE LYS 54 1.687 10.335 5.968
418 1HZ LYS 54 1HZ LYS 54 3.517 11.433 4.637
419 2HZ LYS 54 2HZ LYS 54 4.121 9.879 4.349
420 3HZ LYS 54 3HZ LYS 54 4.009 10.462 5.933
421 H ASN 55 H ASN 55 -1.147 7.063 5.476
422 HA ASN 55 HA ASN 55 -0.343 6.569 8.205
423 1HB ASN 55 2HB ASN 55 -1.366 8.754 6.924
424 2HB ASN 55 1HB ASN 55 -2.794 8.124 7.738
425 1HD2 ASN 55 1HD2 ASN 55 -2.149 10.479 8.569
426 2HD2 ASN 55 2HD2 ASN 55 -1.323 10.461 10.086
427 H TYR 56 H TYR 56 -2.384 5.047 6.072
428 HA TYR 56 HA TYR 56 -4.195 4.125 8.203
429 1HB TYR 56 2HB TYR 56 -4.496 3.990 5.195
430 2HB TYR 56 1HB TYR 56 -5.639 3.315 6.347
431 HD1 TYR 56 1HD TYR 56 -6.683 5.093 4.393
432 HD2 TYR 56 2HD TYR 56 -4.773 6.056 8.069
433 HE1 TYR 56 1HE TYR 56 -7.891 7.233 4.452
434 HE2 TYR 56 2HE TYR 56 -5.977 8.200 8.142
435 HH TYR 56 HH TYR 56 -8.003 9.208 7.224
436 H VAL 57 H VAL 57 -1.369 3.260 7.466
437 HA VAL 57 HA VAL 57 -1.923 0.401 7.588
438 HB VAL 57 HB VAL 57 -0.918 -0.261 5.650
439 1HG1 VAL 57 1HG1 VAL 57 -1.599 2.554 4.817
440 2HG1 VAL 57 2HG1 VAL 57 -2.778 1.262 5.029
441 3HG1 VAL 57 3HG1 VAL 57 -1.534 1.126 3.786
442 1HG2 VAL 57 1HG2 VAL 57 1.277 0.427 5.860
443 2HG2 VAL 57 2HG2 VAL 57 0.839 2.130 6.003
444 3HG2 VAL 57 3HG2 VAL 57 0.753 1.327 4.434
445 H VAL 58 H VAL 58 0.290 -0.798 7.647
446 HA VAL 58 HA VAL 58 2.271 0.729 9.183
447 HB VAL 58 HB VAL 58 0.990 -0.453 10.864
448 1HG1 VAL 58 1HG1 VAL 58 0.114 -2.489 10.627
449 2HG1 VAL 58 2HG1 VAL 58 1.629 -3.170 10.038
450 3HG1 VAL 58 3HG1 VAL 58 0.543 -2.339 8.924
451 1HG2 VAL 58 1HG2 VAL 58 2.736 -1.701 11.937
452 2HG2 VAL 58 2HG2 VAL 58 3.466 -0.342 11.081
453 3HG2 VAL 58 3HG2 VAL 58 3.555 -1.966 10.398
454 H VAL 59 H VAL 59 4.073 0.634 8.013
455 HA VAL 59 HA VAL 59 4.481 -1.204 5.934
456 HB VAL 59 HB VAL 59 6.638 0.445 7.229
457 1HG1 VAL 59 1HG1 VAL 59 7.314 0.335 4.665
458 2HG1 VAL 59 2HG1 VAL 59 6.383 -1.159 4.738
459 3HG1 VAL 59 3HG1 VAL 59 7.772 -0.936 5.800
460 1HG2 VAL 59 1HG2 VAL 59 5.362 1.415 4.766
461 2HG2 VAL 59 2HG2 VAL 59 5.891 2.302 6.195
462 3HG2 VAL 59 3HG2 VAL 59 4.338 1.468 6.201
463 H LEU 60 H LEU 60 5.900 -2.816 5.615
464 HA LEU 60 HA LEU 60 6.785 -4.262 7.977
465 1HB LEU 60 2HB LEU 60 5.375 -5.042 5.625
466 2HB LEU 60 1HB LEU 60 6.935 -5.843 5.613
467 HG LEU 60 HG LEU 60 6.493 -6.927 7.692
468 1HD1 LEU 60 1HD1 LEU 60 5.401 -5.653 9.186
469 2HD1 LEU 60 2HD1 LEU 60 3.967 -6.435 8.520
470 3HD1 LEU 60 3HD1 LEU 60 4.445 -4.837 7.948
471 1HD2 LEU 60 1HD2 LEU 60 5.177 -7.505 5.423
472 2HD2 LEU 60 2HD2 LEU 60 3.810 -7.250 6.508
473 3HD2 LEU 60 3HD2 LEU 60 5.033 -8.458 6.901
474 H SER 61 H SER 61 8.775 -5.494 7.632
475 HA SER 61 HA SER 61 10.645 -4.888 5.619
476 1HB SER 61 2HB SER 61 12.245 -3.555 6.996
477 2HB SER 61 1HB SER 61 10.748 -2.692 6.641
478 HG SER 61 HG SER 61 10.023 -3.214 8.728
Start of MODEL 8
1 1H GLY 1 1HT GLY 1 14.732 -9.218 3.357
2 2H GLY 1 2HT GLY 1 15.275 -7.667 2.956
3 3H GLY 1 3HT GLY 1 16.374 -8.948 3.051
4 1HA GLY 1 1HA GLY 1 16.129 -8.889 0.810
5 2HA GLY 1 2HA GLY 1 14.829 -9.992 1.234
6 H SER 2 H SER 2 12.735 -9.409 0.872
7 HA SER 2 HA SER 2 12.338 -7.043 -0.769
8 1HB SER 2 2HB SER 2 11.045 -9.621 -0.480
9 2HB SER 2 1HB SER 2 9.855 -8.314 -0.405
10 HG SER 2 HG SER 2 10.987 -9.315 -2.549
11 H HIS 3 H HIS 3 11.488 -5.189 -0.063
12 HA HIS 3 HA HIS 3 10.641 -4.992 2.696
13 1HB HIS 3 2HB HIS 3 10.073 -2.540 1.749
14 2HB HIS 3 1HB HIS 3 11.679 -3.016 2.272
15 HD1 HIS 3 1HD HIS 3 13.342 -2.101 0.694
16 HD2 HIS 3 2HD HIS 3 9.901 -3.366 -1.261
17 HE1 HIS 3 1HE HIS 3 13.773 -1.699 -1.751
18 HE2 HIS 3 2HE HIS 3 11.708 -2.545 -2.921
19 H VAL 4 H VAL 4 8.627 -5.185 3.382
20 HA VAL 4 HA VAL 4 6.465 -4.828 1.409
21 HB VAL 4 HB VAL 4 5.801 -6.760 3.480
22 1HG1 VAL 4 1HG1 VAL 4 5.908 -7.268 0.529
23 2HG1 VAL 4 2HG1 VAL 4 4.693 -6.188 1.213
24 3HG1 VAL 4 3HG1 VAL 4 4.761 -7.875 1.722
25 1HG2 VAL 4 1HG2 VAL 4 8.056 -7.470 3.448
26 2HG2 VAL 4 2HG2 VAL 4 8.151 -7.326 1.692
27 3HG2 VAL 4 3HG2 VAL 4 7.171 -8.598 2.421
28 H VAL 5 H VAL 5 4.297 -4.589 2.514
29 HA VAL 5 HA VAL 5 4.588 -3.248 5.091
30 HB VAL 5 HB VAL 5 4.377 -1.295 4.114
31 1HG1 VAL 5 1HG1 VAL 5 4.785 -1.351 1.964
32 2HG1 VAL 5 2HG1 VAL 5 3.042 -1.324 1.725
33 3HG1 VAL 5 3HG1 VAL 5 3.903 -2.857 1.743
34 1HG2 VAL 5 1HG2 VAL 5 2.071 -0.535 3.539
35 2HG2 VAL 5 2HG2 VAL 5 2.245 -1.291 5.123
36 3HG2 VAL 5 3HG2 VAL 5 1.538 -2.198 3.787
37 H GLN 6 H GLN 6 2.851 -3.216 6.422
38 HA GLN 6 HA GLN 6 0.844 -5.290 5.835
39 1HB GLN 6 2HB GLN 6 2.435 -5.523 7.811
40 2HB GLN 6 1HB GLN 6 1.579 -4.176 8.541
41 1HG GLN 6 2HG GLN 6 0.164 -5.631 9.408
42 2HG GLN 6 1HG GLN 6 -0.409 -5.963 7.777
43 1HE2 GLN 6 1HE2 GLN 6 1.852 -7.226 6.758
44 2HE2 GLN 6 2HE2 GLN 6 2.043 -8.747 7.554
45 H THR 7 H THR 7 -1.364 -4.841 6.023
46 HA THR 7 HA THR 7 -1.953 -1.992 6.506
47 HB THR 7 HB THR 7 -4.106 -2.694 5.167
48 HG1 THR 7 1HG THR 7 -3.733 -4.792 4.751
49 1HG2 THR 7 1HG2 THR 7 -2.821 -0.978 4.258
50 2HG2 THR 7 2HG2 THR 7 -2.817 -2.221 3.007
51 3HG2 THR 7 3HG2 THR 7 -1.413 -2.016 4.053
52 H LEU 8 H LEU 8 -3.921 -1.423 7.452
53 HA LEU 8 HA LEU 8 -5.217 -3.511 9.042
54 1HB LEU 8 2HB LEU 8 -5.372 -1.286 10.638
55 2HB LEU 8 1HB LEU 8 -4.312 -2.650 10.884
56 HG LEU 8 HG LEU 8 -3.091 -0.582 11.129
57 1HD1 LEU 8 1HD1 LEU 8 -2.013 -1.396 8.528
58 2HD1 LEU 8 2HD1 LEU 8 -2.256 -2.702 9.690
59 3HD1 LEU 8 3HD1 LEU 8 -1.242 -1.322 10.112
60 1HD2 LEU 8 1HD2 LEU 8 -2.986 1.117 9.572
61 2HD2 LEU 8 2HD2 LEU 8 -4.680 0.628 9.507
62 3HD2 LEU 8 3HD2 LEU 8 -3.557 0.085 8.265
63 H TYR 9 H TYR 9 -5.397 -0.252 7.675
64 HA TYR 9 HA TYR 9 -8.332 -0.478 7.685
65 1HB TYR 9 2HB TYR 9 -6.523 1.804 8.264
66 2HB TYR 9 1HB TYR 9 -7.980 2.169 7.347
67 HD1 TYR 9 1HD TYR 9 -6.897 2.678 10.389
68 HD2 TYR 9 2HD TYR 9 -9.936 0.337 8.547
69 HE1 TYR 9 1HE TYR 9 -8.193 2.727 12.478
70 HE2 TYR 9 2HE TYR 9 -11.240 0.381 10.631
71 HH TYR 9 HH TYR 9 -10.932 0.726 12.991
72 HA PRO 10 HA PRO 10 -8.263 -0.470 3.270
73 1HB PRO 10 2HB PRO 10 -10.694 1.205 3.348
74 2HB PRO 10 1HB PRO 10 -10.460 -0.405 2.663
75 1HG PRO 10 2HG PRO 10 -11.855 -0.042 4.916
76 2HG PRO 10 1HG PRO 10 -10.822 -1.465 4.685
77 1HD PRO 10 2HD PRO 10 -10.305 1.020 6.274
78 2HD PRO 10 1HD PRO 10 -9.927 -0.670 6.667
79 H PHE 11 H PHE 11 -8.179 0.915 1.396
80 HA PHE 11 HA PHE 11 -7.426 3.686 2.042
81 1HB PHE 11 2HB PHE 11 -6.018 3.438 -0.156
82 2HB PHE 11 1HB PHE 11 -5.388 2.833 1.369
83 HD1 PHE 11 1HD PHE 11 -3.899 1.221 0.504
84 HD2 PHE 11 2HD PHE 11 -7.990 1.158 -0.644
85 HE1 PHE 11 1HE PHE 11 -3.576 -0.993 -0.512
86 HE2 PHE 11 2HE PHE 11 -7.676 -1.050 -1.652
87 HZ PHE 11 HZ PHE 11 -5.469 -2.135 -1.593
88 H SER 12 H SER 12 -7.898 5.301 0.450
89 HA SER 12 HA SER 12 -10.016 4.499 -1.445
90 1HB SER 12 2HB SER 12 -10.168 6.289 0.805
91 2HB SER 12 1HB SER 12 -10.466 7.188 -0.684
92 HG SER 12 HG SER 12 -12.386 6.355 -0.586
93 H SER 13 H SER 13 -9.931 5.308 -3.450
94 HA SER 13 HA SER 13 -7.532 6.686 -4.266
95 1HB SER 13 2HB SER 13 -9.175 4.842 -5.473
96 2HB SER 13 1HB SER 13 -9.645 6.342 -6.274
97 HG SER 13 HG SER 13 -7.937 5.428 -7.390
98 H VAL 14 H VAL 14 -7.657 8.575 -5.742
99 HA VAL 14 HA VAL 14 -9.915 10.249 -5.857
100 HB VAL 14 HB VAL 14 -9.724 10.757 -3.587
101 1HG1 VAL 14 1HG1 VAL 14 -7.572 9.647 -3.239
102 2HG1 VAL 14 2HG1 VAL 14 -7.648 11.216 -2.436
103 3HG1 VAL 14 3HG1 VAL 14 -6.750 11.038 -3.944
104 1HG2 VAL 14 1HG2 VAL 14 -9.248 13.055 -3.508
105 2HG2 VAL 14 2HG2 VAL 14 -9.706 12.751 -5.183
106 3HG2 VAL 14 3HG2 VAL 14 -8.005 12.929 -4.753
107 H THR 15 H THR 15 -6.388 10.137 -5.742
108 HA THR 15 HA THR 15 -6.203 12.232 -7.769
109 HB THR 15 HB THR 15 -3.822 10.815 -6.634
110 HG1 THR 15 1HG THR 15 -3.907 12.207 -4.845
111 1HG2 THR 15 1HG2 THR 15 -4.399 13.510 -7.745
112 2HG2 THR 15 2HG2 THR 15 -3.048 12.421 -8.059
113 3HG2 THR 15 3HG2 THR 15 -3.115 13.330 -6.549
114 H GLU 16 H GLU 16 -4.406 11.814 -9.470
115 HA GLU 16 HA GLU 16 -5.279 9.695 -11.117
116 1HB GLU 16 2HB GLU 16 -4.410 11.217 -12.525
117 2HB GLU 16 1HB GLU 16 -3.388 11.911 -11.278
118 1HG GLU 16 2HG GLU 16 -2.039 11.102 -13.096
119 2HG GLU 16 1HG GLU 16 -1.743 10.133 -11.654
120 H GLU 17 H GLU 17 -2.512 10.061 -8.964
121 HA GLU 17 HA GLU 17 -1.402 7.501 -9.747
122 1HB GLU 17 2HB GLU 17 -0.505 9.035 -7.331
123 2HB GLU 17 1HB GLU 17 0.435 8.008 -8.405
124 1HG GLU 17 2HG GLU 17 0.015 9.779 -10.189
125 2HG GLU 17 1HG GLU 17 -0.519 10.812 -8.864
126 H GLU 18 H GLU 18 -3.922 8.426 -7.835
127 HA GLU 18 HA GLU 18 -3.564 6.638 -5.620
128 1HB GLU 18 2HB GLU 18 -5.392 8.700 -6.423
129 2HB GLU 18 1HB GLU 18 -6.283 7.288 -5.893
130 1HG GLU 18 2HG GLU 18 -5.741 9.059 -4.153
131 2HG GLU 18 1HG GLU 18 -5.407 7.378 -3.744
132 H LEU 19 H LEU 19 -5.396 5.015 -5.160
133 HA LEU 19 HA LEU 19 -6.620 3.809 -7.466
134 1HB LEU 19 2HB LEU 19 -4.061 2.885 -6.566
135 2HB LEU 19 1HB LEU 19 -5.253 1.629 -6.328
136 HG LEU 19 HG LEU 19 -5.901 2.240 -8.801
137 1HD1 LEU 19 1HD1 LEU 19 -3.579 3.803 -8.430
138 2HD1 LEU 19 2HD1 LEU 19 -4.545 3.595 -9.887
139 3HD1 LEU 19 3HD1 LEU 19 -3.193 2.510 -9.563
140 1HD2 LEU 19 1HD2 LEU 19 -5.189 0.057 -7.992
141 2HD2 LEU 19 2HD2 LEU 19 -3.506 0.576 -8.080
142 3HD2 LEU 19 3HD2 LEU 19 -4.463 0.431 -9.553
143 H ASN 20 H ASN 20 -8.031 2.070 -6.967
144 HA ASN 20 HA ASN 20 -8.589 1.641 -4.129
145 1HB ASN 20 2HB ASN 20 -10.213 3.277 -4.557
146 2HB ASN 20 1HB ASN 20 -10.522 2.689 -6.182
147 1HD2 ASN 20 1HD2 ASN 20 -10.674 1.540 -2.829
148 2HD2 ASN 20 2HD2 ASN 20 -12.189 0.726 -2.997
149 H PHE 21 H PHE 21 -8.038 -0.395 -4.026
150 HA PHE 21 HA PHE 21 -9.432 -2.339 -5.724
151 1HB PHE 21 2HB PHE 21 -7.143 -3.708 -5.292
152 2HB PHE 21 1HB PHE 21 -7.450 -2.758 -6.731
153 HD1 PHE 21 1HD PHE 21 -5.254 -2.244 -7.328
154 HD2 PHE 21 2HD PHE 21 -6.615 -1.391 -3.394
155 HE1 PHE 21 1HE PHE 21 -3.208 -0.947 -6.905
156 HE2 PHE 21 2HE PHE 21 -4.574 -0.077 -2.971
157 HZ PHE 21 HZ PHE 21 -2.868 0.141 -4.727
158 H GLU 22 H GLU 22 -9.383 -4.596 -4.709
159 HA GLU 22 HA GLU 22 -10.450 -4.411 -2.113
160 1HB GLU 22 2HB GLU 22 -9.492 -6.750 -3.744
161 2HB GLU 22 1HB GLU 22 -10.163 -6.956 -2.134
162 1HG GLU 22 2HG GLU 22 -12.035 -7.279 -3.378
163 2HG GLU 22 1HG GLU 22 -12.135 -5.536 -3.137
164 H LYS 23 H LYS 23 -9.246 -3.641 -0.557
165 HA LYS 23 HA LYS 23 -6.472 -4.151 -0.209
166 1HB LYS 23 2HB LYS 23 -7.021 -2.103 0.643
167 2HB LYS 23 1HB LYS 23 -8.585 -2.635 1.224
168 1HG LYS 23 2HG LYS 23 -7.404 -2.186 3.165
169 2HG LYS 23 1HG LYS 23 -7.250 -3.932 3.008
170 1HD LYS 23 2HD LYS 23 -5.112 -3.047 3.598
171 2HD LYS 23 1HD LYS 23 -5.024 -3.556 1.911
172 1HE LYS 23 2HE LYS 23 -4.070 -1.493 1.717
173 2HE LYS 23 1HE LYS 23 -5.759 -1.035 1.517
174 1HZ LYS 23 1HZ LYS 23 -5.796 0.034 3.470
175 2HZ LYS 23 2HZ LYS 23 -4.119 0.106 3.271
176 3HZ LYS 23 3HZ LYS 23 -4.803 -1.091 4.250
177 H GLY 24 H GLY 24 -5.399 -5.342 1.264
178 1HA GLY 24 2HA GLY 24 -6.978 -7.309 2.799
179 2HA GLY 24 1HA GLY 24 -5.440 -7.698 2.033
180 H GLU 25 H GLU 25 -4.748 -8.340 4.206
181 HA GLU 25 HA GLU 25 -4.286 -6.152 6.067
182 1HB GLU 25 2HB GLU 25 -3.810 -9.122 6.381
183 2HB GLU 25 1HB GLU 25 -3.586 -7.915 7.639
184 1HG GLU 25 2HG GLU 25 -6.131 -7.401 6.979
185 2HG GLU 25 1HG GLU 25 -6.059 -9.115 6.575
186 H THR 26 H THR 26 -2.820 -7.012 3.399
187 HA THR 26 HA THR 26 -0.209 -6.237 4.364
188 HB THR 26 HB THR 26 0.579 -8.325 2.829
189 HG1 THR 26 1HG THR 26 -0.873 -9.817 2.808
190 1HG2 THR 26 1HG2 THR 26 0.159 -8.228 5.794
191 2HG2 THR 26 2HG2 THR 26 1.647 -7.953 4.889
192 3HG2 THR 26 3HG2 THR 26 0.958 -9.574 4.984
193 H MET 27 H MET 27 0.862 -5.088 2.941
194 HA MET 27 HA MET 27 0.291 -5.301 0.090
195 1HB MET 27 2HB MET 27 -0.392 -3.147 -0.221
196 2HB MET 27 1HB MET 27 -0.969 -3.348 1.426
197 1HG MET 27 2HG MET 27 1.491 -2.458 1.942
198 2HG MET 27 1HG MET 27 1.245 -1.704 0.371
199 1HE MET 27 1HE MET 27 -1.648 -1.486 0.227
200 2HE MET 27 2HE MET 27 -1.240 0.226 0.135
201 3HE MET 27 3HE MET 27 -2.443 -0.333 1.296
202 H GLU 28 H GLU 28 2.031 -4.094 -1.191
203 HA GLU 28 HA GLU 28 4.551 -4.065 0.352
204 1HB GLU 28 2HB GLU 28 5.667 -4.915 -1.728
205 2HB GLU 28 1HB GLU 28 4.581 -6.051 -0.951
206 1HG GLU 28 2HG GLU 28 2.860 -5.578 -2.593
207 2HG GLU 28 1HG GLU 28 3.908 -4.388 -3.361
208 H VAL 29 H VAL 29 5.249 -2.086 0.437
209 HA VAL 29 HA VAL 29 4.620 -0.182 -1.660
210 HB VAL 29 HB VAL 29 5.722 0.094 1.122
211 1HG1 VAL 29 1HG1 VAL 29 6.978 1.749 0.112
212 2HG1 VAL 29 2HG1 VAL 29 5.520 2.619 0.589
213 3HG1 VAL 29 3HG1 VAL 29 5.733 2.105 -1.084
214 1HG2 VAL 29 1HG2 VAL 29 3.168 -0.032 0.207
215 2HG2 VAL 29 2HG2 VAL 29 3.449 1.709 0.236
216 3HG2 VAL 29 3HG2 VAL 29 3.665 0.756 1.704
217 H ILE 30 H ILE 30 6.026 0.660 -3.028
218 HA ILE 30 HA ILE 30 8.771 -0.382 -2.993
219 HB ILE 30 HB ILE 30 8.657 0.661 -5.426
220 1HG1 ILE 30 2HG1 ILE 30 6.173 1.345 -4.683
221 2HG1 ILE 30 1HG1 ILE 30 6.585 0.988 -6.344
222 1HG2 ILE 30 1HG2 ILE 30 7.757 -1.590 -6.204
223 2HG2 ILE 30 2HG2 ILE 30 7.575 -1.978 -4.494
224 3HG2 ILE 30 3HG2 ILE 30 9.170 -1.608 -5.149
225 1HD1 ILE 30 1HD1 ILE 30 5.782 -1.321 -6.000
226 2HD1 ILE 30 2HD1 ILE 30 4.536 -0.094 -5.786
227 3HD1 ILE 30 3HD1 ILE 30 5.271 -0.856 -4.378
228 H GLU 31 H GLU 31 6.912 2.608 -3.392
229 HA GLU 31 HA GLU 31 9.356 4.191 -3.403
230 1HB GLU 31 2HB GLU 31 7.509 4.774 -4.940
231 2HB GLU 31 1HB GLU 31 6.467 5.073 -3.556
232 1HG GLU 31 2HG GLU 31 8.400 6.732 -2.889
233 2HG GLU 31 1HG GLU 31 8.719 6.686 -4.623
234 H LYS 32 H LYS 32 10.268 4.480 -1.468
235 HA LYS 32 HA LYS 32 8.608 4.753 0.903
236 1HB LYS 32 2HB LYS 32 11.592 4.873 0.967
237 2HB LYS 32 1HB LYS 32 10.476 4.201 2.140
238 1HG LYS 32 2HG LYS 32 11.326 2.992 -0.473
239 2HG LYS 32 1HG LYS 32 11.660 2.397 1.153
240 1HD LYS 32 2HD LYS 32 8.936 2.576 -0.136
241 2HD LYS 32 1HD LYS 32 9.886 1.105 0.064
242 1HE LYS 32 2HE LYS 32 9.100 2.825 2.396
243 2HE LYS 32 1HE LYS 32 8.042 1.561 1.771
244 1HZ LYS 32 1HZ LYS 32 10.366 0.250 2.024
245 2HZ LYS 32 2HZ LYS 32 9.159 0.278 3.210
246 3HZ LYS 32 3HZ LYS 32 10.475 1.336 3.318
247 HA PRO 33 HA PRO 33 8.864 9.231 0.422
248 1HB PRO 33 2HB PRO 33 7.723 9.138 3.158
249 2HB PRO 33 1HB PRO 33 7.132 9.978 1.721
250 1HG PRO 33 2HG PRO 33 5.911 7.785 2.627
251 2HG PRO 33 1HG PRO 33 6.077 8.090 0.888
252 1HD PRO 33 2HD PRO 33 7.629 6.233 2.645
253 2HD PRO 33 1HD PRO 33 7.054 5.996 0.981
254 H GLU 34 H GLU 34 11.141 9.357 0.561
255 HA GLU 34 HA GLU 34 12.427 9.213 3.147
256 1HB GLU 34 2HB GLU 34 13.241 9.022 0.427
257 2HB GLU 34 1HB GLU 34 14.145 10.337 1.165
258 1HG GLU 34 2HG GLU 34 15.167 8.945 2.704
259 2HG GLU 34 1HG GLU 34 13.937 7.693 2.537
260 H ASN 35 H ASN 35 11.966 11.738 0.669
261 HA ASN 35 HA ASN 35 12.404 13.744 2.783
262 1HB ASN 35 2HB ASN 35 12.834 15.261 0.690
263 2HB ASN 35 1HB ASN 35 14.104 14.193 1.278
264 1HD2 ASN 35 1HD2 ASN 35 15.062 12.982 -0.177
265 2HD2 ASN 35 2HD2 ASN 35 14.417 12.532 -1.716
266 H ASP 36 H ASP 36 10.296 12.666 0.224
267 HA ASP 36 HA ASP 36 8.514 14.951 0.673
268 1HB ASP 36 2HB ASP 36 8.599 12.850 -1.494
269 2HB ASP 36 1HB ASP 36 7.292 14.019 -1.335
270 HA PRO 37 HA PRO 37 6.293 11.889 3.195
271 1HB PRO 37 2HB PRO 37 5.056 13.646 4.802
272 2HB PRO 37 1HB PRO 37 6.766 13.246 5.009
273 1HG PRO 37 2HG PRO 37 5.524 15.628 3.686
274 2HG PRO 37 1HG PRO 37 6.912 15.557 4.787
275 1HD PRO 37 2HD PRO 37 7.139 15.730 2.064
276 2HD PRO 37 1HD PRO 37 8.366 14.990 3.110
277 H GLU 38 H GLU 38 5.305 12.089 0.737
278 HA GLU 38 HA GLU 38 2.607 13.203 0.936
279 1HB GLU 38 2HB GLU 38 2.634 12.411 -1.589
280 2HB GLU 38 1HB GLU 38 3.379 13.922 -1.093
281 1HG GLU 38 2HG GLU 38 5.507 13.140 -1.398
282 2HG GLU 38 1HG GLU 38 5.045 11.459 -1.134
283 H TRP 39 H TRP 39 3.322 10.476 -1.153
284 HA TRP 39 HA TRP 39 2.055 8.589 0.648
285 1HB TRP 39 2HB TRP 39 0.823 9.218 -2.042
286 2HB TRP 39 1HB TRP 39 0.270 7.993 -0.906
287 HD1 TRP 39 HD TRP 39 -0.902 8.907 1.383
288 HE1 TRP 39 1HE TRP 39 -2.179 11.093 1.843
289 HE3 TRP 39 3HE TRP 39 0.704 11.644 -2.625
290 HZ2 TRP 39 2HZ TRP 39 -2.468 13.642 0.664
291 HZ3 TRP 39 3HZ TRP 39 -0.120 13.948 -2.887
292 HH2 TRP 39 HH TRP 39 -1.674 14.924 -1.276
293 H TRP 40 H TRP 40 2.293 6.404 -0.004
294 HA TRP 40 HA TRP 40 4.384 6.034 -2.035
295 1HB TRP 40 2HB TRP 40 4.670 3.769 -0.871
296 2HB TRP 40 1HB TRP 40 5.217 5.196 -0.003
297 HD1 TRP 40 HD TRP 40 1.517 4.238 -0.067
298 HE1 TRP 40 1HE TRP 40 0.790 3.559 2.311
299 HE3 TRP 40 3HE TRP 40 6.082 4.291 2.201
300 HZ2 TRP 40 2HZ TRP 40 2.020 3.117 4.817
301 HZ3 TRP 40 3HZ TRP 40 6.226 3.739 4.591
302 HH2 TRP 40 HH TRP 40 4.228 3.168 5.871
303 H LYS 41 H LYS 41 4.265 3.752 -3.076
304 HA LYS 41 HA LYS 41 1.490 3.064 -3.676
305 1HB LYS 41 2HB LYS 41 2.165 2.750 -6.081
306 2HB LYS 41 1HB LYS 41 2.006 4.406 -5.523
307 1HG LYS 41 2HG LYS 41 3.944 4.498 -6.706
308 2HG LYS 41 1HG LYS 41 4.560 4.207 -5.087
309 1HD LYS 41 2HD LYS 41 5.702 2.564 -6.091
310 2HD LYS 41 1HD LYS 41 4.180 1.683 -5.979
311 1HE LYS 41 2HE LYS 41 5.612 2.666 -8.318
312 2HE LYS 41 1HE LYS 41 4.423 1.372 -8.167
313 1HZ LYS 41 1HZ LYS 41 3.306 2.866 -9.470
314 2HZ LYS 41 2HZ LYS 41 4.011 4.224 -8.747
315 3HZ LYS 41 3HZ LYS 41 2.787 3.379 -7.943
316 H CYS 42 H CYS 42 1.007 0.996 -3.940
317 HA CYS 42 HA CYS 42 3.228 -0.923 -3.982
318 1HB CYS 42 2HB CYS 42 1.616 -2.435 -2.649
319 2HB CYS 42 1HB CYS 42 2.425 -1.147 -1.766
320 HG CYS 42 HG CYS 42 -0.423 -1.511 -1.677
321 H LYS 43 H LYS 43 2.745 -2.910 -5.098
322 HA LYS 43 HA LYS 43 0.730 -2.528 -7.167
323 1HB LYS 43 2HB LYS 43 1.806 -4.563 -8.188
324 2HB LYS 43 1HB LYS 43 2.873 -3.177 -8.002
325 1HG LYS 43 2HG LYS 43 3.932 -4.158 -6.099
326 2HG LYS 43 1HG LYS 43 2.751 -5.469 -6.057
327 1HD LYS 43 2HD LYS 43 4.638 -6.414 -7.075
328 2HD LYS 43 1HD LYS 43 3.562 -6.031 -8.418
329 1HE LYS 43 2HE LYS 43 5.687 -4.118 -7.504
330 2HE LYS 43 1HE LYS 43 6.041 -5.414 -8.647
331 1HZ LYS 43 1HZ LYS 43 5.441 -3.882 -10.150
332 2HZ LYS 43 2HZ LYS 43 4.563 -2.955 -9.039
333 3HZ LYS 43 3HZ LYS 43 3.859 -4.323 -9.742
334 H ASN 44 H ASN 44 -1.127 -3.598 -7.282
335 HA ASN 44 HA ASN 44 -1.639 -5.670 -5.263
336 1HB ASN 44 2HB ASN 44 -2.995 -3.395 -5.512
337 2HB ASN 44 1HB ASN 44 -3.850 -4.315 -6.744
338 1HD2 ASN 44 1HD2 ASN 44 -3.335 -3.831 -3.395
339 2HD2 ASN 44 2HD2 ASN 44 -4.482 -4.988 -2.821
340 H ALA 45 H ALA 45 -3.518 -7.147 -6.030
341 HA ALA 45 HA ALA 45 -2.538 -8.454 -8.381
342 1HB ALA 45 1HB ALA 45 -3.580 -10.293 -7.606
343 2HB ALA 45 2HB ALA 45 -5.067 -9.418 -7.239
344 3HB ALA 45 3HB ALA 45 -3.710 -9.361 -6.114
345 H ARG 46 H ARG 46 -4.399 -5.824 -8.109
346 HA ARG 46 HA ARG 46 -6.448 -6.514 -10.012
347 1HB ARG 46 2HB ARG 46 -7.470 -4.914 -8.845
348 2HB ARG 46 1HB ARG 46 -5.960 -4.394 -8.117
349 1HG ARG 46 2HG ARG 46 -5.549 -2.857 -9.810
350 2HG ARG 46 1HG ARG 46 -6.766 -3.550 -10.877
351 1HD ARG 46 2HD ARG 46 -7.132 -1.859 -8.430
352 2HD ARG 46 1HD ARG 46 -7.774 -1.613 -10.051
353 HE ARG 46 HE ARG 46 -8.902 -3.251 -7.961
354 1HH1 ARG 46 1HH1 ARG 46 -8.822 -2.596 -11.388
355 2HH1 ARG 46 2HH1 ARG 46 -10.378 -3.296 -11.684
356 1HH2 ARG 46 1HH2 ARG 46 -10.945 -4.173 -8.349
357 2HH2 ARG 46 2HH2 ARG 46 -11.583 -4.191 -9.959
358 H GLY 47 H GLY 47 -3.215 -5.804 -10.229
359 1HA GLY 47 2HA GLY 47 -2.060 -5.800 -12.283
360 2HA GLY 47 1HA GLY 47 -3.508 -5.200 -13.072
361 H GLN 48 H GLN 48 -3.815 -3.070 -11.003
362 HA GLN 48 HA GLN 48 -1.669 -1.302 -11.979
363 1HB GLN 48 2HB GLN 48 -4.588 -0.975 -11.867
364 2HB GLN 48 1HB GLN 48 -3.673 0.400 -11.279
365 1HG GLN 48 2HG GLN 48 -3.506 -0.865 -13.999
366 2HG GLN 48 1HG GLN 48 -4.137 0.730 -13.592
367 1HE2 GLN 48 1HE2 GLN 48 -1.364 -1.130 -14.318
368 2HE2 GLN 48 2HE2 GLN 48 -0.202 0.145 -14.225
369 H VAL 49 H VAL 49 -0.612 0.011 -10.571
370 HA VAL 49 HA VAL 49 -1.294 -0.316 -7.725
371 HB VAL 49 HB VAL 49 0.889 -0.147 -7.138
372 1HG1 VAL 49 1HG1 VAL 49 0.692 -1.873 -9.024
373 2HG1 VAL 49 2HG1 VAL 49 2.294 -1.374 -8.481
374 3HG1 VAL 49 3HG1 VAL 49 1.620 -0.709 -9.968
375 1HG2 VAL 49 1HG2 VAL 49 2.563 1.202 -8.494
376 2HG2 VAL 49 2HG2 VAL 49 1.288 2.090 -7.661
377 3HG2 VAL 49 3HG2 VAL 49 1.170 1.796 -9.396
378 H GLY 50 H GLY 50 -1.454 1.485 -6.396
379 1HA GLY 50 2HA GLY 50 -1.378 4.100 -7.735
380 2HA GLY 50 1HA GLY 50 -2.763 3.643 -6.770
381 H LEU 51 H LEU 51 -2.297 5.531 -5.501
382 HA LEU 51 HA LEU 51 0.043 5.221 -3.762
383 1HB LEU 51 2HB LEU 51 -1.365 7.521 -4.882
384 2HB LEU 51 1HB LEU 51 -1.030 7.685 -3.169
385 HG LEU 51 HG LEU 51 1.270 7.731 -3.481
386 1HD1 LEU 51 1HD1 LEU 51 1.970 7.108 -6.054
387 2HD1 LEU 51 2HD1 LEU 51 0.713 5.925 -5.693
388 3HD1 LEU 51 3HD1 LEU 51 2.131 6.052 -4.652
389 1HD2 LEU 51 1HD2 LEU 51 1.322 8.945 -5.976
390 2HD2 LEU 51 2HD2 LEU 51 1.088 9.736 -4.418
391 3HD2 LEU 51 3HD2 LEU 51 -0.309 9.238 -5.372
392 H VAL 52 H VAL 52 -0.244 4.437 -1.828
393 HA VAL 52 HA VAL 52 -2.926 4.459 -0.652
394 HB VAL 52 HB VAL 52 -2.203 2.243 -0.679
395 1HG1 VAL 52 1HG1 VAL 52 -0.090 1.540 -0.768
396 2HG1 VAL 52 2HG1 VAL 52 0.372 2.442 0.669
397 3HG1 VAL 52 3HG1 VAL 52 0.342 3.237 -0.900
398 1HG2 VAL 52 1HG2 VAL 52 -1.674 3.455 2.021
399 2HG2 VAL 52 2HG2 VAL 52 -1.509 1.723 1.750
400 3HG2 VAL 52 3HG2 VAL 52 -3.058 2.513 1.474
401 HA PRO 53 HA PRO 53 -1.740 7.422 2.442
402 1HB PRO 53 2HB PRO 53 -3.652 6.918 4.258
403 2HB PRO 53 1HB PRO 53 -4.056 7.636 2.688
404 1HG PRO 53 2HG PRO 53 -4.116 4.733 3.485
405 2HG PRO 53 1HG PRO 53 -5.437 5.703 2.780
406 1HD PRO 53 2HD PRO 53 -3.939 4.157 1.231
407 2HD PRO 53 1HD PRO 53 -4.390 5.786 0.686
408 H LYS 54 H LYS 54 0.186 6.803 3.326
409 HA LYS 54 HA LYS 54 0.790 4.451 4.627
410 1HB LYS 54 2HB LYS 54 2.647 5.764 5.670
411 2HB LYS 54 1HB LYS 54 2.524 5.867 3.916
412 1HG LYS 54 2HG LYS 54 2.554 8.050 4.139
413 2HG LYS 54 1HG LYS 54 0.933 7.934 4.820
414 1HD LYS 54 2HD LYS 54 1.846 7.773 7.054
415 2HD LYS 54 1HD LYS 54 3.493 7.783 6.415
416 1HE LYS 54 2HE LYS 54 2.515 10.045 5.305
417 2HE LYS 54 1HE LYS 54 1.593 10.001 6.807
418 1HZ LYS 54 1HZ LYS 54 3.402 11.019 7.623
419 2HZ LYS 54 2HZ LYS 54 4.419 10.476 6.385
420 3HZ LYS 54 3HZ LYS 54 4.057 9.460 7.688
421 H ASN 55 H ASN 55 -0.998 7.137 5.795
422 HA ASN 55 HA ASN 55 -0.551 6.663 8.584
423 1HB ASN 55 2HB ASN 55 -1.507 8.777 7.178
424 2HB ASN 55 1HB ASN 55 -3.008 8.076 7.773
425 1HD2 ASN 55 1HD2 ASN 55 -3.643 9.244 9.435
426 2HD2 ASN 55 2HD2 ASN 55 -2.656 9.738 10.765
427 H TYR 56 H TYR 56 -2.340 5.059 6.255
428 HA TYR 56 HA TYR 56 -4.250 4.034 8.250
429 1HB TYR 56 2HB TYR 56 -4.394 3.866 5.233
430 2HB TYR 56 1HB TYR 56 -5.614 3.295 6.359
431 HD1 TYR 56 1HD TYR 56 -4.779 6.076 8.007
432 HD2 TYR 56 2HD TYR 56 -6.449 5.021 4.242
433 HE1 TYR 56 1HE TYR 56 -5.909 8.255 7.906
434 HE2 TYR 56 2HE TYR 56 -7.584 7.198 4.127
435 HH TYR 56 HH TYR 56 -8.276 9.037 6.434
436 H VAL 57 H VAL 57 -1.344 3.268 7.583
437 HA VAL 57 HA VAL 57 -1.839 0.394 7.631
438 HB VAL 57 HB VAL 57 -0.819 -0.194 5.683
439 1HG1 VAL 57 1HG1 VAL 57 -1.540 2.654 4.991
440 2HG1 VAL 57 2HG1 VAL 57 -2.665 1.299 5.044
441 3HG1 VAL 57 3HG1 VAL 57 -1.363 1.317 3.855
442 1HG2 VAL 57 1HG2 VAL 57 1.373 0.479 5.934
443 2HG2 VAL 57 2HG2 VAL 57 0.938 2.174 6.152
444 3HG2 VAL 57 3HG2 VAL 57 0.866 1.444 4.547
445 H VAL 58 H VAL 58 0.383 -0.778 7.688
446 HA VAL 58 HA VAL 58 2.363 0.709 9.252
447 HB VAL 58 HB VAL 58 0.988 -0.439 10.919
448 1HG1 VAL 58 1HG1 VAL 58 1.759 -3.155 10.198
449 2HG1 VAL 58 2HG1 VAL 58 0.677 -2.400 9.028
450 3HG1 VAL 58 3HG1 VAL 58 0.201 -2.518 10.721
451 1HG2 VAL 58 1HG2 VAL 58 2.745 -1.117 12.175
452 2HG2 VAL 58 2HG2 VAL 58 3.662 -0.418 10.840
453 3HG2 VAL 58 3HG2 VAL 58 3.392 -2.160 10.907
454 H VAL 59 H VAL 59 4.248 0.484 8.246
455 HA VAL 59 HA VAL 59 4.631 -1.281 6.102
456 HB VAL 59 HB VAL 59 6.834 0.144 7.578
457 1HG1 VAL 59 1HG1 VAL 59 6.640 -0.641 4.671
458 2HG1 VAL 59 2HG1 VAL 59 7.425 -1.641 5.895
459 3HG1 VAL 59 3HG1 VAL 59 8.054 -0.036 5.535
460 1HG2 VAL 59 1HG2 VAL 59 4.625 1.340 6.485
461 2HG2 VAL 59 2HG2 VAL 59 5.772 1.366 5.146
462 3HG2 VAL 59 3HG2 VAL 59 6.202 2.101 6.690
463 H LEU 60 H LEU 60 5.943 -2.958 5.748
464 HA LEU 60 HA LEU 60 6.686 -4.588 8.047
465 1HB LEU 60 2HB LEU 60 5.162 -5.152 5.713
466 2HB LEU 60 1HB LEU 60 6.657 -6.058 5.594
467 HG LEU 60 HG LEU 60 6.200 -7.283 7.566
468 1HD1 LEU 60 1HD1 LEU 60 4.357 -5.044 8.148
469 2HD1 LEU 60 2HD1 LEU 60 5.406 -5.963 9.227
470 3HD1 LEU 60 3HD1 LEU 60 3.868 -6.646 8.701
471 1HD2 LEU 60 1HD2 LEU 60 4.956 -8.077 5.663
472 2HD2 LEU 60 2HD2 LEU 60 3.658 -6.927 5.984
473 3HD2 LEU 60 3HD2 LEU 60 3.966 -8.248 7.112
474 H SER 61 H SER 61 8.559 -5.969 7.616
475 HA SER 61 HA SER 61 10.454 -5.369 5.602
476 1HB SER 61 2HB SER 61 12.188 -4.363 7.096
477 2HB SER 61 1HB SER 61 10.789 -3.318 6.846
478 HG SER 61 HG SER 61 11.717 -4.489 9.143
Start of MODEL 9
1 1H GLY 1 1HT GLY 1 16.750 -6.839 2.193
2 2H GLY 1 2HT GLY 1 16.853 -8.240 3.134
3 3H GLY 1 3HT GLY 1 15.607 -7.129 3.406
4 1HA GLY 1 1HA GLY 1 15.971 -8.889 1.048
5 2HA GLY 1 2HA GLY 1 14.675 -8.957 2.233
6 H SER 2 H SER 2 12.820 -8.197 1.496
7 HA SER 2 HA SER 2 12.885 -6.031 -0.502
8 1HB SER 2 2HB SER 2 11.661 -8.556 -0.645
9 2HB SER 2 1HB SER 2 10.341 -7.415 -0.374
10 HG SER 2 HG SER 2 11.240 -6.190 -2.154
11 H HIS 3 H HIS 3 11.559 -4.266 -0.245
12 HA HIS 3 HA HIS 3 10.651 -3.768 2.454
13 1HB HIS 3 2HB HIS 3 9.789 -1.591 1.055
14 2HB HIS 3 1HB HIS 3 11.375 -1.740 1.795
15 HD1 HIS 3 1HD HIS 3 9.926 -2.890 -1.543
16 HD2 HIS 3 2HD HIS 3 13.217 -0.892 0.020
17 HE1 HIS 3 1HE HIS 3 11.369 -2.322 -3.522
18 HE2 HIS 3 2HE HIS 3 13.299 -1.017 -2.562
19 H VAL 4 H VAL 4 8.682 -4.156 3.180
20 HA VAL 4 HA VAL 4 6.477 -4.270 1.235
21 HB VAL 4 HB VAL 4 5.970 -6.009 3.466
22 1HG1 VAL 4 1HG1 VAL 4 5.448 -7.598 1.751
23 2HG1 VAL 4 2HG1 VAL 4 6.381 -6.693 0.561
24 3HG1 VAL 4 3HG1 VAL 4 4.892 -6.012 1.215
25 1HG2 VAL 4 1HG2 VAL 4 8.375 -6.274 3.640
26 2HG2 VAL 4 2HG2 VAL 4 8.481 -6.628 1.915
27 3HG2 VAL 4 3HG2 VAL 4 7.647 -7.745 2.994
28 H VAL 5 H VAL 5 4.319 -4.157 2.328
29 HA VAL 5 HA VAL 5 4.373 -2.601 4.796
30 HB VAL 5 HB VAL 5 4.025 -0.741 3.639
31 1HG1 VAL 5 1HG1 VAL 5 2.650 -1.165 1.272
32 2HG1 VAL 5 2HG1 VAL 5 3.741 -2.538 1.422
33 3HG1 VAL 5 3HG1 VAL 5 4.375 -0.903 1.486
34 1HG2 VAL 5 1HG2 VAL 5 1.710 -0.158 3.147
35 2HG2 VAL 5 2HG2 VAL 5 1.861 -0.988 4.697
36 3HG2 VAL 5 3HG2 VAL 5 1.250 -1.856 3.287
37 H GLN 6 H GLN 6 2.319 -2.507 5.904
38 HA GLN 6 HA GLN 6 0.564 -4.766 5.196
39 1HB GLN 6 2HB GLN 6 2.371 -4.867 7.237
40 2HB GLN 6 1HB GLN 6 0.938 -4.280 8.074
41 1HG GLN 6 2HG GLN 6 -0.282 -6.194 7.613
42 2HG GLN 6 1HG GLN 6 0.770 -6.661 6.279
43 1HE2 GLN 6 1HE2 GLN 6 2.135 -8.244 6.681
44 2HE2 GLN 6 2HE2 GLN 6 2.714 -8.720 8.238
45 H THR 7 H THR 7 -1.602 -4.565 5.665
46 HA THR 7 HA THR 7 -2.435 -1.923 6.661
47 HB THR 7 HB THR 7 -4.585 -2.946 5.227
48 HG1 THR 7 1HG THR 7 -3.565 -3.355 3.172
49 1HG2 THR 7 1HG2 THR 7 -2.499 -0.934 4.440
50 2HG2 THR 7 2HG2 THR 7 -4.077 -0.633 5.167
51 3HG2 THR 7 3HG2 THR 7 -3.968 -1.240 3.515
52 H LEU 8 H LEU 8 -4.691 -1.915 7.514
53 HA LEU 8 HA LEU 8 -5.274 -4.387 8.986
54 1HB LEU 8 2HB LEU 8 -6.048 -2.362 10.694
55 2HB LEU 8 1HB LEU 8 -4.644 -3.386 10.874
56 HG LEU 8 HG LEU 8 -4.118 -1.016 11.178
57 1HD1 LEU 8 1HD1 LEU 8 -2.741 -1.506 8.638
58 2HD1 LEU 8 2HD1 LEU 8 -2.668 -2.836 9.792
59 3HD1 LEU 8 3HD1 LEU 8 -2.090 -1.235 10.254
60 1HD2 LEU 8 1HD2 LEU 8 -5.753 -0.733 8.853
61 2HD2 LEU 8 2HD2 LEU 8 -4.161 -0.044 8.540
62 3HD2 LEU 8 3HD2 LEU 8 -5.107 0.510 9.922
63 H TYR 9 H TYR 9 -6.442 -1.634 7.261
64 HA TYR 9 HA TYR 9 -9.176 -2.664 7.533
65 1HB TYR 9 2HB TYR 9 -8.566 0.292 7.482
66 2HB TYR 9 1HB TYR 9 -10.105 -0.490 7.828
67 HD1 TYR 9 1HD TYR 9 -7.451 1.183 9.282
68 HD2 TYR 9 2HD TYR 9 -9.909 -2.236 9.895
69 HE1 TYR 9 1HE TYR 9 -6.932 1.248 11.685
70 HE2 TYR 9 2HE TYR 9 -9.398 -2.179 12.299
71 HH TYR 9 HH TYR 9 -7.081 -0.983 13.661
72 HA PRO 10 HA PRO 10 -9.771 -2.493 3.179
73 1HB PRO 10 2HB PRO 10 -11.820 -0.367 3.654
74 2HB PRO 10 1HB PRO 10 -11.931 -1.835 2.675
75 1HG PRO 10 2HG PRO 10 -13.074 -1.732 5.071
76 2HG PRO 10 1HG PRO 10 -12.250 -3.204 4.525
77 1HD PRO 10 2HD PRO 10 -11.374 -1.166 6.510
78 2HD PRO 10 1HD PRO 10 -11.052 -2.911 6.463
79 H PHE 11 H PHE 11 -9.845 -0.942 1.280
80 HA PHE 11 HA PHE 11 -7.996 1.270 1.825
81 1HB PHE 11 2HB PHE 11 -7.494 -0.634 0.147
82 2HB PHE 11 1HB PHE 11 -8.636 0.193 -0.908
83 HD1 PHE 11 1HD PHE 11 -5.278 -0.137 -0.112
84 HD2 PHE 11 2HD PHE 11 -8.176 2.821 -1.091
85 HE1 PHE 11 1HE PHE 11 -3.483 1.369 -0.862
86 HE2 PHE 11 2HE PHE 11 -6.388 4.333 -1.842
87 HZ PHE 11 HZ PHE 11 -4.037 3.610 -1.729
88 H SER 12 H SER 12 -8.431 3.346 1.264
89 HA SER 12 HA SER 12 -11.058 3.887 0.040
90 1HB SER 12 2HB SER 12 -9.861 4.907 2.542
91 2HB SER 12 1HB SER 12 -10.614 6.130 1.517
92 HG SER 12 HG SER 12 -11.799 4.399 3.134
93 H SER 13 H SER 13 -10.859 4.854 -1.860
94 HA SER 13 HA SER 13 -8.460 6.472 -2.380
95 1HB SER 13 2HB SER 13 -10.082 4.639 -4.062
96 2HB SER 13 1HB SER 13 -9.427 6.074 -4.852
97 HG SER 13 HG SER 13 -7.389 5.294 -3.655
98 H VAL 14 H VAL 14 -8.866 8.174 -4.137
99 HA VAL 14 HA VAL 14 -11.444 9.351 -4.324
100 HB VAL 14 HB VAL 14 -11.253 10.145 -2.147
101 1HG1 VAL 14 1HG1 VAL 14 -9.215 11.116 -1.207
102 2HG1 VAL 14 2HG1 VAL 14 -8.373 10.801 -2.724
103 3HG1 VAL 14 3HG1 VAL 14 -8.969 9.457 -1.752
104 1HG2 VAL 14 1HG2 VAL 14 -10.035 12.377 -3.773
105 2HG2 VAL 14 2HG2 VAL 14 -11.006 12.531 -2.308
106 3HG2 VAL 14 3HG2 VAL 14 -11.744 11.941 -3.797
107 H THR 15 H THR 15 -7.946 9.866 -4.491
108 HA THR 15 HA THR 15 -8.145 11.914 -6.487
109 HB THR 15 HB THR 15 -5.582 10.494 -6.281
110 HG1 THR 15 1HG THR 15 -5.188 11.149 -4.168
111 1HG2 THR 15 1HG2 THR 15 -5.292 12.558 -7.202
112 2HG2 THR 15 2HG2 THR 15 -4.967 12.915 -5.506
113 3HG2 THR 15 3HG2 THR 15 -6.540 13.303 -6.203
114 H GLU 16 H GLU 16 -6.786 11.594 -8.568
115 HA GLU 16 HA GLU 16 -7.987 9.387 -9.990
116 1HB GLU 16 2HB GLU 16 -8.087 11.150 -11.410
117 2HB GLU 16 1HB GLU 16 -6.716 11.955 -10.665
118 1HG GLU 16 2HG GLU 16 -6.226 11.424 -12.962
119 2HG GLU 16 1HG GLU 16 -5.195 10.480 -11.887
120 H GLU 17 H GLU 17 -4.848 10.288 -8.766
121 HA GLU 17 HA GLU 17 -3.570 8.052 -10.152
122 1HB GLU 17 2HB GLU 17 -1.467 8.978 -9.267
123 2HB GLU 17 1HB GLU 17 -2.378 10.172 -10.183
124 1HG GLU 17 2HG GLU 17 -3.176 10.376 -7.477
125 2HG GLU 17 1HG GLU 17 -1.414 10.321 -7.517
126 H GLU 18 H GLU 18 -5.513 7.521 -8.086
127 HA GLU 18 HA GLU 18 -3.800 6.255 -6.054
128 1HB GLU 18 2HB GLU 18 -6.564 7.411 -5.866
129 2HB GLU 18 1HB GLU 18 -5.990 6.224 -4.707
130 1HG GLU 18 2HG GLU 18 -3.954 8.070 -4.765
131 2HG GLU 18 1HG GLU 18 -5.406 9.058 -4.916
132 H LEU 19 H LEU 19 -5.547 4.467 -4.960
133 HA LEU 19 HA LEU 19 -6.758 2.966 -7.133
134 1HB LEU 19 2HB LEU 19 -4.176 2.355 -6.058
135 2HB LEU 19 1HB LEU 19 -5.288 1.045 -5.706
136 HG LEU 19 HG LEU 19 -5.906 1.305 -8.230
137 1HD1 LEU 19 1HD1 LEU 19 -4.088 3.275 -8.140
138 2HD1 LEU 19 2HD1 LEU 19 -4.544 2.393 -9.594
139 3HD1 LEU 19 3HD1 LEU 19 -3.102 1.926 -8.694
140 1HD2 LEU 19 1HD2 LEU 19 -4.524 -0.498 -6.791
141 2HD2 LEU 19 2HD2 LEU 19 -3.285 0.001 -7.943
142 3HD2 LEU 19 3HD2 LEU 19 -4.819 -0.642 -8.525
143 H ASN 20 H ASN 20 -8.362 1.629 -6.564
144 HA ASN 20 HA ASN 20 -9.048 1.481 -3.698
145 1HB ASN 20 2HB ASN 20 -11.418 1.164 -4.523
146 2HB ASN 20 1HB ASN 20 -10.736 2.760 -4.820
147 1HD2 ASN 20 1HD2 ASN 20 -10.242 3.379 -6.912
148 2HD2 ASN 20 2HD2 ASN 20 -10.831 2.525 -8.293
149 H PHE 21 H PHE 21 -8.268 -0.447 -3.074
150 HA PHE 21 HA PHE 21 -8.941 -2.812 -4.706
151 1HB PHE 21 2HB PHE 21 -6.538 -2.139 -3.055
152 2HB PHE 21 1HB PHE 21 -6.961 -3.818 -3.356
153 HD1 PHE 21 1HD PHE 21 -8.073 -2.250 -6.209
154 HD2 PHE 21 2HD PHE 21 -4.433 -3.222 -4.228
155 HE1 PHE 21 1HE PHE 21 -6.888 -2.186 -8.352
156 HE2 PHE 21 2HE PHE 21 -3.255 -3.160 -6.369
157 HZ PHE 21 HZ PHE 21 -4.475 -2.647 -8.425
158 H GLU 22 H GLU 22 -9.172 -4.832 -3.514
159 HA GLU 22 HA GLU 22 -11.155 -4.642 -1.529
160 1HB GLU 22 2HB GLU 22 -10.174 -6.613 -3.220
161 2HB GLU 22 1HB GLU 22 -9.799 -7.220 -1.614
162 1HG GLU 22 2HG GLU 22 -12.277 -6.590 -1.110
163 2HG GLU 22 1HG GLU 22 -12.445 -6.667 -2.864
164 H LYS 23 H LYS 23 -10.338 -6.802 0.216
165 HA LYS 23 HA LYS 23 -9.370 -5.419 2.381
166 1HB LYS 23 2HB LYS 23 -9.843 -7.340 3.402
167 2HB LYS 23 1HB LYS 23 -10.195 -8.023 1.830
168 1HG LYS 23 2HG LYS 23 -8.714 -9.512 2.909
169 2HG LYS 23 1HG LYS 23 -7.786 -8.684 1.663
170 1HD LYS 23 2HD LYS 23 -6.959 -9.016 4.213
171 2HD LYS 23 1HD LYS 23 -6.395 -7.723 3.165
172 1HE LYS 23 2HE LYS 23 -6.983 -6.743 5.252
173 2HE LYS 23 1HE LYS 23 -8.259 -6.310 4.119
174 1HZ LYS 23 1HZ LYS 23 -9.751 -7.301 5.399
175 2HZ LYS 23 2HZ LYS 23 -8.552 -7.546 6.567
176 3HZ LYS 23 3HZ LYS 23 -8.875 -8.749 5.422
177 H GLY 24 H GLY 24 -7.467 -4.844 3.163
178 1HA GLY 24 2HA GLY 24 -5.072 -5.605 1.624
179 2HA GLY 24 1HA GLY 24 -5.261 -4.087 2.491
180 H GLU 25 H GLU 25 -4.534 -7.463 2.744
181 HA GLU 25 HA GLU 25 -4.107 -7.266 5.618
182 1HB GLU 25 2HB GLU 25 -4.890 -9.356 3.883
183 2HB GLU 25 1HB GLU 25 -3.313 -9.800 4.526
184 1HG GLU 25 2HG GLU 25 -4.110 -9.586 6.773
185 2HG GLU 25 1HG GLU 25 -5.657 -8.966 6.202
186 H THR 26 H THR 26 -2.485 -7.152 2.679
187 HA THR 26 HA THR 26 -0.018 -6.459 3.877
188 HB THR 26 HB THR 26 0.994 -8.491 2.371
189 HG1 THR 26 1HG THR 26 -1.217 -9.337 2.300
190 1HG2 THR 26 1HG2 THR 26 1.805 -9.427 4.319
191 2HG2 THR 26 2HG2 THR 26 0.369 -8.987 5.243
192 3HG2 THR 26 3HG2 THR 26 1.527 -7.744 4.768
193 H MET 27 H MET 27 1.042 -5.170 2.574
194 HA MET 27 HA MET 27 0.721 -5.366 -0.328
195 1HB MET 27 2HB MET 27 0.031 -3.013 1.390
196 2HB MET 27 1HB MET 27 0.659 -2.741 -0.229
197 1HG MET 27 2HG MET 27 -1.249 -3.368 -1.212
198 2HG MET 27 1HG MET 27 -1.508 -4.702 -0.089
199 1HE MET 27 1HE MET 27 -4.846 -3.191 0.749
200 2HE MET 27 2HE MET 27 -3.881 -4.618 0.368
201 3HE MET 27 3HE MET 27 -4.181 -3.400 -0.871
202 H GLU 28 H GLU 28 2.395 -3.982 -1.462
203 HA GLU 28 HA GLU 28 4.805 -3.697 0.218
204 1HB GLU 28 2HB GLU 28 5.190 -4.362 -2.628
205 2HB GLU 28 1HB GLU 28 6.122 -4.854 -1.229
206 1HG GLU 28 2HG GLU 28 4.472 -6.526 -0.669
207 2HG GLU 28 1HG GLU 28 3.437 -5.983 -1.988
208 H VAL 29 H VAL 29 5.393 -1.671 0.304
209 HA VAL 29 HA VAL 29 4.653 0.171 -1.824
210 HB VAL 29 HB VAL 29 5.587 0.513 1.006
211 1HG1 VAL 29 1HG1 VAL 29 6.810 2.279 0.264
212 2HG1 VAL 29 2HG1 VAL 29 5.232 3.064 0.350
213 3HG1 VAL 29 3HG1 VAL 29 5.843 2.477 -1.198
214 1HG2 VAL 29 1HG2 VAL 29 3.313 2.018 -0.094
215 2HG2 VAL 29 2HG2 VAL 29 3.477 1.153 1.436
216 3HG2 VAL 29 3HG2 VAL 29 3.124 0.264 -0.046
217 H ILE 30 H ILE 30 6.017 1.042 -3.217
218 HA ILE 30 HA ILE 30 8.800 0.186 -3.163
219 HB ILE 30 HB ILE 30 8.692 1.611 -5.438
220 1HG1 ILE 30 2HG1 ILE 30 6.113 1.908 -4.747
221 2HG1 ILE 30 1HG1 ILE 30 6.639 1.810 -6.416
222 1HG2 ILE 30 1HG2 ILE 30 9.445 -0.599 -5.469
223 2HG2 ILE 30 2HG2 ILE 30 8.049 -0.589 -6.547
224 3HG2 ILE 30 3HG2 ILE 30 7.894 -1.228 -4.910
225 1HD1 ILE 30 1HD1 ILE 30 6.099 -0.577 -6.442
226 2HD1 ILE 30 2HD1 ILE 30 4.699 0.415 -6.049
227 3HD1 ILE 30 3HD1 ILE 30 5.543 -0.457 -4.774
228 H GLU 31 H GLU 31 7.238 3.285 -4.017
229 HA GLU 31 HA GLU 31 9.520 4.843 -3.495
230 1HB GLU 31 2HB GLU 31 7.513 5.530 -4.862
231 2HB GLU 31 1HB GLU 31 6.650 5.777 -3.350
232 1HG GLU 31 2HG GLU 31 9.208 7.143 -3.396
233 2HG GLU 31 1HG GLU 31 8.148 7.646 -4.712
234 H LYS 32 H LYS 32 10.387 5.545 -1.635
235 HA LYS 32 HA LYS 32 8.827 5.111 0.813
236 1HB LYS 32 2HB LYS 32 11.647 4.702 0.111
237 2HB LYS 32 1HB LYS 32 11.390 5.452 1.679
238 1HG LYS 32 2HG LYS 32 11.555 2.946 1.677
239 2HG LYS 32 1HG LYS 32 10.126 3.621 2.465
240 1HD LYS 32 2HD LYS 32 8.968 3.286 0.192
241 2HD LYS 32 1HD LYS 32 10.338 2.248 -0.197
242 1HE LYS 32 2HE LYS 32 8.433 1.920 2.117
243 2HE LYS 32 1HE LYS 32 8.482 0.935 0.655
244 1HZ LYS 32 1HZ LYS 32 10.578 1.122 2.750
245 2HZ LYS 32 2HZ LYS 32 10.770 0.292 1.290
246 3HZ LYS 32 3HZ LYS 32 9.604 -0.218 2.403
247 HA PRO 33 HA PRO 33 9.087 9.407 1.742
248 1HB PRO 33 2HB PRO 33 8.401 9.306 4.350
249 2HB PRO 33 1HB PRO 33 7.271 8.916 3.052
250 1HG PRO 33 2HG PRO 33 8.559 7.134 4.994
251 2HG PRO 33 1HG PRO 33 7.130 6.849 3.992
252 1HD PRO 33 2HD PRO 33 9.852 5.983 3.549
253 2HD PRO 33 1HD PRO 33 8.392 5.581 2.624
254 H GLU 34 H GLU 34 11.590 7.521 2.494
255 HA GLU 34 HA GLU 34 12.803 8.868 4.677
256 1HB GLU 34 2HB GLU 34 14.880 7.732 3.938
257 2HB GLU 34 1HB GLU 34 13.519 6.633 4.099
258 1HG GLU 34 2HG GLU 34 13.192 6.666 1.688
259 2HG GLU 34 1HG GLU 34 14.535 7.794 1.514
260 H ASN 35 H ASN 35 12.673 9.431 1.251
261 HA ASN 35 HA ASN 35 14.446 11.760 1.591
262 1HB ASN 35 2HB ASN 35 14.718 11.534 -0.963
263 2HB ASN 35 1HB ASN 35 15.561 10.372 0.058
264 1HD2 ASN 35 1HD2 ASN 35 15.599 8.536 -1.029
265 2HD2 ASN 35 2HD2 ASN 35 14.237 7.770 -1.768
266 H ASP 36 H ASP 36 11.500 10.520 0.103
267 HA ASP 36 HA ASP 36 10.589 13.303 -0.237
268 1HB ASP 36 2HB ASP 36 9.863 10.950 -1.993
269 2HB ASP 36 1HB ASP 36 9.316 12.611 -2.199
270 HA PRO 37 HA PRO 37 7.491 11.455 2.532
271 1HB PRO 37 2HB PRO 37 6.914 13.668 3.912
272 2HB PRO 37 1HB PRO 37 8.425 12.791 4.185
273 1HG PRO 37 2HG PRO 37 7.940 15.285 2.605
274 2HG PRO 37 1HG PRO 37 9.276 14.898 3.704
275 1HD PRO 37 2HD PRO 37 9.401 14.695 0.953
276 2HD PRO 37 1HD PRO 37 10.446 13.804 2.077
277 H GLU 38 H GLU 38 6.709 11.847 -0.059
278 HA GLU 38 HA GLU 38 4.417 13.665 0.073
279 1HB GLU 38 2HB GLU 38 4.374 12.981 -2.488
280 2HB GLU 38 1HB GLU 38 5.433 14.243 -1.879
281 1HG GLU 38 2HG GLU 38 7.316 13.022 -2.198
282 2HG GLU 38 1HG GLU 38 6.502 11.482 -1.929
283 H TRP 39 H TRP 39 4.738 10.756 -1.926
284 HA TRP 39 HA TRP 39 2.679 9.378 -0.403
285 1HB TRP 39 2HB TRP 39 2.028 9.434 -3.266
286 2HB TRP 39 1HB TRP 39 0.964 9.577 -1.876
287 HD1 TRP 39 HD TRP 39 2.942 11.655 -4.378
288 HE1 TRP 39 1HE TRP 39 2.215 14.116 -4.189
289 HE3 TRP 39 3HE TRP 39 0.027 11.321 -0.190
290 HZ2 TRP 39 2HZ TRP 39 0.617 15.706 -2.491
291 HZ3 TRP 39 3HZ TRP 39 -1.066 13.360 0.650
292 HH2 TRP 39 HH TRP 39 -0.775 15.506 -0.478
293 H TRP 40 H TRP 40 2.482 7.133 -0.962
294 HA TRP 40 HA TRP 40 4.638 6.192 -2.728
295 1HB TRP 40 2HB TRP 40 4.520 4.060 -1.256
296 2HB TRP 40 1HB TRP 40 5.419 5.456 -0.681
297 HD1 TRP 40 HD TRP 40 2.025 3.676 -0.084
298 HE1 TRP 40 1HE TRP 40 1.310 4.159 2.321
299 HE3 TRP 40 3HE TRP 40 5.683 6.992 1.195
300 HZ2 TRP 40 2HZ TRP 40 2.166 5.772 4.493
301 HZ3 TRP 40 3HZ TRP 40 5.657 7.978 3.447
302 HH2 TRP 40 HH TRP 40 3.931 7.378 5.063
303 H LYS 41 H LYS 41 4.219 3.837 -3.383
304 HA LYS 41 HA LYS 41 1.418 3.260 -3.814
305 1HB LYS 41 2HB LYS 41 1.947 2.868 -6.296
306 2HB LYS 41 1HB LYS 41 1.662 4.510 -5.753
307 1HG LYS 41 2HG LYS 41 3.496 4.757 -7.074
308 2HG LYS 41 1HG LYS 41 4.240 4.592 -5.494
309 1HD LYS 41 2HD LYS 41 5.512 3.149 -6.770
310 2HD LYS 41 1HD LYS 41 4.290 2.068 -6.120
311 1HE LYS 41 2HE LYS 41 4.948 2.508 -8.817
312 2HE LYS 41 1HE LYS 41 3.676 1.481 -8.163
313 1HZ LYS 41 1HZ LYS 41 2.713 2.997 -9.707
314 2HZ LYS 41 2HZ LYS 41 3.440 4.331 -8.964
315 3HZ LYS 41 3HZ LYS 41 2.221 3.477 -8.161
316 H CYS 42 H CYS 42 0.981 1.109 -3.986
317 HA CYS 42 HA CYS 42 3.307 -0.675 -4.134
318 1HB CYS 42 2HB CYS 42 2.040 -2.150 -2.471
319 2HB CYS 42 1HB CYS 42 2.767 -0.686 -1.821
320 HG CYS 42 HG CYS 42 0.543 -0.227 -0.919
321 H LYS 43 H LYS 43 2.857 -2.807 -4.931
322 HA LYS 43 HA LYS 43 0.633 -2.831 -6.821
323 1HB LYS 43 2HB LYS 43 2.688 -5.002 -6.634
324 2HB LYS 43 1HB LYS 43 1.805 -4.429 -8.042
325 1HG LYS 43 2HG LYS 43 3.129 -2.276 -7.814
326 2HG LYS 43 1HG LYS 43 4.148 -3.152 -6.670
327 1HD LYS 43 2HD LYS 43 3.577 -4.209 -9.425
328 2HD LYS 43 1HD LYS 43 4.904 -3.087 -9.111
329 1HE LYS 43 2HE LYS 43 6.095 -4.951 -8.730
330 2HE LYS 43 1HE LYS 43 5.298 -4.931 -7.158
331 1HZ LYS 43 1HZ LYS 43 5.254 -7.045 -8.686
332 2HZ LYS 43 2HZ LYS 43 3.928 -6.257 -9.378
333 3HZ LYS 43 3HZ LYS 43 3.922 -6.631 -7.729
334 H ASN 44 H ASN 44 -0.958 -4.361 -6.900
335 HA ASN 44 HA ASN 44 -1.087 -6.176 -4.565
336 1HB ASN 44 2HB ASN 44 -2.730 -4.105 -4.758
337 2HB ASN 44 1HB ASN 44 -3.588 -5.171 -5.858
338 1HD2 ASN 44 1HD2 ASN 44 -5.342 -5.261 -4.419
339 2HD2 ASN 44 2HD2 ASN 44 -5.284 -6.207 -2.978
340 H ALA 45 H ALA 45 -2.845 -7.908 -4.993
341 HA ALA 45 HA ALA 45 -1.958 -9.413 -7.212
342 1HB ALA 45 1HB ALA 45 -2.716 -10.894 -5.690
343 2HB ALA 45 2HB ALA 45 -4.266 -10.652 -6.497
344 3HB ALA 45 3HB ALA 45 -3.890 -9.758 -5.023
345 H ARG 46 H ARG 46 -3.789 -6.750 -7.150
346 HA ARG 46 HA ARG 46 -5.830 -7.394 -9.069
347 1HB ARG 46 2HB ARG 46 -4.917 -5.086 -7.467
348 2HB ARG 46 1HB ARG 46 -5.643 -4.682 -9.008
349 1HG ARG 46 2HG ARG 46 -7.218 -4.558 -7.210
350 2HG ARG 46 1HG ARG 46 -7.693 -5.807 -8.361
351 1HD ARG 46 2HD ARG 46 -6.418 -6.175 -5.651
352 2HD ARG 46 1HD ARG 46 -8.071 -6.566 -6.103
353 HE ARG 46 HE ARG 46 -5.779 -8.197 -6.489
354 1HH1 ARG 46 1HH1 ARG 46 -8.856 -7.347 -7.895
355 2HH1 ARG 46 2HH1 ARG 46 -9.051 -8.867 -8.701
356 1HH2 ARG 46 1HH2 ARG 46 -6.030 -10.199 -7.553
357 2HH2 ARG 46 2HH2 ARG 46 -7.446 -10.486 -8.508
358 H GLY 47 H GLY 47 -2.512 -6.810 -9.156
359 1HA GLY 47 2HA GLY 47 -1.081 -6.635 -10.963
360 2HA GLY 47 1HA GLY 47 -2.482 -6.533 -12.020
361 H GLN 48 H GLN 48 -3.139 -4.301 -9.779
362 HA GLN 48 HA GLN 48 -1.722 -2.174 -11.216
363 1HB GLN 48 2HB GLN 48 -3.889 -0.877 -10.231
364 2HB GLN 48 1HB GLN 48 -3.749 -1.523 -11.838
365 1HG GLN 48 2HG GLN 48 -4.714 -3.567 -10.118
366 2HG GLN 48 1HG GLN 48 -5.675 -2.105 -9.907
367 1HE2 GLN 48 1HE2 GLN 48 -7.484 -2.458 -10.994
368 2HE2 GLN 48 2HE2 GLN 48 -7.586 -2.967 -12.641
369 H VAL 49 H VAL 49 -0.783 -0.557 -10.087
370 HA VAL 49 HA VAL 49 -1.102 -0.636 -7.163
371 HB VAL 49 HB VAL 49 1.050 -1.338 -7.177
372 1HG1 VAL 49 1HG1 VAL 49 1.411 -1.762 -9.410
373 2HG1 VAL 49 2HG1 VAL 49 2.704 -0.648 -8.958
374 3HG1 VAL 49 3HG1 VAL 49 1.298 -0.057 -9.843
375 1HG2 VAL 49 1HG2 VAL 49 1.700 1.527 -7.761
376 2HG2 VAL 49 2HG2 VAL 49 2.545 0.410 -6.688
377 3HG2 VAL 49 3HG2 VAL 49 0.945 1.012 -6.254
378 H GLY 50 H GLY 50 -1.741 1.203 -6.297
379 1HA GLY 50 2HA GLY 50 -1.418 3.665 -7.889
380 2HA GLY 50 1HA GLY 50 -2.827 3.335 -6.910
381 H LEU 51 H LEU 51 -2.210 5.496 -6.107
382 HA LEU 51 HA LEU 51 0.034 5.493 -4.259
383 1HB LEU 51 2HB LEU 51 -1.672 7.530 -5.497
384 2HB LEU 51 1HB LEU 51 -1.275 7.859 -3.824
385 HG LEU 51 HG LEU 51 0.923 8.261 -4.273
386 1HD1 LEU 51 1HD1 LEU 51 0.648 6.123 -6.300
387 2HD1 LEU 51 2HD1 LEU 51 1.855 6.339 -5.032
388 3HD1 LEU 51 3HD1 LEU 51 1.939 7.308 -6.504
389 1HD2 LEU 51 1HD2 LEU 51 1.074 9.712 -6.051
390 2HD2 LEU 51 2HD2 LEU 51 -0.671 9.624 -5.803
391 3HD2 LEU 51 3HD2 LEU 51 0.085 8.694 -7.097
392 H VAL 52 H VAL 52 -0.108 5.122 -2.158
393 HA VAL 52 HA VAL 52 -2.776 5.127 -0.919
394 HB VAL 52 HB VAL 52 -2.280 2.833 -1.425
395 1HG1 VAL 52 1HG1 VAL 52 -0.270 1.740 -0.890
396 2HG1 VAL 52 2HG1 VAL 52 0.249 3.036 0.183
397 3HG1 VAL 52 3HG1 VAL 52 0.224 3.292 -1.562
398 1HG2 VAL 52 1HG2 VAL 52 -1.727 3.334 1.504
399 2HG2 VAL 52 2HG2 VAL 52 -2.356 1.847 0.797
400 3HG2 VAL 52 3HG2 VAL 52 -3.326 3.317 0.765
401 HA PRO 53 HA PRO 53 -0.545 7.241 2.379
402 1HB PRO 53 2HB PRO 53 -2.633 7.914 3.831
403 2HB PRO 53 1HB PRO 53 -2.528 8.552 2.177
404 1HG PRO 53 2HG PRO 53 -3.973 6.094 3.129
405 2HG PRO 53 1HG PRO 53 -4.663 7.474 2.243
406 1HD PRO 53 2HD PRO 53 -3.851 5.218 1.007
407 2HD PRO 53 1HD PRO 53 -3.658 6.815 0.252
408 H LYS 54 H LYS 54 0.528 5.314 3.184
409 HA LYS 54 HA LYS 54 -0.827 3.310 4.631
410 1HB LYS 54 2HB LYS 54 2.018 3.978 4.161
411 2HB LYS 54 1HB LYS 54 1.649 2.955 5.528
412 1HG LYS 54 2HG LYS 54 2.113 2.075 3.016
413 2HG LYS 54 1HG LYS 54 1.227 1.192 4.251
414 1HD LYS 54 2HD LYS 54 -0.885 2.040 3.364
415 2HD LYS 54 1HD LYS 54 -0.008 2.970 2.150
416 1HE LYS 54 2HE LYS 54 -0.606 1.099 0.952
417 2HE LYS 54 1HE LYS 54 1.001 0.650 1.517
418 1HZ LYS 54 1HZ LYS 54 -1.615 -0.378 2.325
419 2HZ LYS 54 2HZ LYS 54 -0.410 -0.301 3.508
420 3HZ LYS 54 3HZ LYS 54 -0.153 -1.199 2.099
421 H ASN 55 H ASN 55 -0.150 6.454 5.547
422 HA ASN 55 HA ASN 55 0.651 6.377 8.159
423 1HB ASN 55 2HB ASN 55 0.142 8.445 6.900
424 2HB ASN 55 1HB ASN 55 -1.577 8.103 7.060
425 1HD2 ASN 55 1HD2 ASN 55 1.338 9.000 8.750
426 2HD2 ASN 55 2HD2 ASN 55 0.562 9.618 10.165
427 H TYR 56 H TYR 56 -2.278 5.070 6.873
428 HA TYR 56 HA TYR 56 -3.454 4.821 9.552
429 1HB TYR 56 2HB TYR 56 -5.541 4.449 8.515
430 2HB TYR 56 1HB TYR 56 -4.787 5.723 7.571
431 HD1 TYR 56 1HD TYR 56 -5.656 2.132 7.590
432 HD2 TYR 56 2HD TYR 56 -4.280 5.421 5.269
433 HE1 TYR 56 1HE TYR 56 -6.010 0.825 5.540
434 HE2 TYR 56 2HE TYR 56 -4.630 4.122 3.212
435 HH TYR 56 HH TYR 56 -6.349 1.155 3.184
436 H VAL 57 H VAL 57 -1.250 3.206 8.046
437 HA VAL 57 HA VAL 57 -2.288 0.553 8.815
438 HB VAL 57 HB VAL 57 -1.658 -0.432 6.851
439 1HG1 VAL 57 1HG1 VAL 57 -2.173 2.396 5.977
440 2HG1 VAL 57 2HG1 VAL 57 -3.370 1.123 6.208
441 3HG1 VAL 57 3HG1 VAL 57 -2.189 0.996 4.905
442 1HG2 VAL 57 1HG2 VAL 57 0.039 0.475 5.284
443 2HG2 VAL 57 2HG2 VAL 57 0.674 0.082 6.879
444 3HG2 VAL 57 3HG2 VAL 57 0.354 1.760 6.446
445 H VAL 58 H VAL 58 -0.322 -1.037 8.763
446 HA VAL 58 HA VAL 58 1.919 0.262 10.165
447 HB VAL 58 HB VAL 58 0.722 -1.394 11.542
448 1HG1 VAL 58 1HG1 VAL 58 1.653 -3.722 10.027
449 2HG1 VAL 58 2HG1 VAL 58 0.375 -2.799 9.239
450 3HG1 VAL 58 3HG1 VAL 58 0.124 -3.444 10.861
451 1HG2 VAL 58 1HG2 VAL 58 2.606 -2.328 12.450
452 2HG2 VAL 58 2HG2 VAL 58 3.330 -1.072 11.446
453 3HG2 VAL 58 3HG2 VAL 58 3.294 -2.741 10.880
454 H VAL 59 H VAL 59 3.596 0.544 8.833
455 HA VAL 59 HA VAL 59 3.857 -0.903 6.394
456 HB VAL 59 HB VAL 59 5.954 0.850 7.664
457 1HG1 VAL 59 1HG1 VAL 59 6.079 1.117 4.928
458 2HG1 VAL 59 2HG1 VAL 59 5.710 -0.598 5.139
459 3HG1 VAL 59 3HG1 VAL 59 7.135 0.095 5.911
460 1HG2 VAL 59 1HG2 VAL 59 4.801 2.408 5.790
461 2HG2 VAL 59 2HG2 VAL 59 4.342 2.427 7.492
462 3HG2 VAL 59 3HG2 VAL 59 3.398 1.489 6.336
463 H LEU 60 H LEU 60 5.391 -2.322 5.738
464 HA LEU 60 HA LEU 60 6.617 -3.909 7.820
465 1HB LEU 60 2HB LEU 60 5.312 -4.460 5.314
466 2HB LEU 60 1HB LEU 60 6.930 -5.132 5.302
467 HG LEU 60 HG LEU 60 6.466 -6.573 7.102
468 1HD1 LEU 60 1HD1 LEU 60 3.998 -6.310 8.094
469 2HD1 LEU 60 2HD1 LEU 60 4.332 -4.621 7.709
470 3HD1 LEU 60 3HD1 LEU 60 5.405 -5.508 8.792
471 1HD2 LEU 60 1HD2 LEU 60 5.469 -7.696 5.399
472 2HD2 LEU 60 2HD2 LEU 60 4.370 -6.370 5.022
473 3HD2 LEU 60 3HD2 LEU 60 4.038 -7.427 6.393
474 H SER 61 H SER 61 8.740 -4.722 7.364
475 HA SER 61 HA SER 61 10.973 -4.459 7.012
476 1HB SER 61 2HB SER 61 10.065 -4.628 4.600
477 2HB SER 61 1HB SER 61 10.313 -2.883 4.532
478 HG SER 61 HG SER 61 12.185 -3.769 3.815
Start of MODEL 10
1 1H GLY 1 1HT GLY 1 13.518 -11.039 4.281
2 2H GLY 1 2HT GLY 1 13.456 -9.366 4.517
3 3H GLY 1 3HT GLY 1 14.732 -10.264 5.168
4 1HA GLY 1 1HA GLY 1 15.836 -9.553 3.358
5 2HA GLY 1 2HA GLY 1 15.021 -10.925 2.624
6 H SER 2 H SER 2 12.394 -9.774 2.653
7 HA SER 2 HA SER 2 12.741 -7.823 0.480
8 1HB SER 2 2HB SER 2 11.162 -10.170 0.691
9 2HB SER 2 1HB SER 2 10.041 -8.804 0.662
10 HG SER 2 HG SER 2 10.813 -8.207 -1.297
11 H HIS 3 H HIS 3 11.752 -5.853 0.539
12 HA HIS 3 HA HIS 3 10.762 -4.983 3.116
13 1HB HIS 3 2HB HIS 3 10.326 -2.889 1.316
14 2HB HIS 3 1HB HIS 3 11.673 -3.061 2.428
15 HD1 HIS 3 1HD HIS 3 13.790 -4.457 1.329
16 HD2 HIS 3 2HD HIS 3 11.063 -2.712 -1.276
17 HE1 HIS 3 1HE HIS 3 14.968 -4.325 -0.889
18 HE2 HIS 3 2HE HIS 3 13.318 -3.216 -2.437
19 H VAL 4 H VAL 4 8.738 -5.277 3.687
20 HA VAL 4 HA VAL 4 6.660 -5.082 1.604
21 HB VAL 4 HB VAL 4 5.955 -6.851 3.830
22 1HG1 VAL 4 1HG1 VAL 4 4.690 -7.843 2.254
23 2HG1 VAL 4 2HG1 VAL 4 5.981 -7.822 1.055
24 3HG1 VAL 4 3HG1 VAL 4 5.022 -6.370 1.344
25 1HG2 VAL 4 1HG2 VAL 4 8.231 -7.597 2.004
26 2HG2 VAL 4 2HG2 VAL 4 7.288 -8.763 2.932
27 3HG2 VAL 4 3HG2 VAL 4 8.241 -7.537 3.767
28 H VAL 5 H VAL 5 4.454 -4.761 2.562
29 HA VAL 5 HA VAL 5 4.571 -3.223 5.046
30 HB VAL 5 HB VAL 5 4.443 -1.346 3.849
31 1HG1 VAL 5 1HG1 VAL 5 4.695 -1.409 1.673
32 2HG1 VAL 5 2HG1 VAL 5 3.003 -1.837 1.456
33 3HG1 VAL 5 3HG1 VAL 5 4.211 -3.096 1.659
34 1HG2 VAL 5 1HG2 VAL 5 2.113 -0.663 3.172
35 2HG2 VAL 5 2HG2 VAL 5 2.314 -1.199 4.838
36 3HG2 VAL 5 3HG2 VAL 5 1.596 -2.279 3.647
37 H GLN 6 H GLN 6 2.484 -2.848 6.040
38 HA GLN 6 HA GLN 6 0.567 -5.001 5.421
39 1HB GLN 6 2HB GLN 6 2.196 -5.015 7.595
40 2HB GLN 6 1HB GLN 6 0.809 -4.143 8.238
41 1HG GLN 6 2HG GLN 6 -0.632 -5.943 7.919
42 2HG GLN 6 1HG GLN 6 0.473 -6.740 6.802
43 1HE2 GLN 6 1HE2 GLN 6 1.770 -8.266 7.582
44 2HE2 GLN 6 2HE2 GLN 6 2.061 -8.577 9.256
45 H THR 7 H THR 7 -1.632 -4.522 5.689
46 HA THR 7 HA THR 7 -2.171 -1.659 6.188
47 HB THR 7 HB THR 7 -4.381 -2.719 4.841
48 HG1 THR 7 1HG THR 7 -1.990 -3.471 3.521
49 1HG2 THR 7 1HG2 THR 7 -2.153 -0.895 4.125
50 2HG2 THR 7 2HG2 THR 7 -3.884 -0.579 4.239
51 3HG2 THR 7 3HG2 THR 7 -3.238 -1.458 2.855
52 H LEU 8 H LEU 8 -3.735 -1.052 7.546
53 HA LEU 8 HA LEU 8 -4.941 -3.163 9.191
54 1HB LEU 8 2HB LEU 8 -4.737 -0.269 9.940
55 2HB LEU 8 1HB LEU 8 -4.927 -1.653 10.992
56 HG LEU 8 HG LEU 8 -2.726 -0.854 11.301
57 1HD1 LEU 8 1HD1 LEU 8 -3.193 -3.418 10.579
58 2HD1 LEU 8 2HD1 LEU 8 -1.649 -2.812 11.178
59 3HD1 LEU 8 3HD1 LEU 8 -1.924 -2.962 9.442
60 1HD2 LEU 8 1HD2 LEU 8 -1.294 -0.097 9.734
61 2HD2 LEU 8 2HD2 LEU 8 -2.839 0.308 8.985
62 3HD2 LEU 8 3HD2 LEU 8 -1.958 -1.134 8.470
63 H TYR 9 H TYR 9 -5.616 0.024 7.776
64 HA TYR 9 HA TYR 9 -8.480 -0.363 8.185
65 1HB TYR 9 2HB TYR 9 -6.790 1.986 7.356
66 2HB TYR 9 1HB TYR 9 -8.539 2.017 7.183
67 HD1 TYR 9 1HD TYR 9 -5.802 2.583 9.378
68 HD2 TYR 9 2HD TYR 9 -9.928 1.547 9.312
69 HE1 TYR 9 1HE TYR 9 -6.008 3.277 11.728
70 HE2 TYR 9 2HE TYR 9 -10.146 2.241 11.661
71 HH TYR 9 HH TYR 9 -7.660 2.626 13.703
72 HA PRO 10 HA PRO 10 -9.699 -1.522 4.123
73 1HB PRO 10 2HB PRO 10 -11.481 0.510 3.447
74 2HB PRO 10 1HB PRO 10 -11.884 -0.942 4.366
75 1HG PRO 10 2HG PRO 10 -11.252 1.809 5.344
76 2HG PRO 10 1HG PRO 10 -12.455 0.652 5.943
77 1HD PRO 10 2HD PRO 10 -10.155 1.038 7.242
78 2HD PRO 10 1HD PRO 10 -10.865 -0.585 7.109
79 H PHE 11 H PHE 11 -10.351 -0.127 1.888
80 HA PHE 11 HA PHE 11 -7.872 1.361 1.339
81 1HB PHE 11 2HB PHE 11 -8.086 0.669 -0.962
82 2HB PHE 11 1HB PHE 11 -8.244 -0.751 0.065
83 HD1 PHE 11 1HD PHE 11 -10.019 1.575 -2.141
84 HD2 PHE 11 2HD PHE 11 -10.310 -1.959 0.212
85 HE1 PHE 11 1HE PHE 11 -12.162 1.037 -3.223
86 HE2 PHE 11 2HE PHE 11 -12.453 -2.504 -0.866
87 HZ PHE 11 HZ PHE 11 -13.383 -1.006 -2.585
88 H SER 12 H SER 12 -7.965 3.437 0.794
89 HA SER 12 HA SER 12 -10.516 4.537 -0.171
90 1HB SER 12 2HB SER 12 -10.489 5.289 2.063
91 2HB SER 12 1HB SER 12 -8.750 5.584 2.034
92 HG SER 12 HG SER 12 -10.612 7.019 0.450
93 H SER 13 H SER 13 -10.231 5.369 -2.144
94 HA SER 13 HA SER 13 -7.873 6.993 -2.668
95 1HB SER 13 2HB SER 13 -8.406 4.359 -3.908
96 2HB SER 13 1HB SER 13 -7.884 5.641 -5.000
97 HG SER 13 HG SER 13 -6.496 4.353 -2.975
98 H VAL 14 H VAL 14 -8.454 8.800 -3.657
99 HA VAL 14 HA VAL 14 -10.703 8.760 -5.535
100 HB VAL 14 HB VAL 14 -11.578 10.852 -4.607
101 1HG1 VAL 14 1HG1 VAL 14 -12.079 8.379 -3.744
102 2HG1 VAL 14 2HG1 VAL 14 -12.884 9.802 -3.082
103 3HG1 VAL 14 3HG1 VAL 14 -11.511 9.091 -2.234
104 1HG2 VAL 14 1HG2 VAL 14 -9.651 11.826 -3.605
105 2HG2 VAL 14 2HG2 VAL 14 -9.437 10.444 -2.531
106 3HG2 VAL 14 3HG2 VAL 14 -10.812 11.525 -2.313
107 H THR 15 H THR 15 -7.530 9.595 -4.975
108 HA THR 15 HA THR 15 -7.552 11.990 -6.633
109 HB THR 15 HB THR 15 -5.086 10.636 -5.570
110 HG1 THR 15 1HG THR 15 -6.529 10.908 -3.825
111 1HG2 THR 15 1HG2 THR 15 -4.513 13.144 -5.250
112 2HG2 THR 15 2HG2 THR 15 -5.787 13.396 -6.442
113 3HG2 THR 15 3HG2 THR 15 -4.384 12.409 -6.847
114 H GLU 16 H GLU 16 -5.801 12.123 -8.358
115 HA GLU 16 HA GLU 16 -6.319 10.155 -10.325
116 1HB GLU 16 2HB GLU 16 -5.199 12.740 -10.237
117 2HB GLU 16 1HB GLU 16 -3.969 11.700 -10.941
118 1HG GLU 16 2HG GLU 16 -6.304 10.944 -12.219
119 2HG GLU 16 1HG GLU 16 -6.430 12.697 -12.079
120 H GLU 17 H GLU 17 -3.588 10.738 -8.170
121 HA GLU 17 HA GLU 17 -2.111 8.515 -9.348
122 1HB GLU 17 2HB GLU 17 -1.203 10.042 -6.927
123 2HB GLU 17 1HB GLU 17 -0.237 9.230 -8.148
124 1HG GLU 17 2HG GLU 17 -0.026 11.095 -9.306
125 2HG GLU 17 1HG GLU 17 -1.773 11.316 -9.370
126 H GLU 18 H GLU 18 -4.661 8.380 -7.622
127 HA GLU 18 HA GLU 18 -3.652 6.635 -5.499
128 1HB GLU 18 2HB GLU 18 -6.082 8.297 -5.847
129 2HB GLU 18 1HB GLU 18 -6.247 6.811 -4.929
130 1HG GLU 18 2HG GLU 18 -4.266 7.615 -3.557
131 2HG GLU 18 1HG GLU 18 -4.507 9.179 -4.334
132 H LEU 19 H LEU 19 -5.602 4.917 -4.995
133 HA LEU 19 HA LEU 19 -6.697 3.755 -7.395
134 1HB LEU 19 2HB LEU 19 -4.131 2.934 -6.472
135 2HB LEU 19 1HB LEU 19 -5.253 1.617 -6.218
136 HG LEU 19 HG LEU 19 -5.941 2.052 -8.672
137 1HD1 LEU 19 1HD1 LEU 19 -3.480 2.721 -9.685
138 2HD1 LEU 19 2HD1 LEU 19 -3.697 3.849 -8.349
139 3HD1 LEU 19 3HD1 LEU 19 -4.904 3.760 -9.629
140 1HD2 LEU 19 1HD2 LEU 19 -3.231 0.907 -8.600
141 2HD2 LEU 19 2HD2 LEU 19 -4.740 0.213 -9.194
142 3HD2 LEU 19 3HD2 LEU 19 -4.392 0.218 -7.466
143 H ASN 20 H ASN 20 -8.420 2.480 -6.994
144 HA ASN 20 HA ASN 20 -8.995 1.891 -4.165
145 1HB ASN 20 2HB ASN 20 -11.396 1.728 -4.952
146 2HB ASN 20 1HB ASN 20 -10.689 3.340 -5.031
147 1HD2 ASN 20 1HD2 ASN 20 -12.862 1.826 -6.540
148 2HD2 ASN 20 2HD2 ASN 20 -12.496 2.137 -8.200
149 H PHE 21 H PHE 21 -8.191 -0.089 -3.867
150 HA PHE 21 HA PHE 21 -9.301 -2.258 -5.510
151 1HB PHE 21 2HB PHE 21 -6.998 -3.418 -5.094
152 2HB PHE 21 1HB PHE 21 -7.157 -2.250 -6.395
153 HD1 PHE 21 1HD PHE 21 -6.800 -1.513 -2.771
154 HD2 PHE 21 2HD PHE 21 -4.971 -1.487 -6.611
155 HE1 PHE 21 1HE PHE 21 -4.918 -0.226 -1.858
156 HE2 PHE 21 2HE PHE 21 -3.082 -0.199 -5.704
157 HZ PHE 21 HZ PHE 21 -3.053 0.432 -3.324
158 H GLU 22 H GLU 22 -9.191 -4.411 -4.339
159 HA GLU 22 HA GLU 22 -10.134 -4.042 -1.670
160 1HB GLU 22 2HB GLU 22 -9.549 -6.458 -3.348
161 2HB GLU 22 1HB GLU 22 -9.992 -6.620 -1.657
162 1HG GLU 22 2HG GLU 22 -12.063 -6.772 -2.520
163 2HG GLU 22 1HG GLU 22 -11.964 -5.013 -2.458
164 H LYS 23 H LYS 23 -8.624 -3.229 -0.352
165 HA LYS 23 HA LYS 23 -5.927 -4.167 -0.266
166 1HB LYS 23 2HB LYS 23 -6.642 -1.845 0.337
167 2HB LYS 23 1HB LYS 23 -7.362 -2.501 1.801
168 1HG LYS 23 2HG LYS 23 -5.095 -1.489 2.092
169 2HG LYS 23 1HG LYS 23 -5.246 -3.154 2.654
170 1HD LYS 23 2HD LYS 23 -3.147 -2.707 1.393
171 2HD LYS 23 1HD LYS 23 -4.140 -3.979 0.686
172 1HE LYS 23 2HE LYS 23 -5.075 -2.263 -0.877
173 2HE LYS 23 1HE LYS 23 -3.888 -1.124 -0.244
174 1HZ LYS 23 1HZ LYS 23 -2.360 -3.243 -0.884
175 2HZ LYS 23 2HZ LYS 23 -2.614 -1.906 -1.888
176 3HZ LYS 23 3HZ LYS 23 -3.539 -3.307 -2.096
177 H GLY 24 H GLY 24 -4.978 -5.620 1.031
178 1HA GLY 24 2HA GLY 24 -6.742 -7.117 2.855
179 2HA GLY 24 1HA GLY 24 -5.301 -7.767 2.081
180 H GLU 25 H GLU 25 -4.688 -8.414 4.265
181 HA GLU 25 HA GLU 25 -3.872 -6.255 6.028
182 1HB GLU 25 2HB GLU 25 -4.988 -8.693 6.558
183 2HB GLU 25 1HB GLU 25 -3.281 -9.010 6.854
184 1HG GLU 25 2HG GLU 25 -3.150 -7.340 8.493
185 2HG GLU 25 1HG GLU 25 -4.705 -6.658 8.026
186 H THR 26 H THR 26 -2.525 -6.948 3.458
187 HA THR 26 HA THR 26 0.141 -6.602 4.339
188 HB THR 26 HB THR 26 0.915 -8.732 3.043
189 HG1 THR 26 1HG THR 26 -0.833 -9.777 2.446
190 1HG2 THR 26 1HG2 THR 26 1.064 -8.170 5.588
191 2HG2 THR 26 2HG2 THR 26 1.381 -9.803 5.000
192 3HG2 THR 26 3HG2 THR 26 -0.182 -9.412 5.718
193 H MET 27 H MET 27 1.058 -5.390 2.916
194 HA MET 27 HA MET 27 0.664 -5.832 0.061
195 1HB MET 27 2HB MET 27 0.046 -3.643 -0.459
196 2HB MET 27 1HB MET 27 -0.891 -3.980 0.988
197 1HG MET 27 2HG MET 27 1.458 -2.918 1.963
198 2HG MET 27 1HG MET 27 1.146 -1.978 0.508
199 1HE MET 27 1HE MET 27 -2.495 -0.766 1.132
200 2HE MET 27 2HE MET 27 -1.500 -1.668 -0.012
201 3HE MET 27 3HE MET 27 -1.034 -0.036 0.468
202 H GLU 28 H GLU 28 2.345 -4.580 -1.223
203 HA GLU 28 HA GLU 28 4.824 -4.306 0.374
204 1HB GLU 28 2HB GLU 28 4.650 -5.210 -2.485
205 2HB GLU 28 1HB GLU 28 6.074 -5.202 -1.467
206 1HG GLU 28 2HG GLU 28 5.624 -7.236 -0.720
207 2HG GLU 28 1HG GLU 28 3.992 -6.761 -0.254
208 H VAL 29 H VAL 29 5.601 -2.284 0.326
209 HA VAL 29 HA VAL 29 4.726 -0.496 -1.817
210 HB VAL 29 HB VAL 29 5.830 0.026 0.930
211 1HG1 VAL 29 1HG1 VAL 29 5.472 1.997 -1.318
212 2HG1 VAL 29 2HG1 VAL 29 6.946 1.648 -0.416
213 3HG1 VAL 29 3HG1 VAL 29 5.599 2.461 0.379
214 1HG2 VAL 29 1HG2 VAL 29 3.405 1.359 -0.072
215 2HG2 VAL 29 2HG2 VAL 29 3.733 0.618 1.495
216 3HG2 VAL 29 3HG2 VAL 29 3.297 -0.391 0.115
217 H ILE 30 H ILE 30 6.023 0.257 -3.316
218 HA ILE 30 HA ILE 30 8.751 -0.674 -3.453
219 HB ILE 30 HB ILE 30 8.623 0.885 -5.616
220 1HG1 ILE 30 2HG1 ILE 30 6.178 1.460 -4.711
221 2HG1 ILE 30 1HG1 ILE 30 6.538 1.372 -6.423
222 1HG2 ILE 30 1HG2 ILE 30 9.096 -1.411 -5.801
223 2HG2 ILE 30 2HG2 ILE 30 7.693 -1.124 -6.831
224 3HG2 ILE 30 3HG2 ILE 30 7.486 -1.868 -5.246
225 1HD1 ILE 30 1HD1 ILE 30 4.451 0.239 -5.848
226 2HD1 ILE 30 2HD1 ILE 30 5.346 -0.855 -4.797
227 3HD1 ILE 30 3HD1 ILE 30 5.640 -0.865 -6.535
228 H GLU 31 H GLU 31 7.732 2.570 -4.444
229 HA GLU 31 HA GLU 31 10.130 3.750 -3.531
230 1HB GLU 31 2HB GLU 31 9.092 5.880 -4.138
231 2HB GLU 31 1HB GLU 31 8.840 4.676 -5.395
232 1HG GLU 31 2HG GLU 31 6.574 4.261 -4.292
233 2HG GLU 31 1HG GLU 31 6.862 5.771 -3.429
234 H LYS 32 H LYS 32 10.512 5.149 -1.811
235 HA LYS 32 HA LYS 32 8.612 4.870 0.417
236 1HB LYS 32 2HB LYS 32 11.575 4.845 0.245
237 2HB LYS 32 1HB LYS 32 10.871 5.604 1.664
238 1HG LYS 32 2HG LYS 32 11.483 3.132 1.809
239 2HG LYS 32 1HG LYS 32 9.892 3.620 2.394
240 1HD LYS 32 2HD LYS 32 8.933 2.938 0.209
241 2HD LYS 32 1HD LYS 32 10.526 2.355 -0.275
242 1HE LYS 32 2HE LYS 32 9.443 1.371 2.301
243 2HE LYS 32 1HE LYS 32 8.675 0.777 0.829
244 1HZ LYS 32 1HZ LYS 32 10.880 0.087 0.042
245 2HZ LYS 32 2HZ LYS 32 10.446 -0.692 1.480
246 3HZ LYS 32 3HZ LYS 32 11.560 0.581 1.512
247 HA PRO 33 HA PRO 33 7.977 9.205 0.666
248 1HB PRO 33 2HB PRO 33 8.285 9.183 3.580
249 2HB PRO 33 1HB PRO 33 6.842 9.484 2.610
250 1HG PRO 33 2HG PRO 33 7.154 7.231 4.060
251 2HG PRO 33 1HG PRO 33 6.271 7.256 2.523
252 1HD PRO 33 2HD PRO 33 9.062 6.334 3.093
253 2HD PRO 33 1HD PRO 33 7.827 5.611 2.040
254 H GLU 34 H GLU 34 10.921 7.908 1.500
255 HA GLU 34 HA GLU 34 12.260 10.007 2.772
256 1HB GLU 34 2HB GLU 34 14.325 9.003 1.819
257 2HB GLU 34 1HB GLU 34 13.278 7.827 2.601
258 1HG GLU 34 2HG GLU 34 12.414 7.164 0.395
259 2HG GLU 34 1HG GLU 34 13.533 8.298 -0.359
260 H ASN 35 H ASN 35 11.836 9.300 -0.673
261 HA ASN 35 HA ASN 35 12.861 11.984 -1.306
262 1HB ASN 35 2HB ASN 35 12.987 11.036 -3.674
263 2HB ASN 35 1HB ASN 35 14.125 10.375 -2.505
264 1HD2 ASN 35 1HD2 ASN 35 14.303 8.567 -3.927
265 2HD2 ASN 35 2HD2 ASN 35 13.110 7.317 -3.899
266 H ASP 36 H ASP 36 10.142 9.831 -1.561
267 HA ASP 36 HA ASP 36 8.626 11.396 -3.401
268 1HB ASP 36 2HB ASP 36 8.104 9.070 -3.237
269 2HB ASP 36 1HB ASP 36 7.913 9.168 -1.490
270 HA PRO 37 HA PRO 37 6.955 14.765 -1.107
271 1HB PRO 37 2HB PRO 37 4.212 14.041 -1.498
272 2HB PRO 37 1HB PRO 37 5.148 15.260 -2.361
273 1HG PRO 37 2HG PRO 37 4.534 12.465 -3.123
274 2HG PRO 37 1HG PRO 37 4.868 13.869 -4.154
275 1HD PRO 37 2HD PRO 37 6.668 11.913 -3.853
276 2HD PRO 37 1HD PRO 37 7.174 13.611 -3.963
277 H GLU 38 H GLU 38 4.397 12.346 -0.594
278 HA GLU 38 HA GLU 38 5.253 11.775 2.092
279 1HB GLU 38 2HB GLU 38 4.127 14.093 2.114
280 2HB GLU 38 1HB GLU 38 2.628 13.207 1.867
281 1HG GLU 38 2HG GLU 38 2.559 12.483 3.982
282 2HG GLU 38 1HG GLU 38 4.295 12.181 4.043
283 H TRP 39 H TRP 39 4.063 10.594 -0.563
284 HA TRP 39 HA TRP 39 2.414 8.623 0.838
285 1HB TRP 39 2HB TRP 39 1.640 9.793 -1.841
286 2HB TRP 39 1HB TRP 39 0.738 8.603 -0.906
287 HD1 TRP 39 HD TRP 39 0.577 9.900 1.893
288 HE1 TRP 39 1HE TRP 39 -0.714 12.093 2.281
289 HE3 TRP 39 3HE TRP 39 0.580 11.695 -2.891
290 HZ2 TRP 39 2HZ TRP 39 -1.612 14.293 0.756
291 HZ3 TRP 39 3HZ TRP 39 -0.518 13.850 -3.345
292 HH2 TRP 39 HH TRP 39 -1.590 15.120 -1.557
293 H TRP 40 H TRP 40 2.512 6.538 0.004
294 HA TRP 40 HA TRP 40 4.603 6.137 -2.027
295 1HB TRP 40 2HB TRP 40 4.780 3.823 -0.962
296 2HB TRP 40 1HB TRP 40 5.394 5.181 -0.027
297 HD1 TRP 40 HD TRP 40 1.674 4.243 -0.199
298 HE1 TRP 40 1HE TRP 40 0.883 3.561 2.162
299 HE3 TRP 40 3HE TRP 40 6.164 4.388 2.200
300 HZ2 TRP 40 2HZ TRP 40 2.059 3.143 4.709
301 HZ3 TRP 40 3HZ TRP 40 6.255 3.845 4.594
302 HH2 TRP 40 HH TRP 40 4.235 3.242 5.821
303 H LYS 41 H LYS 41 4.320 3.756 -2.971
304 HA LYS 41 HA LYS 41 1.532 3.229 -3.609
305 1HB LYS 41 2HB LYS 41 2.181 2.983 -6.044
306 2HB LYS 41 1HB LYS 41 2.019 4.611 -5.431
307 1HG LYS 41 2HG LYS 41 3.949 4.831 -6.568
308 2HG LYS 41 1HG LYS 41 4.611 4.319 -5.021
309 1HD LYS 41 2HD LYS 41 5.690 2.947 -6.567
310 2HD LYS 41 1HD LYS 41 4.370 1.961 -5.959
311 1HE LYS 41 2HE LYS 41 4.960 2.526 -8.622
312 2HE LYS 41 1HE LYS 41 3.542 1.694 -7.989
313 1HZ LYS 41 1HZ LYS 41 2.447 3.875 -7.800
314 2HZ LYS 41 2HZ LYS 41 2.874 3.509 -9.394
315 3HZ LYS 41 3HZ LYS 41 3.796 4.610 -8.505
316 H CYS 42 H CYS 42 1.050 1.129 -3.928
317 HA CYS 42 HA CYS 42 3.285 -0.750 -4.153
318 1HB CYS 42 2HB CYS 42 1.890 -2.273 -2.603
319 2HB CYS 42 1HB CYS 42 2.799 -0.962 -1.861
320 HG CYS 42 HG CYS 42 0.112 -1.305 -1.177
321 H LYS 43 H LYS 43 2.671 -2.833 -5.047
322 HA LYS 43 HA LYS 43 0.516 -2.537 -6.977
323 1HB LYS 43 2HB LYS 43 1.518 -4.781 -7.816
324 2HB LYS 43 1HB LYS 43 2.401 -3.287 -8.086
325 1HG LYS 43 2HG LYS 43 3.905 -3.764 -6.300
326 2HG LYS 43 1HG LYS 43 2.934 -5.143 -5.779
327 1HD LYS 43 2HD LYS 43 4.928 -5.845 -7.029
328 2HD LYS 43 1HD LYS 43 3.439 -6.305 -7.856
329 1HE LYS 43 2HE LYS 43 5.297 -5.319 -9.289
330 2HE LYS 43 1HE LYS 43 3.689 -4.620 -9.474
331 1HZ LYS 43 1HZ LYS 43 5.750 -3.457 -7.691
332 2HZ LYS 43 2HZ LYS 43 4.309 -2.743 -8.214
333 3HZ LYS 43 3HZ LYS 43 5.572 -2.996 -9.309
334 H ASN 44 H ASN 44 -1.260 -3.691 -7.092
335 HA ASN 44 HA ASN 44 -1.812 -5.612 -4.939
336 1HB ASN 44 2HB ASN 44 -3.114 -3.323 -5.248
337 2HB ASN 44 1HB ASN 44 -3.970 -4.227 -6.489
338 1HD2 ASN 44 1HD2 ASN 44 -2.731 -5.071 -3.271
339 2HD2 ASN 44 2HD2 ASN 44 -4.236 -5.659 -2.660
340 H ALA 45 H ALA 45 -3.725 -7.085 -5.655
341 HA ALA 45 HA ALA 45 -2.772 -8.539 -7.918
342 1HB ALA 45 1HB ALA 45 -5.085 -9.779 -7.358
343 2HB ALA 45 2HB ALA 45 -4.826 -8.937 -5.832
344 3HB ALA 45 3HB ALA 45 -3.600 -10.048 -6.444
345 H ARG 46 H ARG 46 -4.505 -5.793 -7.788
346 HA ARG 46 HA ARG 46 -6.485 -6.388 -9.791
347 1HB ARG 46 2HB ARG 46 -7.442 -4.744 -8.610
348 2HB ARG 46 1HB ARG 46 -5.910 -4.240 -7.918
349 1HG ARG 46 2HG ARG 46 -5.474 -2.781 -9.669
350 2HG ARG 46 1HG ARG 46 -6.720 -3.479 -10.701
351 1HD ARG 46 2HD ARG 46 -7.010 -1.683 -8.321
352 2HD ARG 46 1HD ARG 46 -7.673 -1.491 -9.943
353 HE ARG 46 HE ARG 46 -8.862 -2.878 -7.756
354 1HH1 ARG 46 1HH1 ARG 46 -8.594 -2.853 -11.234
355 2HH1 ARG 46 2HH1 ARG 46 -10.120 -3.634 -11.481
356 1HH2 ARG 46 1HH2 ARG 46 -10.864 -3.906 -8.078
357 2HH2 ARG 46 2HH2 ARG 46 -11.409 -4.232 -9.688
358 H GLY 47 H GLY 47 -3.202 -5.835 -9.852
359 1HA GLY 47 2HA GLY 47 -1.873 -5.802 -11.772
360 2HA GLY 47 1HA GLY 47 -3.285 -5.360 -12.715
361 H GLN 48 H GLN 48 -3.717 -3.174 -10.570
362 HA GLN 48 HA GLN 48 -1.759 -1.282 -11.671
363 1HB GLN 48 2HB GLN 48 -4.700 -1.092 -11.319
364 2HB GLN 48 1HB GLN 48 -3.767 0.352 -10.962
365 1HG GLN 48 2HG GLN 48 -3.888 -1.150 -13.564
366 2HG GLN 48 1HG GLN 48 -4.488 0.473 -13.224
367 1HE2 GLN 48 1HE2 GLN 48 -2.836 2.071 -12.566
368 2HE2 GLN 48 2HE2 GLN 48 -1.284 1.993 -13.320
369 H VAL 49 H VAL 49 -0.716 0.063 -10.288
370 HA VAL 49 HA VAL 49 -1.392 -0.229 -7.436
371 HB VAL 49 HB VAL 49 0.699 -1.046 -7.289
372 1HG1 VAL 49 1HG1 VAL 49 1.564 0.480 -9.712
373 2HG1 VAL 49 2HG1 VAL 49 0.975 -1.182 -9.705
374 3HG1 VAL 49 3HG1 VAL 49 2.474 -0.774 -8.870
375 1HG2 VAL 49 1HG2 VAL 49 1.563 1.806 -7.662
376 2HG2 VAL 49 2HG2 VAL 49 2.330 0.568 -6.668
377 3HG2 VAL 49 3HG2 VAL 49 0.752 1.211 -6.214
378 H GLY 50 H GLY 50 -1.961 1.535 -6.394
379 1HA GLY 50 2HA GLY 50 -1.430 4.130 -7.688
380 2HA GLY 50 1HA GLY 50 -2.833 3.791 -6.700
381 H LEU 51 H LEU 51 -2.514 5.356 -5.194
382 HA LEU 51 HA LEU 51 -0.060 5.105 -3.591
383 1HB LEU 51 2HB LEU 51 -1.515 7.415 -4.609
384 2HB LEU 51 1HB LEU 51 -1.209 7.519 -2.887
385 HG LEU 51 HG LEU 51 1.130 7.517 -3.181
386 1HD1 LEU 51 1HD1 LEU 51 0.588 5.908 -5.453
387 2HD1 LEU 51 2HD1 LEU 51 2.137 6.258 -4.689
388 3HD1 LEU 51 3HD1 LEU 51 1.536 7.298 -5.978
389 1HD2 LEU 51 1HD2 LEU 51 -0.331 9.154 -5.208
390 2HD2 LEU 51 2HD2 LEU 51 1.426 9.240 -5.084
391 3HD2 LEU 51 3HD2 LEU 51 0.422 9.657 -3.695
392 H VAL 52 H VAL 52 -0.362 4.104 -1.753
393 HA VAL 52 HA VAL 52 -3.021 3.981 -0.574
394 HB VAL 52 HB VAL 52 -2.189 1.836 -0.531
395 1HG1 VAL 52 1HG1 VAL 52 0.459 3.132 -0.235
396 2HG1 VAL 52 2HG1 VAL 52 -0.076 1.928 -1.393
397 3HG1 VAL 52 3HG1 VAL 52 0.281 1.456 0.269
398 1HG2 VAL 52 1HG2 VAL 52 -2.424 2.986 1.942
399 2HG2 VAL 52 2HG2 VAL 52 -0.814 2.278 2.023
400 3HG2 VAL 52 3HG2 VAL 52 -2.205 1.264 1.641
401 HA PRO 53 HA PRO 53 -2.304 7.090 2.515
402 1HB PRO 53 2HB PRO 53 -3.972 6.134 4.432
403 2HB PRO 53 1HB PRO 53 -4.579 6.888 2.946
404 1HG PRO 53 2HG PRO 53 -4.086 3.962 3.486
405 2HG PRO 53 1HG PRO 53 -5.606 4.732 2.949
406 1HD PRO 53 2HD PRO 53 -4.054 3.635 1.149
407 2HD PRO 53 1HD PRO 53 -4.671 5.277 0.837
408 H LYS 54 H LYS 54 -0.109 6.559 3.026
409 HA LYS 54 HA LYS 54 0.782 4.403 4.472
410 1HB LYS 54 2HB LYS 54 2.725 5.699 5.028
411 2HB LYS 54 1HB LYS 54 2.228 6.020 3.372
412 1HG LYS 54 2HG LYS 54 2.387 8.144 3.911
413 2HG LYS 54 1HG LYS 54 0.873 7.929 4.780
414 1HD LYS 54 2HD LYS 54 2.044 7.508 6.834
415 2HD LYS 54 1HD LYS 54 3.602 7.517 6.002
416 1HE LYS 54 2HE LYS 54 3.276 9.879 5.435
417 2HE LYS 54 1HE LYS 54 1.726 9.865 6.276
418 1HZ LYS 54 1HZ LYS 54 4.415 9.975 7.352
419 2HZ LYS 54 2HZ LYS 54 3.360 8.942 8.177
420 3HZ LYS 54 3HZ LYS 54 2.966 10.576 7.989
421 H ASN 55 H ASN 55 -1.032 7.088 5.568
422 HA ASN 55 HA ASN 55 -0.336 6.830 8.346
423 1HB ASN 55 2HB ASN 55 -1.454 8.829 6.851
424 2HB ASN 55 1HB ASN 55 -2.860 8.178 7.686
425 1HD2 ASN 55 1HD2 ASN 55 -1.780 10.764 8.056
426 2HD2 ASN 55 2HD2 ASN 55 -1.233 10.880 9.691
427 H TYR 56 H TYR 56 -2.349 5.120 6.247
428 HA TYR 56 HA TYR 56 -4.041 4.184 8.467
429 1HB TYR 56 2HB TYR 56 -4.520 3.863 5.498
430 2HB TYR 56 1HB TYR 56 -5.624 3.418 6.790
431 HD1 TYR 56 1HD TYR 56 -6.513 5.089 4.578
432 HD2 TYR 56 2HD TYR 56 -4.633 6.205 8.224
433 HE1 TYR 56 1HE TYR 56 -7.570 7.302 4.435
434 HE2 TYR 56 2HE TYR 56 -5.684 8.424 8.095
435 HH TYR 56 HH TYR 56 -7.313 9.524 5.265
436 H VAL 57 H VAL 57 -1.220 3.359 7.435
437 HA VAL 57 HA VAL 57 -1.805 0.498 7.614
438 HB VAL 57 HB VAL 57 -0.777 -0.164 5.684
439 1HG1 VAL 57 1HG1 VAL 57 -1.633 1.040 3.879
440 2HG1 VAL 57 2HG1 VAL 57 -1.433 2.589 4.696
441 3HG1 VAL 57 3HG1 VAL 57 -2.697 1.474 5.216
442 1HG2 VAL 57 1HG2 VAL 57 1.391 0.567 5.770
443 2HG2 VAL 57 2HG2 VAL 57 0.930 2.246 6.053
444 3HG2 VAL 57 3HG2 VAL 57 0.788 1.553 4.437
445 H VAL 58 H VAL 58 0.166 -0.826 7.890
446 HA VAL 58 HA VAL 58 2.257 0.605 9.388
447 HB VAL 58 HB VAL 58 0.740 -0.669 10.907
448 1HG1 VAL 58 1HG1 VAL 58 1.863 -3.166 9.673
449 2HG1 VAL 58 2HG1 VAL 58 0.301 -2.489 9.208
450 3HG1 VAL 58 3HG1 VAL 58 0.576 -3.014 10.869
451 1HG2 VAL 58 1HG2 VAL 58 2.504 -1.755 12.169
452 2HG2 VAL 58 2HG2 VAL 58 3.099 -0.246 11.477
453 3HG2 VAL 58 3HG2 VAL 58 3.537 -1.786 10.740
454 H VAL 59 H VAL 59 4.096 0.469 8.264
455 HA VAL 59 HA VAL 59 4.481 -1.328 6.141
456 HB VAL 59 HB VAL 59 6.698 0.137 7.551
457 1HG1 VAL 59 1HG1 VAL 59 7.262 0.103 4.889
458 2HG1 VAL 59 2HG1 VAL 59 6.429 -1.438 5.084
459 3HG1 VAL 59 3HG1 VAL 59 7.859 -1.083 6.053
460 1HG2 VAL 59 1HG2 VAL 59 6.059 2.092 6.656
461 2HG2 VAL 59 2HG2 VAL 59 4.471 1.340 6.507
462 3HG2 VAL 59 3HG2 VAL 59 5.577 1.344 5.134
463 H LEU 60 H LEU 60 5.812 -3.015 5.832
464 HA LEU 60 HA LEU 60 6.524 -4.554 8.189
465 1HB LEU 60 2HB LEU 60 5.229 -5.196 5.727
466 2HB LEU 60 1HB LEU 60 6.743 -6.078 5.799
467 HG LEU 60 HG LEU 60 6.102 -7.148 7.847
468 1HD1 LEU 60 1HD1 LEU 60 3.472 -6.541 8.348
469 2HD1 LEU 60 2HD1 LEU 60 4.177 -4.969 7.973
470 3HD1 LEU 60 3HD1 LEU 60 4.861 -5.956 9.264
471 1HD2 LEU 60 1HD2 LEU 60 3.814 -7.178 5.885
472 2HD2 LEU 60 2HD2 LEU 60 4.150 -8.410 7.101
473 3HD2 LEU 60 3HD2 LEU 60 5.284 -8.146 5.776
474 H SER 61 H SER 61 8.481 -5.850 7.919
475 HA SER 61 HA SER 61 10.736 -4.286 7.425
476 1HB SER 61 2HB SER 61 11.980 -6.514 7.581
477 2HB SER 61 1HB SER 61 10.984 -6.072 8.966
478 HG SER 61 HG SER 61 10.278 -7.857 6.875