NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
12087 |
1sjg   |
4992 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H MET 1 1HT MET 1 -2.885 -20.007 -6.459
2 2H MET 1 2HT MET 1 -3.867 -18.690 -6.867
3 3H MET 1 3HT MET 1 -2.450 -18.456 -5.972
4 HA MET 1 HA MET 1 -1.061 -19.093 -7.694
5 1HB MET 1 1HB MET 1 -3.590 -19.432 -9.340
6 2HB MET 1 2HB MET 1 -2.579 -20.738 -8.754
7 1HG MET 1 1HG MET 1 -0.723 -19.909 -10.104
8 2HG MET 1 2HG MET 1 -1.751 -18.615 -10.718
9 1HE MET 1 1HE MET 1 -1.148 -19.344 -13.194
10 2HE MET 1 2HE MET 1 -1.344 -20.988 -13.807
11 3HE MET 1 3HE MET 1 -0.139 -20.647 -12.566
12 H SER 2 H SER 2 -4.069 -17.305 -8.551
13 HA SER 2 HA SER 2 -2.416 -15.053 -9.315
14 1HB SER 2 1HB SER 2 -5.432 -15.411 -9.403
15 2HB SER 2 2HB SER 2 -4.342 -15.706 -10.757
16 HG SER 2 HG SER 2 -4.428 -13.719 -11.186
17 H PHE 3 H PHE 3 -5.153 -15.758 -7.141
18 HA PHE 3 HA PHE 3 -4.534 -13.420 -5.561
19 1HB PHE 3 1HB PHE 3 -6.576 -14.256 -4.212
20 2HB PHE 3 2HB PHE 3 -6.838 -15.359 -5.551
21 HD1 PHE 3 1HD PHE 3 -7.327 -12.062 -4.314
22 HD2 PHE 3 2HD PHE 3 -7.191 -14.388 -7.871
23 HE1 PHE 3 1HE PHE 3 -8.567 -10.305 -5.495
24 HE2 PHE 3 2HE PHE 3 -8.439 -12.620 -9.059
25 HZ PHE 3 HZ PHE 3 -9.126 -10.586 -7.872
26 H GLU 4 H GLU 4 -2.971 -13.647 -4.264
27 HA GLU 4 HA GLU 4 -2.527 -16.200 -2.885
28 1HB GLU 4 1HB GLU 4 -0.251 -15.330 -2.515
29 2HB GLU 4 2HB GLU 4 -0.686 -13.844 -3.340
30 1HG GLU 4 1HG GLU 4 0.590 -15.225 -4.823
31 2HG GLU 4 2HG GLU 4 -1.069 -15.126 -5.407
32 H LYS 5 H LYS 5 -2.326 -16.170 -0.667
33 HA LYS 5 HA LYS 5 -3.646 -14.017 0.669
34 1HB LYS 5 1HB LYS 5 -2.261 -16.454 1.764
35 2HB LYS 5 2HB LYS 5 -3.984 -16.320 1.409
36 1HG LYS 5 1HG LYS 5 -4.162 -14.564 3.135
37 2HG LYS 5 2HG LYS 5 -2.470 -14.839 3.551
38 1HD LYS 5 1HD LYS 5 -3.024 -17.211 4.029
39 2HD LYS 5 2HD LYS 5 -4.722 -16.843 3.722
40 1HE LYS 5 1HE LYS 5 -4.630 -15.147 5.532
41 2HE LYS 5 2HE LYS 5 -2.987 -15.678 5.891
42 1HZ LYS 5 1HZ LYS 5 -4.484 -16.803 7.365
43 2HZ LYS 5 2HZ LYS 5 -3.984 -17.968 6.226
44 3HZ LYS 5 3HZ LYS 5 -5.481 -17.209 6.084
45 H ILE 6 H ILE 6 -2.736 -12.316 1.229
46 HA ILE 6 HA ILE 6 0.182 -12.214 1.358
47 HB ILE 6 HB ILE 6 -1.001 -10.693 -0.162
48 1HG1 ILE 6 1HG1 ILE 6 0.529 -9.318 2.043
49 2HG1 ILE 6 2HG1 ILE 6 0.176 -8.586 0.479
50 1HG2 ILE 6 1HG2 ILE 6 -2.210 -8.722 0.674
51 2HG2 ILE 6 2HG2 ILE 6 -2.125 -9.401 2.301
52 3HG2 ILE 6 3HG2 ILE 6 -3.017 -10.248 1.039
53 1HD1 ILE 6 1HD1 ILE 6 2.435 -9.442 0.527
54 2HD1 ILE 6 2HD1 ILE 6 1.466 -10.347 -0.634
55 3HD1 ILE 6 3HD1 ILE 6 1.849 -11.051 0.936
56 H CYS 7 H CYS 7 -2.667 -11.691 3.147
57 HA CYS 7 HA CYS 7 -1.343 -12.018 5.646
58 1HB CYS 7 1HB CYS 7 -0.745 -9.708 5.454
59 2HB CYS 7 2HB CYS 7 -2.030 -9.840 6.630
60 HG CYS 7 HG CYS 7 -2.126 -7.532 4.815
61 H SER 8 H SER 8 -3.049 -11.090 7.375
62 HA SER 8 HA SER 8 -5.685 -12.037 6.585
63 1HB SER 8 1HB SER 8 -4.794 -13.919 7.771
64 2HB SER 8 2HB SER 8 -5.907 -13.080 8.819
65 HG SER 8 HG SER 8 -3.184 -12.395 9.022
66 H LEU 9 H LEU 9 -7.448 -11.160 7.785
67 HA LEU 9 HA LEU 9 -7.079 -8.521 8.685
68 1HB LEU 9 1HB LEU 9 -9.476 -8.934 9.482
69 2HB LEU 9 2HB LEU 9 -9.317 -10.495 8.720
70 HG LEU 9 HG LEU 9 -8.926 -9.386 6.531
71 1HD1 LEU 9 1HD1 LEU 9 -11.191 -10.090 7.177
72 2HD1 LEU 9 2HD1 LEU 9 -11.221 -8.635 6.184
73 3HD1 LEU 9 3HD1 LEU 9 -11.454 -8.517 7.931
74 1HD2 LEU 9 1HD2 LEU 9 -8.019 -7.261 7.400
75 2HD2 LEU 9 2HD2 LEU 9 -9.608 -6.862 8.043
76 3HD2 LEU 9 3HD2 LEU 9 -9.375 -7.004 6.302
77 H ASP 10 H ASP 10 -6.750 -11.570 10.053
78 HA ASP 10 HA ASP 10 -7.018 -10.923 12.816
79 1HB ASP 10 1HB ASP 10 -5.415 -13.074 11.397
80 2HB ASP 10 2HB ASP 10 -7.042 -13.249 12.032
81 H ASP 11 H ASP 11 -4.610 -10.366 10.398
82 HA ASP 11 HA ASP 11 -2.561 -9.576 12.288
83 1HB ASP 11 1HB ASP 11 -1.350 -8.682 10.259
84 2HB ASP 11 2HB ASP 11 -2.692 -9.208 9.273
85 H ILE 12 H ILE 12 -4.356 -7.897 9.695
86 HA ILE 12 HA ILE 12 -3.848 -5.453 11.206
87 HB ILE 12 HB ILE 12 -4.227 -4.155 9.216
88 1HG1 ILE 12 1HG1 ILE 12 -5.820 -5.672 8.066
89 2HG1 ILE 12 2HG1 ILE 12 -4.499 -6.787 7.733
90 1HG2 ILE 12 1HG2 ILE 12 -2.212 -4.841 7.965
91 2HG2 ILE 12 2HG2 ILE 12 -2.249 -6.388 8.815
92 3HG2 ILE 12 3HG2 ILE 12 -1.963 -4.898 9.715
93 1HD1 ILE 12 1HD1 ILE 12 -3.405 -5.120 6.364
94 2HD1 ILE 12 2HD1 ILE 12 -4.713 -3.983 6.689
95 3HD1 ILE 12 3HD1 ILE 12 -5.034 -5.467 5.786
96 H TRP 13 H TRP 13 -5.267 -4.233 11.934
97 HA TRP 13 HA TRP 13 -8.053 -4.907 11.751
98 1HB TRP 13 1HB TRP 13 -8.064 -3.001 13.542
99 2HB TRP 13 2HB TRP 13 -6.343 -3.249 13.472
100 HD1 TRP 13 HD TRP 13 -5.478 -5.838 13.883
101 HE1 TRP 13 1HE TRP 13 -6.328 -7.560 15.599
102 HE3 TRP 13 3HE TRP 13 -10.033 -3.772 14.873
103 HZ2 TRP 13 2HZ TRP 13 -8.641 -7.967 17.186
104 HZ3 TRP 13 3HZ TRP 13 -11.508 -4.879 16.498
105 HH2 TRP 13 HH TRP 13 -10.825 -6.936 17.630
106 H VAL 14 H VAL 14 -9.550 -3.045 11.768
107 HA VAL 14 HA VAL 14 -9.314 -1.544 9.388
108 HB VAL 14 HB VAL 14 -11.171 -1.021 11.738
109 1HG1 VAL 14 1HG1 VAL 14 -12.634 0.053 10.090
110 2HG1 VAL 14 2HG1 VAL 14 -11.416 -0.213 8.841
111 3HG1 VAL 14 3HG1 VAL 14 -11.067 0.858 10.198
112 1HG2 VAL 14 1HG2 VAL 14 -11.415 -3.320 10.950
113 2HG2 VAL 14 2HG2 VAL 14 -11.620 -2.743 9.296
114 3HG2 VAL 14 3HG2 VAL 14 -12.833 -2.365 10.517
115 H GLY 15 H GLY 15 -8.078 0.176 9.083
116 1HA GLY 15 1HA GLY 15 -7.632 2.050 11.280
117 2HA GLY 15 2HA GLY 15 -7.375 2.363 9.566
118 H GLU 16 H GLU 16 -6.170 -0.634 9.955
119 HA GLU 16 HA GLU 16 -3.526 0.363 10.699
120 1HB GLU 16 1HB GLU 16 -3.004 -2.141 11.119
121 2HB GLU 16 2HB GLU 16 -4.685 -2.394 10.840
122 1HG GLU 16 1HG GLU 16 -5.342 -1.394 12.775
123 2HG GLU 16 2HG GLU 16 -3.806 -0.538 12.969
124 H MET 17 H MET 17 -1.728 -0.286 9.448
125 HA MET 17 HA MET 17 -2.228 -1.724 7.011
126 1HB MET 17 1HB MET 17 -2.732 0.560 6.381
127 2HB MET 17 2HB MET 17 -1.292 0.006 5.557
128 1HG MET 17 1HG MET 17 -1.220 1.786 7.985
129 2HG MET 17 2HG MET 17 -1.238 2.395 6.338
130 1HE MET 17 1HE MET 17 0.996 3.145 8.520
131 2HE MET 17 2HE MET 17 0.964 3.810 6.884
132 3HE MET 17 3HE MET 17 2.442 3.093 7.516
133 H GLU 18 H GLU 18 -0.390 -2.695 6.164
134 HA GLU 18 HA GLU 18 2.122 -1.862 7.023
135 1HB GLU 18 1HB GLU 18 1.749 -3.100 9.013
136 2HB GLU 18 2HB GLU 18 2.905 -3.994 8.046
137 1HG GLU 18 1HG GLU 18 1.190 -5.527 7.349
138 2HG GLU 18 2HG GLU 18 0.008 -4.643 8.327
139 H THR 19 H THR 19 3.925 -3.118 6.033
140 HA THR 19 HA THR 19 2.972 -3.829 3.390
141 HB THR 19 HB THR 19 4.756 -2.024 3.570
142 HG1 THR 19 1HG THR 19 4.524 -3.847 1.816
143 1HG2 THR 19 1HG2 THR 19 6.060 -2.988 5.418
144 2HG2 THR 19 2HG2 THR 19 7.072 -2.734 3.990
145 3HG2 THR 19 3HG2 THR 19 6.490 -4.351 4.386
146 H PHE 20 H PHE 20 3.379 -5.693 2.453
147 HA PHE 20 HA PHE 20 4.953 -7.689 3.878
148 1HB PHE 20 1HB PHE 20 3.324 -9.418 2.997
149 2HB PHE 20 2HB PHE 20 2.260 -8.095 2.577
150 HD1 PHE 20 1HD PHE 20 3.822 -9.883 5.373
151 HD2 PHE 20 2HD PHE 20 0.883 -7.033 4.220
152 HE1 PHE 20 1HE PHE 20 2.844 -9.984 7.614
153 HE2 PHE 20 2HE PHE 20 -0.095 -7.130 6.455
154 HZ PHE 20 HZ PHE 20 0.882 -8.607 8.162
155 H GLU 21 H GLU 21 5.826 -9.259 2.445
156 HA GLU 21 HA GLU 21 6.317 -8.081 -0.179
157 1HB GLU 21 1HB GLU 21 7.772 -10.318 1.241
158 2HB GLU 21 2HB GLU 21 8.216 -8.615 1.296
159 1HG GLU 21 1HG GLU 21 8.638 -8.606 -1.077
160 2HG GLU 21 2HG GLU 21 8.166 -10.301 -1.176
161 H THR 22 H THR 22 5.813 -9.152 -1.990
162 HA THR 22 HA THR 22 3.818 -11.210 -1.721
163 HB THR 22 HB THR 22 3.485 -10.958 -4.128
164 HG1 THR 22 1HG THR 22 4.846 -9.400 -5.229
165 1HG2 THR 22 1HG2 THR 22 2.525 -9.197 -2.670
166 2HG2 THR 22 2HG2 THR 22 2.976 -8.581 -4.268
167 3HG2 THR 22 3HG2 THR 22 4.018 -8.270 -2.884
168 H SER 23 H SER 23 3.988 -13.046 -3.395
169 HA SER 23 HA SER 23 6.184 -14.642 -2.797
170 1HB SER 23 1HB SER 23 5.120 -16.182 -4.281
171 2HB SER 23 2HB SER 23 4.200 -14.856 -5.008
172 HG SER 23 HG SER 23 3.403 -16.317 -3.035
173 H ASP 24 H ASP 24 5.781 -12.163 -5.109
174 HA ASP 24 HA ASP 24 7.777 -13.226 -6.965
175 1HB ASP 24 1HB ASP 24 6.245 -10.627 -7.041
176 2HB ASP 24 2HB ASP 24 5.722 -12.111 -7.828
177 H GLY 25 H GLY 25 7.598 -11.272 -4.195
178 1HA GLY 25 1HA GLY 25 10.331 -10.296 -4.702
179 2HA GLY 25 2HA GLY 25 9.647 -10.583 -3.110
180 H THR 26 H THR 26 7.332 -9.136 -4.954
181 HA THR 26 HA THR 26 8.197 -6.418 -4.761
182 HB THR 26 HB THR 26 5.413 -7.506 -5.206
183 HG1 THR 26 1HG THR 26 7.695 -7.507 -6.772
184 1HG2 THR 26 1HG2 THR 26 6.772 -4.953 -6.082
185 2HG2 THR 26 2HG2 THR 26 5.579 -5.087 -4.791
186 3HG2 THR 26 3HG2 THR 26 5.116 -5.423 -6.463
187 H GLU 27 H GLU 27 7.826 -5.016 -3.064
188 HA GLU 27 HA GLU 27 6.363 -6.155 -0.837
189 1HB GLU 27 1HB GLU 27 7.491 -4.377 0.511
190 2HB GLU 27 2HB GLU 27 8.360 -3.889 -0.948
191 1HG GLU 27 1HG GLU 27 9.271 -6.188 -1.097
192 2HG GLU 27 2HG GLU 27 8.475 -6.574 0.420
193 H VAL 28 H VAL 28 4.551 -5.476 -0.307
194 HA VAL 28 HA VAL 28 3.419 -3.165 -1.724
195 HB VAL 28 HB VAL 28 2.198 -5.846 -1.089
196 1HG1 VAL 28 1HG1 VAL 28 0.267 -5.143 -2.407
197 2HG1 VAL 28 2HG1 VAL 28 0.963 -3.526 -2.526
198 3HG1 VAL 28 3HG1 VAL 28 0.489 -4.170 -0.952
199 1HG2 VAL 28 1HG2 VAL 28 3.750 -6.005 -2.926
200 2HG2 VAL 28 2HG2 VAL 28 2.968 -4.651 -3.737
201 3HG2 VAL 28 3HG2 VAL 28 2.099 -6.173 -3.528
202 H LEU 29 H LEU 29 2.025 -1.967 -0.546
203 HA LEU 29 HA LEU 29 2.063 -2.295 2.382
204 1HB LEU 29 1HB LEU 29 1.036 -0.002 0.680
205 2HB LEU 29 2HB LEU 29 2.684 -0.099 1.243
206 HG LEU 29 HG LEU 29 1.527 1.488 2.578
207 1HD1 LEU 29 1HD1 LEU 29 -0.462 -0.638 3.303
208 2HD1 LEU 29 2HD1 LEU 29 -0.758 0.771 2.286
209 3HD1 LEU 29 3HD1 LEU 29 -0.360 0.986 3.989
210 1HD2 LEU 29 1HD2 LEU 29 3.185 0.153 3.698
211 2HD2 LEU 29 2HD2 LEU 29 1.962 -1.047 4.125
212 3HD2 LEU 29 3HD2 LEU 29 1.879 0.579 4.804
213 H ILE 30 H ILE 30 0.355 -3.285 3.249
214 HA ILE 30 HA ILE 30 -2.137 -3.301 1.742
215 HB ILE 30 HB ILE 30 -1.229 -5.218 3.941
216 1HG1 ILE 30 1HG1 ILE 30 -1.767 -5.612 1.017
217 2HG1 ILE 30 2HG1 ILE 30 -1.524 -6.965 2.116
218 1HG2 ILE 30 1HG2 ILE 30 -3.331 -6.422 3.555
219 2HG2 ILE 30 2HG2 ILE 30 -3.833 -5.175 2.414
220 3HG2 ILE 30 3HG2 ILE 30 -3.623 -4.773 4.116
221 1HD1 ILE 30 1HD1 ILE 30 0.505 -4.883 1.378
222 2HD1 ILE 30 2HD1 ILE 30 0.473 -6.550 0.825
223 3HD1 ILE 30 3HD1 ILE 30 0.781 -6.190 2.522
224 H VAL 31 H VAL 31 -3.511 -1.935 2.360
225 HA VAL 31 HA VAL 31 -3.483 -0.965 5.138
226 HB VAL 31 HB VAL 31 -2.887 0.802 3.432
227 1HG1 VAL 31 1HG1 VAL 31 -5.561 0.287 2.255
228 2HG1 VAL 31 2HG1 VAL 31 -3.985 -0.023 1.521
229 3HG1 VAL 31 3HG1 VAL 31 -4.491 1.632 1.866
230 1HG2 VAL 31 1HG2 VAL 31 -4.071 1.538 5.494
231 2HG2 VAL 31 2HG2 VAL 31 -5.600 1.236 4.690
232 3HG2 VAL 31 3HG2 VAL 31 -4.533 2.499 4.090
233 H ASN 32 H ASN 32 -5.317 -1.498 6.322
234 HA ASN 32 HA ASN 32 -7.727 -1.812 4.662
235 1HB ASN 32 1HB ASN 32 -7.254 -2.769 7.506
236 2HB ASN 32 2HB ASN 32 -7.171 -3.797 6.080
237 1HD2 ASN 32 1HD2 ASN 32 -8.916 -4.001 8.391
238 2HD2 ASN 32 2HD2 ASN 32 -10.526 -3.952 7.761
239 H SER 33 H SER 33 -8.507 0.118 4.516
240 HA SER 33 HA SER 33 -8.533 1.793 6.880
241 1HB SER 33 1HB SER 33 -7.344 2.848 5.103
242 2HB SER 33 2HB SER 33 -8.879 3.691 5.307
243 HG SER 33 HG SER 33 -8.507 1.628 3.401
244 H GLU 34 H GLU 34 -10.312 3.142 7.272
245 HA GLU 34 HA GLU 34 -12.821 1.787 7.050
246 1HB GLU 34 1HB GLU 34 -12.180 3.013 9.110
247 2HB GLU 34 2HB GLU 34 -13.680 3.611 8.438
248 1HG GLU 34 1HG GLU 34 -12.355 5.462 9.259
249 2HG GLU 34 2HG GLU 34 -12.509 5.568 7.512
250 H GLU 35 H GLU 35 -11.190 4.466 5.564
251 HA GLU 35 HA GLU 35 -13.560 5.335 4.122
252 1HB GLU 35 1HB GLU 35 -10.778 6.485 4.282
253 2HB GLU 35 2HB GLU 35 -12.176 6.995 5.203
254 1HG GLU 35 1HG GLU 35 -13.267 7.795 3.208
255 2HG GLU 35 2HG GLU 35 -11.927 7.211 2.221
256 H HIS 36 H HIS 36 -10.281 4.049 3.307
257 HA HIS 36 HA HIS 36 -11.040 4.091 0.470
258 1HB HIS 36 1HB HIS 36 -8.629 3.606 0.014
259 2HB HIS 36 2HB HIS 36 -8.318 3.612 1.742
260 HD1 HIS 36 1HD HIS 36 -7.622 5.706 -0.905
261 HD2 HIS 36 2HD HIS 36 -9.479 6.331 2.753
262 HE1 HIS 36 1HE HIS 36 -7.497 8.171 -0.488
263 HE2 HIS 36 2HE HIS 36 -8.942 8.496 1.589
264 H GLY 37 H GLY 37 -11.160 1.992 2.994
265 1HA GLY 37 1HA GLY 37 -11.603 -0.260 1.249
266 2HA GLY 37 2HA GLY 37 -11.811 -0.228 2.994
267 H VAL 38 H VAL 38 -10.632 -2.367 1.705
268 HA VAL 38 HA VAL 38 -7.954 -2.191 2.786
269 HB VAL 38 HB VAL 38 -9.290 -4.081 3.629
270 1HG1 VAL 38 1HG1 VAL 38 -9.456 -5.026 0.778
271 2HG1 VAL 38 2HG1 VAL 38 -10.786 -4.437 1.775
272 3HG1 VAL 38 3HG1 VAL 38 -9.967 -5.939 2.200
273 1HG2 VAL 38 1HG2 VAL 38 -7.740 -5.927 3.149
274 2HG2 VAL 38 2HG2 VAL 38 -6.894 -4.416 3.485
275 3HG2 VAL 38 3HG2 VAL 38 -7.047 -4.990 1.825
276 H LYS 39 H LYS 39 -6.338 -1.908 1.598
277 HA LYS 39 HA LYS 39 -6.494 -2.573 -1.244
278 1HB LYS 39 1HB LYS 39 -5.110 -0.385 -1.558
279 2HB LYS 39 2HB LYS 39 -5.721 -0.035 0.028
280 1HG LYS 39 1HG LYS 39 -7.963 -0.016 -0.644
281 2HG LYS 39 2HG LYS 39 -7.567 -0.669 -2.237
282 1HD LYS 39 1HD LYS 39 -6.237 1.339 -2.692
283 2HD LYS 39 2HD LYS 39 -6.739 1.975 -1.118
284 1HE LYS 39 1HE LYS 39 -9.018 2.044 -1.781
285 2HE LYS 39 2HE LYS 39 -8.653 1.222 -3.298
286 1HZ LYS 39 1HZ LYS 39 -7.564 3.889 -2.546
287 2HZ LYS 39 2HZ LYS 39 -8.930 3.646 -3.511
288 3HZ LYS 39 3HZ LYS 39 -7.426 3.114 -4.042
289 H ALA 40 H ALA 40 -4.693 -3.138 -2.243
290 HA ALA 40 HA ALA 40 -2.244 -3.288 -0.666
291 1HB ALA 40 1HB ALA 40 -3.213 -5.531 -0.932
292 2HB ALA 40 2HB ALA 40 -1.730 -5.381 -1.872
293 3HB ALA 40 3HB ALA 40 -3.299 -5.287 -2.676
294 H TYR 41 H TYR 41 -0.898 -1.863 -1.540
295 HA TYR 41 HA TYR 41 -0.679 -1.702 -4.447
296 1HB TYR 41 1HB TYR 41 -2.032 0.274 -4.174
297 2HB TYR 41 2HB TYR 41 -0.388 0.777 -4.175
298 HD1 TYR 41 1HD TYR 41 -3.422 0.850 -2.352
299 HD2 TYR 41 2HD TYR 41 0.789 1.178 -1.895
300 HE1 TYR 41 1HE TYR 41 -3.747 1.998 -0.207
301 HE2 TYR 41 2HE TYR 41 0.474 2.329 0.248
302 HH TYR 41 HH TYR 41 -2.523 2.422 1.838
303 H GLN 42 H GLN 42 1.277 -0.570 -5.171
304 HA GLN 42 HA GLN 42 3.626 -1.537 -4.046
305 1HB GLN 42 1HB GLN 42 4.817 0.189 -5.406
306 2HB GLN 42 2HB GLN 42 3.280 0.972 -5.724
307 1HG GLN 42 1HG GLN 42 3.979 -0.373 -7.580
308 2HG GLN 42 2HG GLN 42 2.519 -1.040 -6.837
309 1HE2 GLN 42 1HE2 GLN 42 2.619 -2.980 -5.775
310 2HE2 GLN 42 2HE2 GLN 42 3.981 -4.023 -5.891
311 H ALA 43 H ALA 43 5.072 -0.821 -2.551
312 HA ALA 43 HA ALA 43 4.022 1.319 -0.838
313 1HB ALA 43 1HB ALA 43 4.017 -0.944 0.090
314 2HB ALA 43 2HB ALA 43 5.004 0.185 1.021
315 3HB ALA 43 3HB ALA 43 5.772 -0.982 -0.053
316 H MET 44 H MET 44 6.962 0.101 -2.325
317 HA MET 44 HA MET 44 8.493 1.794 -0.599
318 1HB MET 44 1HB MET 44 10.502 0.764 -1.519
319 2HB MET 44 2HB MET 44 9.515 -0.122 -2.672
320 1HG MET 44 1HG MET 44 10.163 -1.503 -0.757
321 2HG MET 44 2HG MET 44 8.416 -1.313 -0.877
322 1HE MET 44 1HE MET 44 8.083 -2.179 1.612
323 2HE MET 44 2HE MET 44 8.986 -1.552 2.991
324 3HE MET 44 3HE MET 44 9.823 -2.431 1.711
325 H CYS 45 H CYS 45 7.687 3.841 -1.439
326 HA CYS 45 HA CYS 45 9.350 4.682 -3.701
327 1HB CYS 45 1HB CYS 45 6.877 5.610 -3.272
328 2HB CYS 45 2HB CYS 45 8.138 6.619 -3.977
329 HA PRO 46 HA PRO 46 10.754 7.323 0.345
330 1HB PRO 46 1HB PRO 46 10.328 6.422 2.384
331 2HB PRO 46 2HB PRO 46 11.756 5.410 2.136
332 1HG PRO 46 1HG PRO 46 9.313 4.348 2.455
333 2HG PRO 46 2HG PRO 46 10.519 3.624 1.373
334 1HD PRO 46 1HD PRO 46 8.212 5.424 0.687
335 2HD PRO 46 2HD PRO 46 8.717 3.894 -0.073
336 H HIS 47 H HIS 47 12.321 7.857 -0.904
337 HA HIS 47 HA HIS 47 14.347 5.923 -1.574
338 1HB HIS 47 1HB HIS 47 15.418 7.858 -2.912
339 2HB HIS 47 2HB HIS 47 13.915 8.728 -2.550
340 HD2 HIS 47 2HD HIS 47 15.105 5.602 -4.517
341 HE1 HIS 47 1HE HIS 47 11.118 6.398 -5.657
342 HE2 HIS 47 2HE HIS 47 13.069 4.843 -5.880
343 H GLN 48 H GLN 48 13.911 7.298 1.074
344 HA GLN 48 HA GLN 48 16.738 7.118 1.742
345 1HB GLN 48 1HB GLN 48 14.662 8.843 3.173
346 2HB GLN 48 2HB GLN 48 15.773 9.498 1.991
347 1HG GLN 48 1HG GLN 48 16.642 10.078 4.107
348 2HG GLN 48 2HG GLN 48 17.674 8.810 3.477
349 1HE2 GLN 48 1HE2 GLN 48 17.782 6.794 4.530
350 2HE2 GLN 48 2HE2 GLN 48 17.062 6.572 6.067
351 H GLU 49 H GLU 49 16.970 5.325 2.869
352 HA GLU 49 HA GLU 49 14.914 3.566 3.227
353 1HB GLU 49 1HB GLU 49 16.978 2.551 2.988
354 2HB GLU 49 2HB GLU 49 16.525 2.175 4.632
355 1HG GLU 49 1HG GLU 49 18.816 2.661 4.703
356 2HG GLU 49 2HG GLU 49 18.009 4.082 5.369
357 H ILE 50 H ILE 50 13.302 3.512 4.375
358 HA ILE 50 HA ILE 50 13.396 3.622 7.238
359 HB ILE 50 HB ILE 50 12.956 6.034 6.452
360 1HG1 ILE 50 1HG1 ILE 50 10.696 4.653 7.922
361 2HG1 ILE 50 2HG1 ILE 50 10.930 6.396 7.858
362 1HG2 ILE 50 1HG2 ILE 50 10.748 6.540 5.479
363 2HG2 ILE 50 2HG2 ILE 50 10.445 4.809 5.324
364 3HG2 ILE 50 3HG2 ILE 50 11.757 5.560 4.415
365 1HD1 ILE 50 1HD1 ILE 50 12.840 4.415 9.081
366 2HD1 ILE 50 2HD1 ILE 50 11.750 5.495 9.947
367 3HD1 ILE 50 3HD1 ILE 50 13.072 6.160 8.988
368 H LEU 51 H LEU 51 11.150 2.703 7.955
369 HA LEU 51 HA LEU 51 10.153 1.121 5.728
370 1HB LEU 51 1HB LEU 51 9.811 0.578 8.684
371 2HB LEU 51 2HB LEU 51 11.059 -0.139 7.691
372 HG LEU 51 HG LEU 51 8.083 -0.627 7.449
373 1HD1 LEU 51 1HD1 LEU 51 10.376 -1.752 5.833
374 2HD1 LEU 51 2HD1 LEU 51 9.129 -0.649 5.238
375 3HD1 LEU 51 3HD1 LEU 51 8.696 -2.277 5.746
376 1HD2 LEU 51 1HD2 LEU 51 8.672 -2.898 8.114
377 2HD2 LEU 51 2HD2 LEU 51 9.171 -1.741 9.351
378 3HD2 LEU 51 3HD2 LEU 51 10.365 -2.430 8.252
379 H LEU 52 H LEU 52 8.634 2.156 4.792
380 HA LEU 52 HA LEU 52 7.095 4.258 5.770
381 1HB LEU 52 1HB LEU 52 6.659 2.453 3.393
382 2HB LEU 52 2HB LEU 52 7.596 3.921 3.427
383 HG LEU 52 HG LEU 52 5.393 5.181 3.842
384 1HD1 LEU 52 1HD1 LEU 52 6.594 5.202 1.750
385 2HD1 LEU 52 2HD1 LEU 52 4.860 5.099 1.440
386 3HD1 LEU 52 3HD1 LEU 52 5.874 3.665 1.286
387 1HD2 LEU 52 1HD2 LEU 52 3.367 4.074 3.028
388 2HD2 LEU 52 2HD2 LEU 52 4.000 3.204 4.425
389 3HD2 LEU 52 3HD2 LEU 52 4.257 2.569 2.802
390 H SER 53 H SER 53 6.393 0.849 5.800
391 HA SER 53 HA SER 53 3.620 1.074 6.234
392 1HB SER 53 1HB SER 53 4.644 -0.736 5.185
393 2HB SER 53 2HB SER 53 3.915 -1.375 6.620
394 HG SER 53 HG SER 53 5.920 -1.833 7.306
395 H GLU 54 H GLU 54 6.426 1.219 8.242
396 HA GLU 54 HA GLU 54 4.802 1.070 10.682
397 1HB GLU 54 1HB GLU 54 6.942 0.942 11.847
398 2HB GLU 54 2HB GLU 54 7.811 1.226 10.351
399 1HG GLU 54 1HG GLU 54 7.961 -1.090 10.994
400 2HG GLU 54 2HG GLU 54 7.068 -0.925 9.485
401 H GLY 55 H GLY 55 5.256 3.147 8.444
402 1HA GLY 55 1HA GLY 55 6.174 5.333 8.297
403 2HA GLY 55 2HA GLY 55 6.177 5.402 10.058
404 H SER 56 H SER 56 4.340 6.005 7.173
405 HA SER 56 HA SER 56 2.054 6.586 8.833
406 1HB SER 56 1HB SER 56 3.389 8.643 7.196
407 2HB SER 56 2HB SER 56 3.494 8.495 8.954
408 HG SER 56 HG SER 56 1.285 8.926 9.077
409 H TYR 57 H TYR 57 0.438 6.736 7.962
410 HA TYR 57 HA TYR 57 -0.070 6.977 5.081
411 1HB TYR 57 1HB TYR 57 -1.487 5.063 6.995
412 2HB TYR 57 2HB TYR 57 -0.540 4.609 5.585
413 HD1 TYR 57 1HD TYR 57 -3.779 5.571 6.793
414 HD2 TYR 57 2HD TYR 57 -1.413 5.172 3.280
415 HE1 TYR 57 1HE TYR 57 -5.811 5.629 5.430
416 HE2 TYR 57 2HE TYR 57 -3.453 5.229 1.901
417 HH TYR 57 HH TYR 57 -6.375 6.258 3.164
418 H GLU 58 H GLU 58 -1.036 8.940 4.953
419 HA GLU 58 HA GLU 58 -2.681 9.650 7.283
420 1HB GLU 58 1HB GLU 58 -1.068 11.495 5.516
421 2HB GLU 58 2HB GLU 58 -0.632 10.980 7.134
422 1HG GLU 58 1HG GLU 58 -2.984 12.683 6.383
423 2HG GLU 58 2HG GLU 58 -1.504 13.212 7.180
424 H GLY 59 H GLY 59 -4.683 9.235 6.696
425 1HA GLY 59 1HA GLY 59 -6.037 10.881 4.823
426 2HA GLY 59 2HA GLY 59 -6.702 9.531 5.737
427 H GLY 60 H GLY 60 -4.702 10.277 3.068
428 1HA GLY 60 1HA GLY 60 -5.692 9.032 0.930
429 2HA GLY 60 2HA GLY 60 -5.055 7.653 1.829
430 H VAL 61 H VAL 61 -3.146 10.065 2.766
431 HA VAL 61 HA VAL 61 -1.449 10.183 0.434
432 HB VAL 61 HB VAL 61 -1.258 11.632 3.090
433 1HG1 VAL 61 1HG1 VAL 61 0.273 12.065 0.524
434 2HG1 VAL 61 2HG1 VAL 61 0.922 11.395 2.020
435 3HG1 VAL 61 3HG1 VAL 61 0.384 13.073 1.968
436 1HG2 VAL 61 1HG2 VAL 61 -1.998 13.610 1.841
437 2HG2 VAL 61 2HG2 VAL 61 -3.220 12.336 1.841
438 3HG2 VAL 61 3HG2 VAL 61 -2.226 12.609 0.408
439 H ILE 62 H ILE 62 0.174 8.985 0.292
440 HA ILE 62 HA ILE 62 1.059 7.267 2.461
441 HB ILE 62 HB ILE 62 1.776 7.403 -0.478
442 1HG1 ILE 62 1HG1 ILE 62 -0.619 6.889 -0.059
443 2HG1 ILE 62 2HG1 ILE 62 -0.128 5.505 0.910
444 1HG2 ILE 62 1HG2 ILE 62 2.285 5.252 1.578
445 2HG2 ILE 62 2HG2 ILE 62 3.485 6.331 0.856
446 3HG2 ILE 62 3HG2 ILE 62 2.667 5.126 -0.146
447 1HD1 ILE 62 1HD1 ILE 62 -0.810 4.814 -1.301
448 2HD1 ILE 62 2HD1 ILE 62 0.902 4.484 -1.036
449 3HD1 ILE 62 3HD1 ILE 62 0.414 5.861 -2.022
450 H THR 63 H THR 63 3.210 7.587 3.372
451 HA THR 63 HA THR 63 4.232 10.177 2.897
452 HB THR 63 HB THR 63 5.299 7.940 4.613
453 HG1 THR 63 1HG THR 63 3.525 10.098 5.193
454 1HG2 THR 63 1HG2 THR 63 6.912 9.759 4.205
455 2HG2 THR 63 2HG2 THR 63 6.346 9.756 5.877
456 3HG2 THR 63 3HG2 THR 63 5.708 10.937 4.734
457 H CYS 64 H CYS 64 5.442 10.634 1.331
458 HA CYS 64 HA CYS 64 7.461 8.894 0.149
459 1HB CYS 64 1HB CYS 64 6.329 11.658 -0.429
460 2HB CYS 64 2HB CYS 64 5.969 10.192 -1.309
461 H ARG 65 H ARG 65 9.848 9.538 0.462
462 HA ARG 65 HA ARG 65 9.911 11.337 2.762
463 1HB ARG 65 1HB ARG 65 11.487 8.793 2.514
464 2HB ARG 65 2HB ARG 65 10.085 9.056 3.544
465 1HG ARG 65 1HG ARG 65 11.369 10.834 4.721
466 2HG ARG 65 2HG ARG 65 12.781 10.375 3.771
467 1HD ARG 65 1HD ARG 65 12.688 8.132 4.671
468 2HD ARG 65 2HD ARG 65 11.240 8.543 5.585
469 HE ARG 65 HE ARG 65 13.870 9.775 6.017
470 1HH1 ARG 65 1HH1 ARG 65 10.775 8.581 7.295
471 2HH1 ARG 65 2HH1 ARG 65 11.210 8.796 8.923
472 1HH2 ARG 65 1HH2 ARG 65 14.442 10.056 8.302
473 2HH2 ARG 65 2HH2 ARG 65 13.294 9.613 9.496
474 H ALA 66 H ALA 66 11.839 10.168 0.015
475 HA ALA 66 HA ALA 66 13.797 12.225 0.756
476 1HB ALA 66 1HB ALA 66 15.230 11.259 -0.932
477 2HB ALA 66 2HB ALA 66 13.900 10.257 -1.487
478 3HB ALA 66 3HB ALA 66 14.613 9.958 0.104
479 H HIS 67 H HIS 67 11.094 11.854 -0.896
480 HA HIS 67 HA HIS 67 11.734 14.094 -2.623
481 1HB HIS 67 1HB HIS 67 9.880 13.241 -4.138
482 2HB HIS 67 2HB HIS 67 9.904 11.748 -3.186
483 HD2 HIS 67 2HD HIS 67 12.170 13.807 -5.599
484 HE1 HIS 67 1HE HIS 67 14.031 10.061 -5.133
485 HE2 HIS 67 2HE HIS 67 13.864 12.123 -6.508
486 H LEU 68 H LEU 68 9.131 14.947 -3.326
487 HA LEU 68 HA LEU 68 8.769 16.407 -0.898
488 1HB LEU 68 1HB LEU 68 7.375 16.831 -3.557
489 2HB LEU 68 2HB LEU 68 8.943 17.473 -3.164
490 HG LEU 68 HG LEU 68 7.402 19.262 -3.064
491 1HD1 LEU 68 1HD1 LEU 68 5.319 18.123 -2.774
492 2HD1 LEU 68 2HD1 LEU 68 5.501 19.383 -1.554
493 3HD1 LEU 68 3HD1 LEU 68 5.749 17.691 -1.121
494 1HD2 LEU 68 1HD2 LEU 68 8.140 18.422 -0.272
495 2HD2 LEU 68 2HD2 LEU 68 7.669 20.048 -0.759
496 3HD2 LEU 68 3HD2 LEU 68 9.143 19.328 -1.404
497 H TRP 69 H TRP 69 8.087 14.627 0.214
498 HA TRP 69 HA TRP 69 6.744 13.268 1.332
499 1HB TRP 69 1HB TRP 69 6.876 15.251 2.658
500 2HB TRP 69 2HB TRP 69 5.370 14.412 2.952
501 HD1 TRP 69 HD TRP 69 6.554 17.510 0.939
502 HE1 TRP 69 1HE TRP 69 4.623 19.235 0.977
503 HE3 TRP 69 3HE TRP 69 3.058 14.786 3.484
504 HZ2 TRP 69 2HZ TRP 69 2.008 19.417 1.969
505 HZ3 TRP 69 3HZ TRP 69 0.870 15.814 3.948
506 HH2 TRP 69 HH TRP 69 0.361 18.083 3.206
507 H THR 70 H THR 70 4.713 14.561 -1.140
508 HA THR 70 HA THR 70 2.507 12.938 -0.084
509 HB THR 70 HB THR 70 1.151 14.118 -1.834
510 HG1 THR 70 1HG THR 70 3.483 14.850 -2.684
511 1HG2 THR 70 1HG2 THR 70 1.011 16.218 -0.561
512 2HG2 THR 70 2HG2 THR 70 2.541 15.835 0.228
513 3HG2 THR 70 3HG2 THR 70 1.124 14.825 0.513
514 H PHE 71 H PHE 71 2.061 11.092 -0.894
515 HA PHE 71 HA PHE 71 2.191 10.620 -3.757
516 1HB PHE 71 1HB PHE 71 2.907 8.689 -1.491
517 2HB PHE 71 2HB PHE 71 4.086 9.471 -2.515
518 HD1 PHE 71 1HD PHE 71 3.430 9.113 -5.160
519 HD2 PHE 71 2HD PHE 71 2.699 6.447 -1.943
520 HE1 PHE 71 1HE PHE 71 3.456 7.218 -6.727
521 HE2 PHE 71 2HE PHE 71 2.720 4.564 -3.482
522 HZ PHE 71 HZ PHE 71 3.098 4.939 -5.892
523 H ASN 72 H ASN 72 0.073 9.659 -4.344
524 HA ASN 72 HA ASN 72 -1.664 9.574 -1.974
525 1HB ASN 72 1HB ASN 72 -2.373 10.863 -4.603
526 2HB ASN 72 2HB ASN 72 -1.954 11.708 -3.118
527 1HD2 ASN 72 1HD2 ASN 72 -4.412 11.813 -4.708
528 2HD2 ASN 72 2HD2 ASN 72 -5.672 11.398 -3.622
529 H ASP 73 H ASP 73 -3.023 8.020 -1.729
530 HA ASP 73 HA ASP 73 -3.148 5.792 -3.493
531 1HB ASP 73 1HB ASP 73 -4.784 6.545 -1.066
532 2HB ASP 73 2HB ASP 73 -3.453 5.393 -1.145
533 H GLY 74 H GLY 74 -5.307 8.476 -2.765
534 1HA GLY 74 1HA GLY 74 -7.205 9.271 -3.808
535 2HA GLY 74 2HA GLY 74 -7.576 7.593 -4.172
536 H THR 75 H THR 75 -4.885 9.593 -5.246
537 HA THR 75 HA THR 75 -5.905 9.844 -7.919
538 HB THR 75 HB THR 75 -3.087 10.408 -6.941
539 HG1 THR 75 1HG THR 75 -5.514 11.811 -6.620
540 1HG2 THR 75 1HG2 THR 75 -3.085 12.055 -8.761
541 2HG2 THR 75 2HG2 THR 75 -4.737 11.599 -9.177
542 3HG2 THR 75 3HG2 THR 75 -3.427 10.438 -9.386
543 H GLY 76 H GLY 76 -3.817 7.656 -6.149
544 1HA GLY 76 1HA GLY 76 -3.668 5.770 -8.274
545 2HA GLY 76 2HA GLY 76 -2.808 5.695 -6.735
546 H HIS 77 H HIS 77 -1.650 8.333 -7.121
547 HA HIS 77 HA HIS 77 0.531 7.717 -8.883
548 1HB HIS 77 1HB HIS 77 -1.335 10.038 -9.442
549 2HB HIS 77 2HB HIS 77 -1.299 8.565 -10.386
550 HD1 HIS 77 1HD HIS 77 -0.730 11.496 -11.466
551 HD2 HIS 77 2HD HIS 77 2.065 8.576 -10.598
552 HE1 HIS 77 1HE HIS 77 1.237 12.016 -12.908
553 HE2 HIS 77 2HE HIS 77 2.995 10.360 -12.219
554 H GLY 78 H GLY 78 2.322 9.277 -8.466
555 1HA GLY 78 1HA GLY 78 3.535 10.544 -7.071
556 2HA GLY 78 2HA GLY 78 2.201 10.460 -5.910
557 H ILE 79 H ILE 79 2.005 12.495 -5.346
558 HA ILE 79 HA ILE 79 0.752 14.291 -7.227
559 HB ILE 79 HB ILE 79 1.518 14.674 -4.312
560 1HG1 ILE 79 1HG1 ILE 79 -0.854 14.264 -3.804
561 2HG1 ILE 79 2HG1 ILE 79 -0.104 12.867 -4.558
562 1HG2 ILE 79 1HG2 ILE 79 1.267 16.810 -5.435
563 2HG2 ILE 79 2HG2 ILE 79 -0.049 16.543 -4.296
564 3HG2 ILE 79 3HG2 ILE 79 -0.324 16.326 -6.027
565 1HD1 ILE 79 1HD1 ILE 79 -2.347 13.229 -5.415
566 2HD1 ILE 79 2HD1 ILE 79 -1.145 13.429 -6.689
567 3HD1 ILE 79 3HD1 ILE 79 -1.893 14.847 -5.952
568 H ASN 80 H ASN 80 3.702 14.049 -5.351
569 HA ASN 80 HA ASN 80 5.218 15.474 -7.282
570 1HB ASN 80 1HB ASN 80 5.059 16.564 -4.460
571 2HB ASN 80 2HB ASN 80 4.192 17.312 -5.796
572 1HD2 ASN 80 1HD2 ASN 80 5.261 19.237 -5.532
573 2HD2 ASN 80 2HD2 ASN 80 6.913 19.480 -5.976
574 HA PRO 81 HA PRO 81 6.967 15.158 -8.009
575 1HB PRO 81 1HB PRO 81 9.037 14.443 -8.526
576 2HB PRO 81 2HB PRO 81 8.376 12.855 -8.918
577 1HG PRO 81 1HG PRO 81 9.689 13.794 -6.446
578 2HG PRO 81 2HG PRO 81 9.563 12.158 -7.087
579 1HD PRO 81 1HD PRO 81 8.121 12.931 -4.941
580 2HD PRO 81 2HD PRO 81 7.448 11.830 -6.158
581 H ASP 82 H ASP 82 6.767 14.125 -10.279
582 HA ASP 82 HA ASP 82 4.165 12.837 -10.435
583 1HB ASP 82 1HB ASP 82 6.015 14.013 -12.519
584 2HB ASP 82 2HB ASP 82 4.593 14.779 -11.831
585 H ASP 83 H ASP 83 7.426 11.991 -10.624
586 HA ASP 83 HA ASP 83 7.431 9.998 -12.582
587 1HB ASP 83 1HB ASP 83 9.542 9.219 -11.502
588 2HB ASP 83 2HB ASP 83 9.206 10.406 -10.243
589 H CYS 84 H CYS 84 6.559 9.811 -9.183
590 HA CYS 84 HA CYS 84 6.549 6.970 -9.450
591 1HB CYS 84 1HB CYS 84 7.550 7.549 -7.421
592 2HB CYS 84 2HB CYS 84 5.949 6.986 -6.999
593 HG CYS 84 HG CYS 84 7.177 9.338 -5.655
594 H CYS 85 H CYS 85 4.943 5.768 -9.185
595 HA CYS 85 HA CYS 85 2.272 6.854 -9.100
596 1HB CYS 85 1HB CYS 85 2.252 6.820 -11.399
597 2HB CYS 85 2HB CYS 85 1.703 5.202 -11.030
598 HG CYS 85 HG CYS 85 3.844 5.800 -13.119
599 H LEU 86 H LEU 86 0.563 5.148 -8.926
600 HA LEU 86 HA LEU 86 1.671 3.194 -7.064
601 1HB LEU 86 1HB LEU 86 -1.029 4.523 -7.076
602 2HB LEU 86 2HB LEU 86 0.336 5.005 -6.072
603 HG LEU 86 HG LEU 86 -0.942 2.377 -5.928
604 1HD1 LEU 86 1HD1 LEU 86 1.349 2.361 -5.148
605 2HD1 LEU 86 2HD1 LEU 86 0.329 2.446 -3.688
606 3HD1 LEU 86 3HD1 LEU 86 1.091 3.883 -4.317
607 1HD2 LEU 86 1HD2 LEU 86 -1.332 4.836 -4.224
608 2HD2 LEU 86 2HD2 LEU 86 -1.957 3.232 -3.840
609 3HD2 LEU 86 3HD2 LEU 86 -2.538 4.085 -5.271
610 H ALA 87 H ALA 87 1.311 1.150 -7.500
611 HA ALA 87 HA ALA 87 -0.823 0.457 -9.397
612 1HB ALA 87 1HB ALA 87 0.351 -1.643 -9.773
613 2HB ALA 87 2HB ALA 87 1.594 -1.171 -8.621
614 3HB ALA 87 3HB ALA 87 1.412 -0.285 -10.129
615 H GLU 88 H GLU 88 -2.564 -0.101 -8.315
616 HA GLU 88 HA GLU 88 -2.177 -1.577 -5.877
617 1HB GLU 88 1HB GLU 88 -3.596 0.282 -5.479
618 2HB GLU 88 2HB GLU 88 -4.617 -1.132 -5.441
619 1HG GLU 88 1HG GLU 88 -4.421 0.728 -7.796
620 2HG GLU 88 2HG GLU 88 -5.654 0.832 -6.545
621 H TYR 89 H TYR 89 -3.255 -3.455 -5.457
622 HA TYR 89 HA TYR 89 -3.683 -5.013 -7.890
623 1HB TYR 89 1HB TYR 89 -3.139 -6.959 -6.459
624 2HB TYR 89 2HB TYR 89 -2.850 -5.868 -5.115
625 HD1 TYR 89 1HD TYR 89 -1.534 -7.062 -8.321
626 HD2 TYR 89 2HD TYR 89 -0.810 -4.594 -4.940
627 HE1 TYR 89 1HE TYR 89 0.842 -6.924 -8.941
628 HE2 TYR 89 2HE TYR 89 1.564 -4.446 -5.557
629 HH TYR 89 HH TYR 89 2.744 -5.502 -8.591
630 HA PRO 90 HA PRO 90 -7.941 -5.706 -6.591
631 1HB PRO 90 1HB PRO 90 -8.767 -7.165 -8.164
632 2HB PRO 90 2HB PRO 90 -7.687 -8.455 -7.632
633 1HG PRO 90 1HG PRO 90 -7.207 -6.271 -9.604
634 2HG PRO 90 2HG PRO 90 -6.677 -7.962 -9.653
635 1HD PRO 90 1HD PRO 90 -5.014 -5.977 -9.007
636 2HD PRO 90 2HD PRO 90 -4.885 -7.567 -8.233
637 H VAL 91 H VAL 91 -8.495 -6.143 -4.580
638 HA VAL 91 HA VAL 91 -7.130 -8.315 -3.147
639 HB VAL 91 HB VAL 91 -8.600 -5.918 -2.002
640 1HG1 VAL 91 1HG1 VAL 91 -6.876 -7.973 -0.634
641 2HG1 VAL 91 2HG1 VAL 91 -8.625 -7.804 -0.482
642 3HG1 VAL 91 3HG1 VAL 91 -7.559 -6.537 0.128
643 1HG2 VAL 91 1HG2 VAL 91 -6.389 -5.046 -1.401
644 2HG2 VAL 91 2HG2 VAL 91 -6.575 -5.203 -3.149
645 3HG2 VAL 91 3HG2 VAL 91 -5.631 -6.392 -2.251
646 H GLU 92 H GLU 92 -8.316 -9.914 -2.245
647 HA GLU 92 HA GLU 92 -11.225 -9.708 -2.413
648 1HB GLU 92 1HB GLU 92 -9.500 -12.160 -2.409
649 2HB GLU 92 2HB GLU 92 -10.269 -11.406 -3.834
650 1HG GLU 92 1HG GLU 92 -12.439 -11.882 -2.980
651 2HG GLU 92 2HG GLU 92 -11.757 -12.579 -1.514
652 H VAL 93 H VAL 93 -12.111 -9.636 -0.649
653 HA VAL 93 HA VAL 93 -10.515 -10.106 1.771
654 HB VAL 93 HB VAL 93 -10.980 -7.762 1.429
655 1HG1 VAL 93 1HG1 VAL 93 -13.898 -8.442 1.649
656 2HG1 VAL 93 2HG1 VAL 93 -13.054 -7.833 0.225
657 3HG1 VAL 93 3HG1 VAL 93 -13.230 -6.810 1.652
658 1HG2 VAL 93 1HG2 VAL 93 -12.444 -8.877 3.821
659 2HG2 VAL 93 2HG2 VAL 93 -11.898 -7.207 3.658
660 3HG2 VAL 93 3HG2 VAL 93 -10.719 -8.520 3.720
661 H LYS 94 H LYS 94 -11.025 -11.650 3.044
662 HA LYS 94 HA LYS 94 -13.757 -12.141 3.454
663 1HB LYS 94 1HB LYS 94 -13.255 -14.035 2.102
664 2HB LYS 94 2HB LYS 94 -13.457 -14.615 3.737
665 1HG LYS 94 1HG LYS 94 -11.671 -15.796 2.748
666 2HG LYS 94 2HG LYS 94 -11.062 -14.724 4.005
667 1HD LYS 94 1HD LYS 94 -9.641 -14.718 2.098
668 2HD LYS 94 2HD LYS 94 -10.316 -13.132 2.372
669 1HE LYS 94 1HE LYS 94 -10.271 -13.643 -0.007
670 2HE LYS 94 2HE LYS 94 -11.903 -13.430 0.583
671 1HZ LYS 94 1HZ LYS 94 -11.612 -15.291 -0.967
672 2HZ LYS 94 2HZ LYS 94 -12.284 -15.764 0.489
673 3HZ LYS 94 3HZ LYS 94 -10.658 -16.122 0.157
674 H GLY 95 H GLY 95 -14.345 -12.948 5.532
675 1HA GLY 95 1HA GLY 95 -14.159 -13.036 7.846
676 2HA GLY 95 2HA GLY 95 -13.753 -11.349 7.501
677 H ASP 96 H ASP 96 -11.689 -14.027 7.207
678 HA ASP 96 HA ASP 96 -9.981 -12.670 9.258
679 1HB ASP 96 1HB ASP 96 -8.950 -14.796 9.817
680 2HB ASP 96 2HB ASP 96 -9.961 -15.617 8.648
681 H ASP 97 H ASP 97 -10.111 -13.459 6.016
682 HA ASP 97 HA ASP 97 -7.148 -13.618 5.853
683 1HB ASP 97 1HB ASP 97 -7.441 -15.003 3.903
684 2HB ASP 97 2HB ASP 97 -9.165 -15.081 4.167
685 H ILE 98 H ILE 98 -6.127 -12.649 4.178
686 HA ILE 98 HA ILE 98 -7.799 -11.041 2.419
687 HB ILE 98 HB ILE 98 -5.246 -10.277 3.801
688 1HG1 ILE 98 1HG1 ILE 98 -7.302 -9.961 5.100
689 2HG1 ILE 98 2HG1 ILE 98 -7.975 -8.999 3.793
690 1HG2 ILE 98 1HG2 ILE 98 -6.716 -8.769 1.605
691 2HG2 ILE 98 2HG2 ILE 98 -5.126 -9.513 1.454
692 3HG2 ILE 98 3HG2 ILE 98 -5.352 -8.127 2.522
693 1HD1 ILE 98 1HD1 ILE 98 -7.184 -7.570 5.578
694 2HD1 ILE 98 2HD1 ILE 98 -6.262 -7.307 4.102
695 3HD1 ILE 98 3HD1 ILE 98 -5.562 -8.248 5.424
696 H TYR 99 H TYR 99 -7.626 -11.841 0.487
697 HA TYR 99 HA TYR 99 -5.030 -12.845 -0.425
698 1HB TYR 99 1HB TYR 99 -6.377 -13.954 -2.243
699 2HB TYR 99 2HB TYR 99 -7.825 -13.523 -1.356
700 HD1 TYR 99 1HD TYR 99 -7.877 -14.374 1.151
701 HD2 TYR 99 2HD TYR 99 -5.376 -15.990 -1.870
702 HE1 TYR 99 1HE TYR 99 -7.636 -16.453 2.462
703 HE2 TYR 99 2HE TYR 99 -5.128 -18.056 -0.580
704 HH TYR 99 HH TYR 99 -7.073 -18.797 2.100
705 H VAL 100 H VAL 100 -4.268 -12.125 -2.325
706 HA VAL 100 HA VAL 100 -5.737 -9.968 -3.607
707 HB VAL 100 HB VAL 100 -4.381 -8.926 -1.939
708 1HG1 VAL 100 1HG1 VAL 100 -2.578 -10.536 -1.689
709 2HG1 VAL 100 2HG1 VAL 100 -1.890 -8.951 -2.043
710 3HG1 VAL 100 3HG1 VAL 100 -1.993 -10.174 -3.313
711 1HG2 VAL 100 1HG2 VAL 100 -3.346 -8.428 -4.708
712 2HG2 VAL 100 2HG2 VAL 100 -3.112 -7.337 -3.341
713 3HG2 VAL 100 3HG2 VAL 100 -4.741 -7.668 -3.940
714 H SER 101 H SER 101 -5.216 -9.662 -5.663
715 HA SER 101 HA SER 101 -3.808 -11.890 -6.932
716 1HB SER 101 1HB SER 101 -5.322 -9.570 -8.199
717 2HB SER 101 2HB SER 101 -5.996 -11.162 -7.879
718 HG SER 101 HG SER 101 -4.629 -12.055 -9.412
719 H THR 102 H THR 102 -1.755 -11.694 -7.162
720 HA THR 102 HA THR 102 -0.591 -9.056 -7.700
721 HB THR 102 HB THR 102 -0.382 -9.520 -5.293
722 HG1 THR 102 1HG THR 102 1.973 -9.541 -6.857
723 1HG2 THR 102 1HG2 THR 102 1.095 -12.029 -6.113
724 2HG2 THR 102 2HG2 THR 102 -0.481 -11.962 -5.325
725 3HG2 THR 102 3HG2 THR 102 0.958 -11.418 -4.464
726 H LYS 103 H LYS 103 -1.211 -11.694 -9.139
727 HA LYS 103 HA LYS 103 1.525 -12.365 -9.917
728 1HB LYS 103 1HB LYS 103 -0.982 -13.969 -10.340
729 2HB LYS 103 2HB LYS 103 0.091 -14.197 -8.972
730 1HG LYS 103 1HG LYS 103 0.808 -14.572 -11.874
731 2HG LYS 103 2HG LYS 103 0.460 -15.865 -10.724
732 1HD LYS 103 1HD LYS 103 2.756 -13.889 -10.529
733 2HD LYS 103 2HD LYS 103 2.881 -15.565 -11.053
734 1HE LYS 103 1HE LYS 103 1.962 -14.690 -8.307
735 2HE LYS 103 2HE LYS 103 3.574 -15.259 -8.703
736 1HZ LYS 103 1HZ LYS 103 2.194 -17.016 -7.763
737 2HZ LYS 103 2HZ LYS 103 2.694 -17.374 -9.319
738 3HZ LYS 103 3HZ LYS 103 1.107 -16.890 -9.056
739 H GLY 104 H GLY 104 2.141 -11.496 -11.769
740 1HA GLY 104 1HA GLY 104 0.409 -11.639 -14.091
741 2HA GLY 104 2HA GLY 104 2.113 -11.215 -14.083
742 H ILE 105 H ILE 105 0.655 -9.431 -11.749
743 HA ILE 105 HA ILE 105 -0.317 -7.374 -13.543
744 HB ILE 105 HB ILE 105 -0.402 -7.502 -10.512
745 1HG1 ILE 105 1HG1 ILE 105 -1.821 -9.152 -11.652
746 2HG1 ILE 105 2HG1 ILE 105 -2.556 -7.873 -12.607
747 1HG2 ILE 105 1HG2 ILE 105 -1.924 -5.565 -10.636
748 2HG2 ILE 105 2HG2 ILE 105 -1.679 -5.481 -12.378
749 3HG2 ILE 105 3HG2 ILE 105 -0.332 -5.163 -11.283
750 1HD1 ILE 105 1HD1 ILE 105 -3.477 -6.882 -10.594
751 2HD1 ILE 105 2HD1 ILE 105 -2.778 -8.185 -9.635
752 3HD1 ILE 105 3HD1 ILE 105 -4.025 -8.539 -10.832
753 H LEU 106 H LEU 106 0.678 -5.549 -13.979
754 HA LEU 106 HA LEU 106 3.468 -5.390 -13.411
755 1HB LEU 106 1HB LEU 106 1.628 -3.612 -14.992
756 2HB LEU 106 2HB LEU 106 2.595 -4.923 -15.622
757 HG LEU 106 HG LEU 106 3.723 -2.383 -14.439
758 1HD1 LEU 106 1HD1 LEU 106 5.249 -4.247 -14.226
759 2HD1 LEU 106 2HD1 LEU 106 5.828 -3.116 -15.442
760 3HD1 LEU 106 3HD1 LEU 106 5.061 -4.625 -15.934
761 1HD2 LEU 106 1HD2 LEU 106 2.520 -1.931 -16.501
762 2HD2 LEU 106 2HD2 LEU 106 3.410 -3.220 -17.309
763 3HD2 LEU 106 3HD2 LEU 106 4.263 -1.782 -16.744
764 HA PRO 107 HA PRO 107 2.985 -2.391 -9.921
765 1HB PRO 107 1HB PRO 107 4.718 -3.517 -8.883
766 2HB PRO 107 2HB PRO 107 5.661 -2.185 -9.555
767 1HG PRO 107 1HG PRO 107 6.302 -4.702 -10.093
768 2HG PRO 107 2HG PRO 107 6.419 -3.441 -11.334
769 1HD PRO 107 1HD PRO 107 4.344 -5.546 -10.953
770 2HD PRO 107 2HD PRO 107 5.085 -4.938 -12.440
771 H ASN 108 H ASN 108 3.144 -0.194 -9.939
772 HA ASN 108 HA ASN 108 4.198 1.033 -12.303
773 1HB ASN 108 1HB ASN 108 3.283 3.133 -11.036
774 2HB ASN 108 2HB ASN 108 2.405 1.946 -10.094
775 1HD2 ASN 108 1HD2 ASN 108 0.625 0.920 -10.994
776 2HD2 ASN 108 2HD2 ASN 108 0.020 1.328 -12.543
777 H LYS 109 H LYS 109 5.145 3.365 -11.610
778 HA LYS 109 HA LYS 109 7.645 2.568 -10.654
779 1HB LYS 109 1HB LYS 109 8.228 5.049 -10.867
780 2HB LYS 109 2HB LYS 109 6.587 5.188 -11.452
781 1HG LYS 109 1HG LYS 109 8.763 3.463 -12.706
782 2HG LYS 109 2HG LYS 109 8.256 5.030 -13.324
783 1HD LYS 109 1HD LYS 109 6.063 4.198 -13.837
784 2HD LYS 109 2HD LYS 109 6.431 2.644 -13.092
785 1HE LYS 109 1HE LYS 109 8.201 2.290 -14.762
786 2HE LYS 109 2HE LYS 109 7.733 3.801 -15.543
787 1HZ LYS 109 1HZ LYS 109 5.549 2.873 -15.970
788 2HZ LYS 109 2HZ LYS 109 5.973 1.437 -15.192
789 3HZ LYS 109 3HZ LYS 109 6.742 1.865 -16.615
790 H ALA 110 H ALA 110 7.894 2.141 -8.979
791 HA ALA 110 HA ALA 110 8.313 3.577 -6.653
792 1HB ALA 110 1HB ALA 110 5.745 1.923 -6.627
793 2HB ALA 110 2HB ALA 110 5.840 3.665 -6.374
794 3HB ALA 110 3HB ALA 110 6.536 2.565 -5.186
795 H HIS 111 H HIS 111 6.795 0.560 -7.403
796 HA HIS 111 HA HIS 111 7.512 -1.629 -7.597
797 1HB HIS 111 1HB HIS 111 10.122 -0.224 -8.200
798 2HB HIS 111 2HB HIS 111 8.808 -0.389 -9.343
799 HD1 HIS 111 1HD HIS 111 11.935 -1.845 -8.618
800 HD2 HIS 111 2HD HIS 111 8.263 -3.281 -9.917
801 HE1 HIS 111 1HE HIS 111 12.430 -4.005 -9.772
802 HE2 HIS 111 2HE HIS 111 10.171 -4.971 -10.286
803 H SER 112 H SER 112 9.886 -2.975 -6.857
804 HA SER 112 HA SER 112 10.633 -2.049 -4.246
805 1HB SER 112 1HB SER 112 10.308 -4.275 -3.305
806 2HB SER 112 2HB SER 112 9.681 -4.865 -4.843
807 HG SER 112 HG SER 112 8.420 -2.628 -4.070
Start of MODEL 2
1 1H MET 1 1HT MET 1 0.907 -17.840 -8.059
2 2H MET 1 2HT MET 1 -0.771 -17.996 -8.014
3 3H MET 1 3HT MET 1 0.049 -17.009 -6.909
4 HA MET 1 HA MET 1 0.725 -15.476 -8.433
5 1HB MET 1 1HB MET 1 1.216 -16.949 -10.346
6 2HB MET 1 2HB MET 1 0.229 -15.598 -10.853
7 1HG MET 1 1HG MET 1 -0.501 -17.591 -11.978
8 2HG MET 1 2HG MET 1 -1.756 -17.038 -10.876
9 1HE MET 1 1HE MET 1 0.944 -20.703 -10.079
10 2HE MET 1 2HE MET 1 1.548 -19.051 -10.007
11 3HE MET 1 3HE MET 1 1.015 -19.725 -11.547
12 H SER 2 H SER 2 -2.452 -17.108 -8.769
13 HA SER 2 HA SER 2 -3.691 -14.492 -8.807
14 1HB SER 2 1HB SER 2 -5.659 -15.710 -9.614
15 2HB SER 2 2HB SER 2 -4.763 -17.227 -9.480
16 HG SER 2 HG SER 2 -4.510 -15.116 -11.241
17 H PHE 3 H PHE 3 -3.859 -13.881 -6.810
18 HA PHE 3 HA PHE 3 -4.496 -13.638 -4.713
19 1HB PHE 3 1HB PHE 3 -6.747 -14.593 -4.057
20 2HB PHE 3 2HB PHE 3 -6.791 -15.321 -5.660
21 HD1 PHE 3 1HD PHE 3 -7.271 -14.017 -7.584
22 HD2 PHE 3 2HD PHE 3 -6.664 -12.136 -3.824
23 HE1 PHE 3 1HE PHE 3 -8.102 -11.891 -8.515
24 HE2 PHE 3 2HE PHE 3 -7.494 -10.015 -4.746
25 HZ PHE 3 HZ PHE 3 -8.215 -9.893 -7.094
26 H GLU 4 H GLU 4 -3.048 -14.263 -3.453
27 HA GLU 4 HA GLU 4 -3.288 -16.923 -2.239
28 1HB GLU 4 1HB GLU 4 -0.834 -16.880 -1.988
29 2HB GLU 4 2HB GLU 4 -0.781 -15.364 -2.877
30 1HG GLU 4 1HG GLU 4 -1.756 -16.518 -4.822
31 2HG GLU 4 2HG GLU 4 -1.698 -18.029 -3.923
32 H LYS 5 H LYS 5 -2.776 -16.921 0.038
33 HA LYS 5 HA LYS 5 -3.718 -14.569 1.312
34 1HB LYS 5 1HB LYS 5 -2.480 -17.036 2.534
35 2HB LYS 5 2HB LYS 5 -4.192 -16.785 2.222
36 1HG LYS 5 1HG LYS 5 -4.172 -14.889 3.787
37 2HG LYS 5 2HG LYS 5 -2.476 -15.221 4.137
38 1HD LYS 5 1HD LYS 5 -3.067 -17.440 4.943
39 2HD LYS 5 2HD LYS 5 -4.766 -17.113 4.601
40 1HE LYS 5 1HE LYS 5 -4.680 -15.209 6.159
41 2HE LYS 5 2HE LYS 5 -3.015 -15.611 6.549
42 1HZ LYS 5 1HZ LYS 5 -5.390 -17.306 6.962
43 2HZ LYS 5 2HZ LYS 5 -4.523 -16.525 8.186
44 3HZ LYS 5 3HZ LYS 5 -3.819 -17.797 7.341
45 H ILE 6 H ILE 6 -2.715 -13.019 2.364
46 HA ILE 6 HA ILE 6 0.194 -13.221 2.598
47 HB ILE 6 HB ILE 6 -0.476 -11.756 0.756
48 1HG1 ILE 6 1HG1 ILE 6 0.803 -10.310 3.069
49 2HG1 ILE 6 2HG1 ILE 6 0.797 -9.754 1.398
50 1HG2 ILE 6 1HG2 ILE 6 -2.589 -10.945 1.497
51 2HG2 ILE 6 2HG2 ILE 6 -1.523 -9.577 1.159
52 3HG2 ILE 6 3HG2 ILE 6 -1.831 -10.068 2.825
53 1HD1 ILE 6 1HD1 ILE 6 2.042 -11.750 0.723
54 2HD1 ILE 6 2HD1 ILE 6 2.063 -12.313 2.396
55 3HD1 ILE 6 3HD1 ILE 6 2.915 -10.837 1.947
56 H CYS 7 H CYS 7 -2.774 -11.820 3.818
57 HA CYS 7 HA CYS 7 -1.735 -11.895 6.521
58 1HB CYS 7 1HB CYS 7 -0.913 -9.737 5.931
59 2HB CYS 7 2HB CYS 7 -2.311 -9.515 6.954
60 HG CYS 7 HG CYS 7 -2.314 -7.526 5.033
61 H SER 8 H SER 8 -3.470 -10.532 7.870
62 HA SER 8 HA SER 8 -6.176 -11.297 7.084
63 1HB SER 8 1HB SER 8 -5.630 -13.006 8.629
64 2HB SER 8 2HB SER 8 -6.528 -11.804 9.529
65 HG SER 8 HG SER 8 -4.795 -12.361 10.734
66 H LEU 9 H LEU 9 -7.764 -9.999 7.867
67 HA LEU 9 HA LEU 9 -7.149 -7.212 8.273
68 1HB LEU 9 1HB LEU 9 -9.750 -8.655 8.750
69 2HB LEU 9 2HB LEU 9 -9.250 -8.193 7.146
70 HG LEU 9 HG LEU 9 -9.406 -5.759 7.911
71 1HD1 LEU 9 1HD1 LEU 9 -11.844 -5.700 7.688
72 2HD1 LEU 9 2HD1 LEU 9 -11.905 -7.444 7.951
73 3HD1 LEU 9 3HD1 LEU 9 -11.101 -6.792 6.523
74 1HD2 LEU 9 1HD2 LEU 9 -9.386 -6.138 10.347
75 2HD2 LEU 9 2HD2 LEU 9 -10.913 -7.010 10.219
76 3HD2 LEU 9 3HD2 LEU 9 -10.844 -5.286 9.836
77 H ASP 10 H ASP 10 -7.751 -9.956 10.209
78 HA ASP 10 HA ASP 10 -8.240 -8.817 12.737
79 1HB ASP 10 1HB ASP 10 -6.835 -11.394 12.009
80 2HB ASP 10 2HB ASP 10 -8.564 -11.202 12.243
81 H ASP 11 H ASP 11 -5.422 -9.133 10.815
82 HA ASP 11 HA ASP 11 -3.595 -8.476 12.979
83 1HB ASP 11 1HB ASP 11 -3.090 -9.021 10.052
84 2HB ASP 11 2HB ASP 11 -2.927 -10.192 11.354
85 H ILE 12 H ILE 12 -4.448 -7.197 9.726
86 HA ILE 12 HA ILE 12 -3.561 -4.618 10.739
87 HB ILE 12 HB ILE 12 -3.561 -3.770 8.432
88 1HG1 ILE 12 1HG1 ILE 12 -5.260 -5.312 7.495
89 2HG1 ILE 12 2HG1 ILE 12 -4.098 -6.626 7.619
90 1HG2 ILE 12 1HG2 ILE 12 -1.501 -4.623 9.375
91 2HG2 ILE 12 2HG2 ILE 12 -1.573 -5.014 7.652
92 3HG2 ILE 12 3HG2 ILE 12 -1.922 -6.257 8.856
93 1HD1 ILE 12 1HD1 ILE 12 -3.785 -4.184 5.925
94 2HD1 ILE 12 2HD1 ILE 12 -4.246 -5.793 5.362
95 3HD1 ILE 12 3HD1 ILE 12 -2.640 -5.521 6.048
96 H TRP 13 H TRP 13 -4.916 -3.437 11.520
97 HA TRP 13 HA TRP 13 -7.732 -3.750 11.117
98 1HB TRP 13 1HB TRP 13 -7.749 -1.948 12.943
99 2HB TRP 13 2HB TRP 13 -6.015 -2.154 12.952
100 HD1 TRP 13 HD TRP 13 -5.539 -5.152 12.913
101 HE1 TRP 13 1HE TRP 13 -6.312 -6.696 14.801
102 HE3 TRP 13 3HE TRP 13 -9.186 -2.183 14.897
103 HZ2 TRP 13 2HZ TRP 13 -8.232 -6.649 16.884
104 HZ3 TRP 13 3HZ TRP 13 -10.441 -3.007 16.846
105 HH2 TRP 13 HH TRP 13 -9.972 -5.195 17.813
106 H VAL 14 H VAL 14 -9.055 -1.732 11.018
107 HA VAL 14 HA VAL 14 -8.593 -0.301 8.667
108 HB VAL 14 HB VAL 14 -10.316 0.480 11.041
109 1HG1 VAL 14 1HG1 VAL 14 -11.473 1.990 9.496
110 2HG1 VAL 14 2HG1 VAL 14 -10.335 1.557 8.225
111 3HG1 VAL 14 3HG1 VAL 14 -9.770 2.426 9.651
112 1HG2 VAL 14 1HG2 VAL 14 -10.950 -1.641 10.001
113 2HG2 VAL 14 2HG2 VAL 14 -11.020 -0.853 8.425
114 3HG2 VAL 14 3HG2 VAL 14 -12.158 -0.395 9.693
115 H GLY 15 H GLY 15 -7.129 1.142 8.225
116 1HA GLY 15 1HA GLY 15 -6.370 3.125 10.241
117 2HA GLY 15 2HA GLY 15 -6.093 3.252 8.508
118 H GLU 16 H GLU 16 -5.368 0.164 9.369
119 HA GLU 16 HA GLU 16 -2.609 0.767 10.099
120 1HB GLU 16 1HB GLU 16 -2.559 -1.676 10.828
121 2HB GLU 16 2HB GLU 16 -4.199 -1.789 10.272
122 1HG GLU 16 1HG GLU 16 -4.014 -1.586 12.694
123 2HG GLU 16 2HG GLU 16 -4.994 -0.328 11.946
124 H MET 17 H MET 17 -0.937 -0.036 8.895
125 HA MET 17 HA MET 17 -1.530 -1.409 6.406
126 1HB MET 17 1HB MET 17 -1.621 0.932 5.782
127 2HB MET 17 2HB MET 17 -0.184 0.179 5.115
128 1HG MET 17 1HG MET 17 0.395 2.384 5.840
129 2HG MET 17 2HG MET 17 1.179 1.216 6.896
130 1HE MET 17 1HE MET 17 0.916 4.346 7.613
131 2HE MET 17 2HE MET 17 1.733 3.162 8.630
132 3HE MET 17 3HE MET 17 0.514 4.228 9.327
133 H GLU 18 H GLU 18 0.150 -2.683 5.682
134 HA GLU 18 HA GLU 18 2.711 -2.404 7.004
135 1HB GLU 18 1HB GLU 18 1.149 -4.957 7.221
136 2HB GLU 18 2HB GLU 18 1.425 -3.716 8.478
137 1HG GLU 18 1HG GLU 18 3.621 -5.257 7.168
138 2HG GLU 18 2HG GLU 18 2.921 -5.651 8.736
139 H THR 19 H THR 19 4.331 -2.859 5.723
140 HA THR 19 HA THR 19 3.848 -3.762 3.067
141 HB THR 19 HB THR 19 6.446 -3.257 4.523
142 HG1 THR 19 1HG THR 19 6.313 -1.299 3.116
143 1HG2 THR 19 1HG2 THR 19 5.876 -3.455 1.556
144 2HG2 THR 19 2HG2 THR 19 6.744 -4.643 2.520
145 3HG2 THR 19 3HG2 THR 19 7.435 -3.039 2.269
146 H PHE 20 H PHE 20 3.845 -5.731 2.490
147 HA PHE 20 HA PHE 20 5.231 -7.733 4.132
148 1HB PHE 20 1HB PHE 20 3.549 -9.410 3.372
149 2HB PHE 20 2HB PHE 20 2.636 -8.115 2.617
150 HD1 PHE 20 1HD PHE 20 0.848 -7.225 3.803
151 HD2 PHE 20 2HD PHE 20 4.081 -8.978 5.936
152 HE1 PHE 20 1HE PHE 20 -0.348 -6.853 5.901
153 HE2 PHE 20 2HE PHE 20 2.878 -8.610 8.052
154 HZ PHE 20 HZ PHE 20 0.660 -7.546 8.033
155 H GLU 21 H GLU 21 6.051 -9.544 3.000
156 HA GLU 21 HA GLU 21 7.019 -8.753 0.366
157 1HB GLU 21 1HB GLU 21 8.074 -10.787 2.325
158 2HB GLU 21 2HB GLU 21 8.632 -9.133 2.154
159 1HG GLU 21 1HG GLU 21 9.423 -9.578 -0.078
160 2HG GLU 21 2HG GLU 21 8.790 -11.222 0.010
161 H THR 22 H THR 22 6.551 -9.922 -1.305
162 HA THR 22 HA THR 22 4.709 -12.183 -1.090
163 HB THR 22 HB THR 22 4.651 -12.185 -3.521
164 HG1 THR 22 1HG THR 22 6.022 -10.785 -4.677
165 1HG2 THR 22 1HG2 THR 22 3.968 -9.882 -3.987
166 2HG2 THR 22 2HG2 THR 22 4.800 -9.342 -2.539
167 3HG2 THR 22 3HG2 THR 22 3.374 -10.382 -2.395
168 H SER 23 H SER 23 5.266 -14.290 -2.353
169 HA SER 23 HA SER 23 7.654 -15.356 -1.402
170 1HB SER 23 1HB SER 23 7.061 -17.309 -2.806
171 2HB SER 23 2HB SER 23 5.800 -16.305 -3.531
172 HG SER 23 HG SER 23 6.035 -16.965 -0.789
173 H ASP 24 H ASP 24 7.178 -13.398 -4.134
174 HA ASP 24 HA ASP 24 9.490 -14.410 -5.607
175 1HB ASP 24 1HB ASP 24 9.079 -12.567 -7.149
176 2HB ASP 24 2HB ASP 24 7.896 -11.889 -6.045
177 H GLY 25 H GLY 25 8.862 -12.393 -3.021
178 1HA GLY 25 1HA GLY 25 11.540 -11.271 -3.119
179 2HA GLY 25 2HA GLY 25 10.434 -11.236 -1.746
180 H THR 26 H THR 26 8.197 -10.281 -3.415
181 HA THR 26 HA THR 26 9.115 -7.638 -4.197
182 HB THR 26 HB THR 26 6.404 -8.934 -4.508
183 HG1 THR 26 1HG THR 26 8.667 -8.754 -6.205
184 1HG2 THR 26 1HG2 THR 26 7.609 -6.498 -5.854
185 2HG2 THR 26 2HG2 THR 26 6.378 -6.466 -4.592
186 3HG2 THR 26 3HG2 THR 26 6.008 -7.173 -6.164
187 H GLU 27 H GLU 27 8.658 -5.875 -3.015
188 HA GLU 27 HA GLU 27 7.279 -6.265 -0.514
189 1HB GLU 27 1HB GLU 27 7.907 -3.821 -0.108
190 2HB GLU 27 2HB GLU 27 8.804 -3.898 -1.609
191 1HG GLU 27 1HG GLU 27 9.340 -5.558 0.819
192 2HG GLU 27 2HG GLU 27 10.244 -4.137 0.333
193 H VAL 28 H VAL 28 5.262 -5.674 -0.162
194 HA VAL 28 HA VAL 28 3.978 -3.796 -2.015
195 HB VAL 28 HB VAL 28 2.718 -6.287 -0.849
196 1HG1 VAL 28 1HG1 VAL 28 0.885 -5.891 -2.422
197 2HG1 VAL 28 2HG1 VAL 28 1.664 -4.392 -2.926
198 3HG1 VAL 28 3HG1 VAL 28 1.087 -4.570 -1.271
199 1HG2 VAL 28 1HG2 VAL 28 3.709 -5.856 -3.662
200 2HG2 VAL 28 2HG2 VAL 28 2.782 -7.251 -3.110
201 3HG2 VAL 28 3HG2 VAL 28 4.394 -6.953 -2.464
202 H LEU 29 H LEU 29 2.580 -2.412 -0.984
203 HA LEU 29 HA LEU 29 2.586 -2.327 1.973
204 1HB LEU 29 1HB LEU 29 1.903 -0.316 -0.186
205 2HB LEU 29 2HB LEU 29 3.357 -0.341 0.788
206 HG LEU 29 HG LEU 29 0.585 0.197 1.841
207 1HD1 LEU 29 1HD1 LEU 29 3.261 0.348 3.187
208 2HD1 LEU 29 2HD1 LEU 29 1.996 -0.841 3.504
209 3HD1 LEU 29 3HD1 LEU 29 1.725 0.860 3.880
210 1HD2 LEU 29 1HD2 LEU 29 1.369 2.493 2.110
211 2HD2 LEU 29 2HD2 LEU 29 1.375 2.002 0.418
212 3HD2 LEU 29 3HD2 LEU 29 2.888 2.069 1.324
213 H ILE 30 H ILE 30 0.898 -3.490 2.739
214 HA ILE 30 HA ILE 30 -1.626 -3.310 1.296
215 HB ILE 30 HB ILE 30 -0.862 -5.223 3.561
216 1HG1 ILE 30 1HG1 ILE 30 -1.280 -5.714 0.621
217 2HG1 ILE 30 2HG1 ILE 30 -1.129 -7.023 1.788
218 1HG2 ILE 30 1HG2 ILE 30 -3.365 -5.101 1.885
219 2HG2 ILE 30 2HG2 ILE 30 -3.231 -4.672 3.590
220 3HG2 ILE 30 3HG2 ILE 30 -2.991 -6.342 3.082
221 1HD1 ILE 30 1HD1 ILE 30 1.201 -6.260 2.257
222 2HD1 ILE 30 2HD1 ILE 30 0.997 -5.069 0.984
223 3HD1 ILE 30 3HD1 ILE 30 0.920 -6.783 0.598
224 H VAL 31 H VAL 31 -3.022 -1.857 1.940
225 HA VAL 31 HA VAL 31 -2.867 -0.847 4.714
226 HB VAL 31 HB VAL 31 -3.974 0.541 2.272
227 1HG1 VAL 31 1HG1 VAL 31 -3.403 1.581 5.034
228 2HG1 VAL 31 2HG1 VAL 31 -4.983 1.311 4.304
229 3HG1 VAL 31 3HG1 VAL 31 -3.916 2.557 3.659
230 1HG2 VAL 31 1HG2 VAL 31 -1.578 0.282 1.988
231 2HG2 VAL 31 2HG2 VAL 31 -1.287 0.978 3.584
232 3HG2 VAL 31 3HG2 VAL 31 -1.976 1.970 2.300
233 H ASN 32 H ASN 32 -4.682 -1.363 5.930
234 HA ASN 32 HA ASN 32 -7.056 -2.123 4.414
235 1HB ASN 32 1HB ASN 32 -6.414 -2.431 7.356
236 2HB ASN 32 2HB ASN 32 -6.322 -3.696 6.137
237 1HD2 ASN 32 1HD2 ASN 32 -7.830 -3.715 8.531
238 2HD2 ASN 32 2HD2 ASN 32 -9.496 -3.872 8.104
239 H SER 33 H SER 33 -8.195 -0.403 3.835
240 HA SER 33 HA SER 33 -8.724 1.727 5.755
241 1HB SER 33 1HB SER 33 -9.469 2.986 3.797
242 2HB SER 33 2HB SER 33 -9.298 1.552 2.784
243 HG SER 33 HG SER 33 -7.247 1.966 2.605
244 H GLU 34 H GLU 34 -10.991 2.248 6.237
245 HA GLU 34 HA GLU 34 -12.606 -0.105 6.040
246 1HB GLU 34 1HB GLU 34 -12.729 1.104 8.105
247 2HB GLU 34 2HB GLU 34 -14.308 1.059 7.353
248 1HG GLU 34 1HG GLU 34 -14.076 3.326 6.611
249 2HG GLU 34 2HG GLU 34 -12.461 3.405 7.322
250 H GLU 35 H GLU 35 -13.008 3.164 4.659
251 HA GLU 35 HA GLU 35 -15.307 2.157 3.190
252 1HB GLU 35 1HB GLU 35 -15.467 4.460 2.263
253 2HB GLU 35 2HB GLU 35 -14.088 4.908 3.247
254 1HG GLU 35 1HG GLU 35 -15.313 4.477 5.262
255 2HG GLU 35 2HG GLU 35 -16.688 3.874 4.333
256 H HIS 36 H HIS 36 -12.068 3.216 2.565
257 HA HIS 36 HA HIS 36 -12.391 2.900 -0.281
258 1HB HIS 36 1HB HIS 36 -9.851 3.294 1.345
259 2HB HIS 36 2HB HIS 36 -10.832 4.589 0.685
260 HD1 HIS 36 1HD HIS 36 -10.614 5.101 -1.876
261 HD2 HIS 36 2HD HIS 36 -8.154 2.035 -0.517
262 HE1 HIS 36 1HE HIS 36 -8.945 4.731 -3.687
263 HE2 HIS 36 2HE HIS 36 -7.266 3.210 -2.620
264 H GLY 37 H GLY 37 -11.966 0.850 2.306
265 1HA GLY 37 1HA GLY 37 -11.678 -1.400 0.561
266 2HA GLY 37 2HA GLY 37 -11.949 -1.439 2.299
267 H VAL 38 H VAL 38 -10.353 -3.217 2.028
268 HA VAL 38 HA VAL 38 -7.758 -2.183 2.625
269 HB VAL 38 HB VAL 38 -8.513 -4.193 3.844
270 1HG1 VAL 38 1HG1 VAL 38 -9.921 -5.217 2.170
271 2HG1 VAL 38 2HG1 VAL 38 -8.708 -6.369 2.742
272 3HG1 VAL 38 3HG1 VAL 38 -8.509 -5.581 1.177
273 1HG2 VAL 38 1HG2 VAL 38 -6.112 -3.919 3.546
274 2HG2 VAL 38 2HG2 VAL 38 -6.185 -4.796 2.021
275 3HG2 VAL 38 3HG2 VAL 38 -6.544 -5.628 3.536
276 H LYS 39 H LYS 39 -6.241 -1.765 1.251
277 HA LYS 39 HA LYS 39 -6.413 -2.974 -1.405
278 1HB LYS 39 1HB LYS 39 -5.728 -0.817 -2.383
279 2HB LYS 39 2HB LYS 39 -5.845 -0.065 -0.805
280 1HG LYS 39 1HG LYS 39 -7.791 0.483 -2.105
281 2HG LYS 39 2HG LYS 39 -8.258 -0.556 -0.761
282 1HD LYS 39 1HD LYS 39 -8.301 -2.495 -2.269
283 2HD LYS 39 2HD LYS 39 -7.856 -1.444 -3.618
284 1HE LYS 39 1HE LYS 39 -9.911 -0.134 -3.235
285 2HE LYS 39 2HE LYS 39 -10.353 -1.242 -1.941
286 1HZ LYS 39 1HZ LYS 39 -10.021 -2.004 -4.791
287 2HZ LYS 39 2HZ LYS 39 -11.481 -1.754 -3.987
288 3HZ LYS 39 3HZ LYS 39 -10.491 -3.034 -3.523
289 H ALA 40 H ALA 40 -4.514 -3.427 -2.323
290 HA ALA 40 HA ALA 40 -2.123 -3.013 -0.676
291 1HB ALA 40 1HB ALA 40 -2.739 -5.373 -0.909
292 2HB ALA 40 2HB ALA 40 -1.248 -5.033 -1.794
293 3HB ALA 40 3HB ALA 40 -2.779 -5.198 -2.661
294 H TYR 41 H TYR 41 -0.447 -2.038 -1.607
295 HA TYR 41 HA TYR 41 -0.686 -1.361 -4.463
296 1HB TYR 41 1HB TYR 41 0.290 0.846 -3.953
297 2HB TYR 41 2HB TYR 41 0.238 0.475 -2.241
298 HD1 TYR 41 1HD TYR 41 -1.716 0.793 -0.956
299 HD2 TYR 41 2HD TYR 41 -1.870 1.157 -5.189
300 HE1 TYR 41 1HE TYR 41 -3.958 1.782 -0.781
301 HE2 TYR 41 2HE TYR 41 -4.114 2.149 -5.029
302 HH TYR 41 HH TYR 41 -5.341 3.289 -2.135
303 H GLN 42 H GLN 42 1.301 -1.292 -5.602
304 HA GLN 42 HA GLN 42 3.528 -2.712 -4.805
305 1HB GLN 42 1HB GLN 42 3.172 -0.271 -6.586
306 2HB GLN 42 2HB GLN 42 3.120 -1.936 -7.094
307 1HG GLN 42 1HG GLN 42 5.433 -2.165 -6.657
308 2HG GLN 42 2HG GLN 42 5.492 -0.428 -6.299
309 1HE2 GLN 42 1HE2 GLN 42 4.901 -2.842 -8.677
310 2HE2 GLN 42 2HE2 GLN 42 4.926 -1.798 -10.067
311 H ALA 43 H ALA 43 5.317 -2.173 -3.425
312 HA ALA 43 HA ALA 43 5.031 0.398 -2.023
313 1HB ALA 43 1HB ALA 43 4.743 -1.573 -0.614
314 2HB ALA 43 2HB ALA 43 6.186 -0.672 -0.146
315 3HB ALA 43 3HB ALA 43 6.339 -2.156 -1.088
316 H MET 44 H MET 44 6.449 -0.323 -4.463
317 HA MET 44 HA MET 44 9.223 -0.235 -3.778
318 1HB MET 44 1HB MET 44 9.659 -0.169 -6.276
319 2HB MET 44 2HB MET 44 7.924 -0.373 -6.456
320 1HG MET 44 1HG MET 44 9.049 -2.507 -6.614
321 2HG MET 44 2HG MET 44 8.029 -2.449 -5.176
322 1HE MET 44 1HE MET 44 11.583 -0.741 -5.667
323 2HE MET 44 2HE MET 44 11.701 -2.256 -6.559
324 3HE MET 44 3HE MET 44 12.644 -2.026 -5.086
325 H CYS 45 H CYS 45 9.455 1.688 -2.690
326 HA CYS 45 HA CYS 45 10.173 3.765 -4.602
327 1HB CYS 45 1HB CYS 45 8.660 4.792 -2.996
328 2HB CYS 45 2HB CYS 45 10.277 5.332 -2.571
329 HA PRO 46 HA PRO 46 13.903 1.519 -3.514
330 1HB PRO 46 1HB PRO 46 13.835 0.919 -5.744
331 2HB PRO 46 2HB PRO 46 15.243 1.990 -5.765
332 1HG PRO 46 1HG PRO 46 13.220 2.444 -7.410
333 2HG PRO 46 2HG PRO 46 14.004 3.795 -6.574
334 1HD PRO 46 1HD PRO 46 11.370 2.515 -6.064
335 2HD PRO 46 2HD PRO 46 11.869 4.208 -5.854
336 H HIS 47 H HIS 47 13.636 4.135 -2.315
337 HA HIS 47 HA HIS 47 16.160 5.412 -3.104
338 1HB HIS 47 1HB HIS 47 15.543 7.323 -1.837
339 2HB HIS 47 2HB HIS 47 14.231 6.466 -1.049
340 HD2 HIS 47 2HD HIS 47 14.863 7.268 -4.887
341 HE1 HIS 47 1HE HIS 47 10.875 8.079 -3.746
342 HE2 HIS 47 2HE HIS 47 12.532 8.201 -5.613
343 H GLN 48 H GLN 48 14.460 4.778 0.029
344 HA GLN 48 HA GLN 48 16.774 3.361 0.950
345 1HB GLN 48 1HB GLN 48 16.210 6.076 2.138
346 2HB GLN 48 2HB GLN 48 17.545 5.707 1.063
347 1HG GLN 48 1HG GLN 48 18.464 4.170 2.701
348 2HG GLN 48 2HG GLN 48 17.110 4.517 3.779
349 1HE2 GLN 48 1HE2 GLN 48 16.955 6.466 4.694
350 2HE2 GLN 48 2HE2 GLN 48 18.277 7.577 4.879
351 H GLU 49 H GLU 49 13.609 4.852 1.639
352 HA GLU 49 HA GLU 49 13.453 3.184 4.007
353 1HB GLU 49 1HB GLU 49 11.313 4.594 4.393
354 2HB GLU 49 2HB GLU 49 11.975 5.676 3.192
355 1HG GLU 49 1HG GLU 49 13.222 5.005 5.842
356 2HG GLU 49 2HG GLU 49 12.423 6.506 5.412
357 H ILE 50 H ILE 50 12.856 1.274 3.354
358 HA ILE 50 HA ILE 50 10.637 0.999 1.486
359 HB ILE 50 HB ILE 50 12.657 -0.469 1.258
360 1HG1 ILE 50 1HG1 ILE 50 10.120 -1.993 1.895
361 2HG1 ILE 50 2HG1 ILE 50 11.499 -2.636 1.009
362 1HG2 ILE 50 1HG2 ILE 50 11.791 -1.650 3.882
363 2HG2 ILE 50 2HG2 ILE 50 13.268 -0.734 3.568
364 3HG2 ILE 50 3HG2 ILE 50 13.031 -2.312 2.819
365 1HD1 ILE 50 1HD1 ILE 50 11.155 -0.974 -0.750
366 2HD1 ILE 50 2HD1 ILE 50 9.762 -0.335 0.125
367 3HD1 ILE 50 3HD1 ILE 50 9.728 -1.978 -0.508
368 H LEU 51 H LEU 51 10.936 1.657 4.550
369 HA LEU 51 HA LEU 51 8.983 -0.129 5.771
370 1HB LEU 51 1HB LEU 51 9.424 1.234 7.819
371 2HB LEU 51 2HB LEU 51 10.531 2.217 6.896
372 HG LEU 51 HG LEU 51 10.975 -0.725 7.432
373 1HD1 LEU 51 1HD1 LEU 51 12.157 0.072 5.462
374 2HD1 LEU 51 2HD1 LEU 51 13.278 -0.288 6.775
375 3HD1 LEU 51 3HD1 LEU 51 12.862 1.387 6.403
376 1HD2 LEU 51 1HD2 LEU 51 10.966 0.518 9.512
377 2HD2 LEU 51 2HD2 LEU 51 12.117 1.674 8.844
378 3HD2 LEU 51 3HD2 LEU 51 12.600 -0.003 9.104
379 H LEU 52 H LEU 52 7.921 1.374 3.677
380 HA LEU 52 HA LEU 52 6.758 3.890 4.203
381 1HB LEU 52 1HB LEU 52 4.981 3.312 2.578
382 2HB LEU 52 2HB LEU 52 5.525 1.662 2.575
383 HG LEU 52 HG LEU 52 7.189 3.937 1.524
384 1HD1 LEU 52 1HD1 LEU 52 8.503 2.004 2.185
385 2HD1 LEU 52 2HD1 LEU 52 8.444 2.149 0.427
386 3HD1 LEU 52 3HD1 LEU 52 7.445 0.951 1.248
387 1HD2 LEU 52 1HD2 LEU 52 5.144 3.721 0.244
388 2HD2 LEU 52 2HD2 LEU 52 5.410 1.991 0.088
389 3HD2 LEU 52 3HD2 LEU 52 6.520 3.124 -0.688
390 H SER 53 H SER 53 5.778 0.709 5.150
391 HA SER 53 HA SER 53 3.094 1.273 5.695
392 1HB SER 53 1HB SER 53 3.969 -0.750 5.011
393 2HB SER 53 2HB SER 53 3.085 -0.869 6.466
394 HG SER 53 HG SER 53 5.057 -1.765 7.257
395 H GLU 54 H GLU 54 6.003 1.380 7.472
396 HA GLU 54 HA GLU 54 4.598 1.970 9.967
397 1HB GLU 54 1HB GLU 54 7.571 1.554 9.484
398 2HB GLU 54 2HB GLU 54 6.465 0.234 9.760
399 1HG GLU 54 1HG GLU 54 7.397 0.435 11.818
400 2HG GLU 54 2HG GLU 54 5.950 1.407 12.001
401 H GLY 55 H GLY 55 5.031 3.615 7.421
402 1HA GLY 55 1HA GLY 55 5.604 5.783 6.826
403 2HA GLY 55 2HA GLY 55 6.393 5.975 8.392
404 H SER 56 H SER 56 3.646 6.747 6.555
405 HA SER 56 HA SER 56 1.944 6.902 8.854
406 1HB SER 56 1HB SER 56 2.720 9.454 7.459
407 2HB SER 56 2HB SER 56 3.212 8.925 9.099
408 HG SER 56 HG SER 56 1.065 8.993 9.727
409 H TYR 57 H TYR 57 -0.010 7.378 8.473
410 HA TYR 57 HA TYR 57 -1.079 7.167 5.710
411 1HB TYR 57 1HB TYR 57 -1.859 5.445 8.068
412 2HB TYR 57 2HB TYR 57 -1.120 4.909 6.568
413 HD1 TYR 57 1HD TYR 57 -4.194 5.512 8.278
414 HD2 TYR 57 2HD TYR 57 -2.473 5.155 4.412
415 HE1 TYR 57 1HE TYR 57 -6.422 5.101 7.333
416 HE2 TYR 57 2HE TYR 57 -4.707 4.743 3.457
417 HH TYR 57 HH TYR 57 -6.924 3.886 4.238
418 H GLU 58 H GLU 58 -2.298 8.750 5.306
419 HA GLU 58 HA GLU 58 -4.135 9.655 7.397
420 1HB GLU 58 1HB GLU 58 -4.268 11.788 6.117
421 2HB GLU 58 2HB GLU 58 -3.070 11.156 4.995
422 1HG GLU 58 1HG GLU 58 -1.419 11.061 6.787
423 2HG GLU 58 2HG GLU 58 -2.616 11.647 7.938
424 H GLY 59 H GLY 59 -6.279 10.464 6.277
425 1HA GLY 59 1HA GLY 59 -8.179 9.593 5.309
426 2HA GLY 59 2HA GLY 59 -7.241 8.190 4.828
427 H GLY 60 H GLY 60 -5.568 8.761 3.099
428 1HA GLY 60 1HA GLY 60 -6.687 10.612 1.123
429 2HA GLY 60 2HA GLY 60 -6.481 8.925 0.678
430 H VAL 61 H VAL 61 -4.102 9.955 2.877
431 HA VAL 61 HA VAL 61 -2.250 10.485 0.675
432 HB VAL 61 HB VAL 61 -2.270 11.806 3.397
433 1HG1 VAL 61 1HG1 VAL 61 0.020 11.456 2.606
434 2HG1 VAL 61 2HG1 VAL 61 -0.388 13.172 2.546
435 3HG1 VAL 61 3HG1 VAL 61 -0.387 12.215 1.067
436 1HG2 VAL 61 1HG2 VAL 61 -2.710 13.893 2.174
437 2HG2 VAL 61 2HG2 VAL 61 -3.993 12.706 1.930
438 3HG2 VAL 61 3HG2 VAL 61 -2.797 12.980 0.667
439 H ILE 62 H ILE 62 -0.476 9.305 0.673
440 HA ILE 62 HA ILE 62 0.108 7.598 3.003
441 HB ILE 62 HB ILE 62 0.798 7.144 0.075
442 1HG1 ILE 62 1HG1 ILE 62 -0.767 5.253 0.161
443 2HG1 ILE 62 2HG1 ILE 62 -1.586 6.765 0.521
444 1HG2 ILE 62 1HG2 ILE 62 1.616 4.932 0.758
445 2HG2 ILE 62 2HG2 ILE 62 1.341 5.363 2.446
446 3HG2 ILE 62 3HG2 ILE 62 2.538 6.242 1.498
447 1HD1 ILE 62 1HD1 ILE 62 -0.721 4.741 2.561
448 2HD1 ILE 62 2HD1 ILE 62 -2.362 4.983 1.959
449 3HD1 ILE 62 3HD1 ILE 62 -1.562 6.258 2.881
450 H THR 63 H THR 63 2.104 7.777 3.912
451 HA THR 63 HA THR 63 4.085 9.405 2.496
452 HB THR 63 HB THR 63 3.404 9.450 5.446
453 HG1 THR 63 1HG THR 63 2.727 10.958 3.231
454 1HG2 THR 63 1HG2 THR 63 5.421 11.093 3.883
455 2HG2 THR 63 2HG2 THR 63 5.815 9.831 5.049
456 3HG2 THR 63 3HG2 THR 63 5.019 11.312 5.587
457 H CYS 64 H CYS 64 6.056 8.407 2.318
458 HA CYS 64 HA CYS 64 6.498 5.769 3.245
459 1HB CYS 64 1HB CYS 64 8.444 7.832 2.134
460 2HB CYS 64 2HB CYS 64 7.644 6.568 1.224
461 H ARG 65 H ARG 65 8.511 8.561 3.993
462 HA ARG 65 HA ARG 65 8.093 9.138 6.569
463 1HB ARG 65 1HB ARG 65 10.258 7.011 6.574
464 2HB ARG 65 2HB ARG 65 8.606 6.689 7.085
465 1HG ARG 65 1HG ARG 65 8.864 8.502 8.774
466 2HG ARG 65 2HG ARG 65 10.569 8.585 8.327
467 1HD ARG 65 1HD ARG 65 10.914 6.316 8.988
468 2HD ARG 65 2HD ARG 65 9.180 6.105 9.260
469 HE ARG 65 HE ARG 65 10.650 8.102 10.785
470 1HH1 ARG 65 1HH1 ARG 65 8.886 5.038 10.685
471 2HH1 ARG 65 2HH1 ARG 65 8.620 4.917 12.335
472 1HH2 ARG 65 1HH2 ARG 65 10.291 7.988 13.141
473 2HH2 ARG 65 2HH2 ARG 65 9.459 6.649 13.782
474 H ALA 66 H ALA 66 8.908 11.068 6.273
475 HA ALA 66 HA ALA 66 10.255 12.809 5.717
476 1HB ALA 66 1HB ALA 66 12.521 10.785 5.940
477 2HB ALA 66 2HB ALA 66 11.910 11.776 7.264
478 3HB ALA 66 3HB ALA 66 12.722 12.537 5.898
479 H HIS 67 H HIS 67 9.302 10.679 3.927
480 HA HIS 67 HA HIS 67 10.440 11.459 1.382
481 1HB HIS 67 1HB HIS 67 10.214 8.911 0.820
482 2HB HIS 67 2HB HIS 67 10.401 8.702 2.549
483 HD2 HIS 67 2HD HIS 67 12.885 10.197 3.427
484 HE1 HIS 67 1HE HIS 67 14.820 8.764 -0.021
485 HE2 HIS 67 2HE HIS 67 15.034 9.338 2.397
486 H LEU 68 H LEU 68 8.893 11.245 -0.211
487 HA LEU 68 HA LEU 68 6.848 11.385 -1.089
488 1HB LEU 68 1HB LEU 68 6.240 9.031 0.713
489 2HB LEU 68 2HB LEU 68 6.994 8.906 -0.853
490 HG LEU 68 HG LEU 68 4.177 9.861 -0.350
491 1HD1 LEU 68 1HD1 LEU 68 5.143 10.912 -2.324
492 2HD1 LEU 68 2HD1 LEU 68 3.949 9.707 -2.806
493 3HD1 LEU 68 3HD1 LEU 68 5.665 9.341 -2.925
494 1HD2 LEU 68 1HD2 LEU 68 3.532 7.727 -1.383
495 2HD2 LEU 68 2HD2 LEU 68 4.460 7.474 0.097
496 3HD2 LEU 68 3HD2 LEU 68 5.231 7.264 -1.473
497 H TRP 69 H TRP 69 6.437 13.345 -0.309
498 HA TRP 69 HA TRP 69 5.468 13.755 2.341
499 1HB TRP 69 1HB TRP 69 5.522 15.702 0.033
500 2HB TRP 69 2HB TRP 69 6.907 15.375 1.064
501 HD1 TRP 69 HD TRP 69 3.821 17.487 0.891
502 HE1 TRP 69 1HE TRP 69 3.632 18.896 3.042
503 HE3 TRP 69 3HE TRP 69 7.419 15.188 3.690
504 HZ2 TRP 69 2HZ TRP 69 4.841 19.009 5.581
505 HZ3 TRP 69 3HZ TRP 69 7.843 16.004 5.968
506 HH2 TRP 69 HH TRP 69 6.579 17.874 6.892
507 H THR 70 H THR 70 4.093 13.918 -0.935
508 HA THR 70 HA THR 70 1.526 13.420 0.316
509 HB THR 70 HB THR 70 0.477 14.849 -1.476
510 HG1 THR 70 1HG THR 70 1.927 16.555 -2.245
511 1HG2 THR 70 1HG2 THR 70 0.576 15.621 0.837
512 2HG2 THR 70 2HG2 THR 70 0.851 16.986 -0.247
513 3HG2 THR 70 3HG2 THR 70 2.209 16.228 0.585
514 H PHE 71 H PHE 71 0.476 11.825 -0.519
515 HA PHE 71 HA PHE 71 0.967 10.935 -3.254
516 1HB PHE 71 1HB PHE 71 0.786 9.233 -0.760
517 2HB PHE 71 2HB PHE 71 2.240 9.480 -1.706
518 HD1 PHE 71 1HD PHE 71 2.476 8.444 -3.912
519 HD2 PHE 71 2HD PHE 71 -0.905 7.689 -1.451
520 HE1 PHE 71 1HE PHE 71 1.924 6.478 -5.264
521 HE2 PHE 71 2HE PHE 71 -1.461 5.723 -2.800
522 HZ PHE 71 HZ PHE 71 -0.047 5.113 -4.710
523 H ASN 72 H ASN 72 -0.962 10.382 -4.246
524 HA ASN 72 HA ASN 72 -3.291 10.735 -2.508
525 1HB ASN 72 1HB ASN 72 -3.169 11.005 -5.519
526 2HB ASN 72 2HB ASN 72 -3.242 12.328 -4.357
527 1HD2 ASN 72 1HD2 ASN 72 -5.084 11.740 -6.494
528 2HD2 ASN 72 2HD2 ASN 72 -6.629 11.490 -5.775
529 H ASP 73 H ASP 73 -4.168 9.054 -1.810
530 HA ASP 73 HA ASP 73 -3.836 6.414 -2.752
531 1HB ASP 73 1HB ASP 73 -5.758 7.687 -0.811
532 2HB ASP 73 2HB ASP 73 -4.289 6.806 -0.432
533 H GLY 74 H GLY 74 -6.055 8.895 -3.632
534 1HA GLY 74 1HA GLY 74 -8.089 8.773 -4.786
535 2HA GLY 74 2HA GLY 74 -7.909 7.025 -4.845
536 H THR 75 H THR 75 -5.053 7.638 -5.812
537 HA THR 75 HA THR 75 -5.784 7.544 -8.616
538 HB THR 75 HB THR 75 -3.850 9.659 -7.606
539 HG1 THR 75 1HG THR 75 -6.502 9.658 -8.074
540 1HG2 THR 75 1HG2 THR 75 -4.708 9.008 -10.439
541 2HG2 THR 75 2HG2 THR 75 -3.119 8.680 -9.751
542 3HG2 THR 75 3HG2 THR 75 -3.660 10.345 -9.960
543 H GLY 76 H GLY 76 -3.032 7.560 -6.308
544 1HA GLY 76 1HA GLY 76 -1.981 5.282 -7.846
545 2HA GLY 76 2HA GLY 76 -1.693 5.575 -6.140
546 H HIS 77 H HIS 77 -1.446 8.466 -7.706
547 HA HIS 77 HA HIS 77 1.451 8.125 -8.242
548 1HB HIS 77 1HB HIS 77 1.208 10.408 -9.341
549 2HB HIS 77 2HB HIS 77 -0.529 10.203 -9.193
550 HD1 HIS 77 1HD HIS 77 2.008 9.850 -11.619
551 HD2 HIS 77 2HD HIS 77 -1.326 7.588 -10.566
552 HE1 HIS 77 1HE HIS 77 1.493 8.445 -13.618
553 HE2 HIS 77 2HE HIS 77 -0.553 7.117 -12.998
554 H GLY 78 H GLY 78 2.991 9.456 -7.287
555 1HA GLY 78 1HA GLY 78 3.739 10.473 -5.349
556 2HA GLY 78 2HA GLY 78 2.065 10.775 -4.890
557 H ILE 79 H ILE 79 2.000 12.933 -4.643
558 HA ILE 79 HA ILE 79 2.291 14.516 -7.053
559 HB ILE 79 HB ILE 79 1.429 15.406 -4.261
560 1HG1 ILE 79 1HG1 ILE 79 -0.235 14.869 -6.745
561 2HG1 ILE 79 2HG1 ILE 79 -0.853 15.700 -5.330
562 1HG2 ILE 79 1HG2 ILE 79 0.680 17.495 -5.323
563 2HG2 ILE 79 2HG2 ILE 79 1.382 16.952 -6.844
564 3HG2 ILE 79 3HG2 ILE 79 2.421 17.252 -5.453
565 1HD1 ILE 79 1HD1 ILE 79 -1.572 13.397 -5.353
566 2HD1 ILE 79 2HD1 ILE 79 -0.511 13.706 -3.977
567 3HD1 ILE 79 3HD1 ILE 79 0.106 12.855 -5.395
568 H ASN 80 H ASN 80 3.673 14.289 -3.855
569 HA ASN 80 HA ASN 80 6.093 15.320 -4.979
570 1HB ASN 80 1HB ASN 80 4.943 16.247 -2.366
571 2HB ASN 80 2HB ASN 80 5.185 17.257 -3.798
572 1HD2 ASN 80 1HD2 ASN 80 7.352 17.829 -4.352
573 2HD2 ASN 80 2HD2 ASN 80 8.619 17.754 -3.187
574 HA PRO 81 HA PRO 81 7.781 14.757 -5.249
575 1HB PRO 81 1HB PRO 81 9.816 13.904 -4.537
576 2HB PRO 81 2HB PRO 81 9.545 12.879 -5.953
577 1HG PRO 81 1HG PRO 81 9.962 11.842 -3.516
578 2HG PRO 81 2HG PRO 81 8.863 11.082 -4.683
579 1HD PRO 81 1HD PRO 81 8.244 12.508 -2.185
580 2HD PRO 81 2HD PRO 81 7.250 11.368 -3.117
581 H ASP 82 H ASP 82 7.797 14.208 -7.567
582 HA ASP 82 HA ASP 82 5.603 12.475 -8.356
583 1HB ASP 82 1HB ASP 82 7.486 14.185 -10.025
584 2HB ASP 82 2HB ASP 82 5.913 14.693 -9.437
585 H ASP 83 H ASP 83 8.812 12.298 -7.818
586 HA ASP 83 HA ASP 83 10.025 10.608 -9.639
587 1HB ASP 83 1HB ASP 83 10.363 10.707 -6.687
588 2HB ASP 83 2HB ASP 83 11.192 11.768 -7.818
589 H CYS 84 H CYS 84 7.610 9.788 -7.203
590 HA CYS 84 HA CYS 84 7.739 7.077 -8.153
591 1HB CYS 84 1HB CYS 84 7.476 6.198 -5.865
592 2HB CYS 84 2HB CYS 84 7.742 7.811 -5.237
593 HG CYS 84 HG CYS 84 10.380 7.805 -6.683
594 H CYS 85 H CYS 85 5.886 5.883 -7.683
595 HA CYS 85 HA CYS 85 3.467 7.078 -6.800
596 1HB CYS 85 1HB CYS 85 2.335 6.462 -8.856
597 2HB CYS 85 2HB CYS 85 3.810 5.854 -9.550
598 HG CYS 85 HG CYS 85 4.565 8.872 -8.835
599 H LEU 86 H LEU 86 1.869 5.105 -6.893
600 HA LEU 86 HA LEU 86 3.391 2.622 -6.631
601 1HB LEU 86 1HB LEU 86 2.115 1.942 -4.735
602 2HB LEU 86 2HB LEU 86 1.070 3.315 -4.817
603 HG LEU 86 HG LEU 86 2.950 4.772 -4.090
604 1HD1 LEU 86 1HD1 LEU 86 3.158 3.953 -1.797
605 2HD1 LEU 86 2HD1 LEU 86 2.485 2.401 -2.303
606 3HD1 LEU 86 3HD1 LEU 86 1.504 3.862 -2.400
607 1HD2 LEU 86 1HD2 LEU 86 4.827 3.513 -5.033
608 2HD2 LEU 86 2HD2 LEU 86 4.530 2.200 -3.896
609 3HD2 LEU 86 3HD2 LEU 86 5.063 3.772 -3.303
610 H ALA 87 H ALA 87 1.871 0.777 -6.713
611 HA ALA 87 HA ALA 87 -0.058 1.249 -8.901
612 1HB ALA 87 1HB ALA 87 1.625 -1.179 -8.483
613 2HB ALA 87 2HB ALA 87 2.064 0.188 -9.469
614 3HB ALA 87 3HB ALA 87 0.636 -0.777 -9.900
615 H GLU 88 H GLU 88 -1.837 -0.059 -9.051
616 HA GLU 88 HA GLU 88 -3.145 -0.984 -6.735
617 1HB GLU 88 1HB GLU 88 -3.606 -1.620 -9.656
618 2HB GLU 88 2HB GLU 88 -4.301 -0.267 -8.782
619 1HG GLU 88 1HG GLU 88 -4.812 -3.124 -8.017
620 2HG GLU 88 2HG GLU 88 -5.808 -2.259 -9.177
621 H TYR 89 H TYR 89 -2.987 -2.931 -5.736
622 HA TYR 89 HA TYR 89 -1.980 -5.237 -7.246
623 1HB TYR 89 1HB TYR 89 -1.576 -4.750 -4.265
624 2HB TYR 89 2HB TYR 89 -0.382 -4.285 -5.448
625 HD1 TYR 89 1HD TYR 89 1.433 -5.608 -5.518
626 HD2 TYR 89 2HD TYR 89 -2.327 -7.419 -4.728
627 HE1 TYR 89 1HE TYR 89 2.525 -7.803 -5.369
628 HE2 TYR 89 2HE TYR 89 -1.215 -9.622 -4.585
629 HH TYR 89 HH TYR 89 2.079 -9.981 -4.297
630 HA PRO 90 HA PRO 90 -6.370 -6.157 -6.451
631 1HB PRO 90 1HB PRO 90 -6.834 -7.859 -7.926
632 2HB PRO 90 2HB PRO 90 -5.431 -8.806 -7.420
633 1HG PRO 90 1HG PRO 90 -5.574 -6.446 -9.257
634 2HG PRO 90 2HG PRO 90 -4.670 -7.957 -9.456
635 1HD PRO 90 1HD PRO 90 -3.508 -5.673 -8.618
636 2HD PRO 90 2HD PRO 90 -2.975 -7.273 -8.056
637 H VAL 91 H VAL 91 -7.217 -6.678 -4.571
638 HA VAL 91 HA VAL 91 -6.116 -8.896 -3.025
639 HB VAL 91 HB VAL 91 -5.137 -6.868 -2.147
640 1HG1 VAL 91 1HG1 VAL 91 -6.491 -5.071 -1.206
641 2HG1 VAL 91 2HG1 VAL 91 -7.940 -5.863 -1.828
642 3HG1 VAL 91 3HG1 VAL 91 -6.716 -5.259 -2.946
643 1HG2 VAL 91 1HG2 VAL 91 -5.733 -8.564 -0.493
644 2HG2 VAL 91 2HG2 VAL 91 -7.329 -7.845 -0.320
645 3HG2 VAL 91 3HG2 VAL 91 -5.898 -6.946 0.185
646 H GLU 92 H GLU 92 -7.580 -10.041 -1.843
647 HA GLU 92 HA GLU 92 -10.382 -9.138 -1.759
648 1HB GLU 92 1HB GLU 92 -11.039 -11.583 -1.760
649 2HB GLU 92 2HB GLU 92 -9.397 -11.926 -2.173
650 1HG GLU 92 1HG GLU 92 -9.603 -10.887 -4.308
651 2HG GLU 92 2HG GLU 92 -11.176 -10.208 -3.884
652 H VAL 93 H VAL 93 -11.303 -9.223 0.143
653 HA VAL 93 HA VAL 93 -9.893 -10.584 2.319
654 HB VAL 93 HB VAL 93 -9.757 -8.173 2.574
655 1HG1 VAL 93 1HG1 VAL 93 -11.712 -7.437 1.366
656 2HG1 VAL 93 2HG1 VAL 93 -11.735 -6.768 2.998
657 3HG1 VAL 93 3HG1 VAL 93 -12.764 -8.140 2.596
658 1HG2 VAL 93 1HG2 VAL 93 -11.633 -9.407 4.591
659 2HG2 VAL 93 2HG2 VAL 93 -10.674 -7.949 4.851
660 3HG2 VAL 93 3HG2 VAL 93 -9.873 -9.502 4.615
661 H LYS 94 H LYS 94 -10.925 -12.253 3.084
662 HA LYS 94 HA LYS 94 -13.828 -12.109 3.208
663 1HB LYS 94 1HB LYS 94 -13.274 -13.589 1.310
664 2HB LYS 94 2HB LYS 94 -14.125 -14.441 2.574
665 1HG LYS 94 1HG LYS 94 -12.446 -15.875 1.688
666 2HG LYS 94 2HG LYS 94 -12.009 -15.438 3.332
667 1HD LYS 94 1HD LYS 94 -10.397 -13.792 2.491
668 2HD LYS 94 2HD LYS 94 -10.803 -14.226 0.841
669 1HE LYS 94 1HE LYS 94 -9.607 -16.014 2.959
670 2HE LYS 94 2HE LYS 94 -8.799 -15.389 1.524
671 1HZ LYS 94 1HZ LYS 94 -11.072 -17.290 1.538
672 2HZ LYS 94 2HZ LYS 94 -9.489 -17.685 1.195
673 3HZ LYS 94 3HZ LYS 94 -10.350 -16.681 0.158
674 H GLY 95 H GLY 95 -14.296 -11.939 5.297
675 1HA GLY 95 1HA GLY 95 -14.068 -14.112 7.029
676 2HA GLY 95 2HA GLY 95 -14.471 -12.487 7.537
677 H ASP 96 H ASP 96 -12.427 -11.155 7.151
678 HA ASP 96 HA ASP 96 -10.497 -10.377 8.115
679 1HB ASP 96 1HB ASP 96 -9.495 -11.512 9.993
680 2HB ASP 96 2HB ASP 96 -10.647 -12.839 9.856
681 H ASP 97 H ASP 97 -10.521 -13.083 6.245
682 HA ASP 97 HA ASP 97 -7.599 -13.399 6.406
683 1HB ASP 97 1HB ASP 97 -9.632 -15.078 4.894
684 2HB ASP 97 2HB ASP 97 -9.131 -15.363 6.562
685 H ILE 98 H ILE 98 -6.346 -12.994 4.632
686 HA ILE 98 HA ILE 98 -7.700 -11.477 2.508
687 HB ILE 98 HB ILE 98 -5.299 -10.596 4.087
688 1HG1 ILE 98 1HG1 ILE 98 -7.486 -10.200 5.108
689 2HG1 ILE 98 2HG1 ILE 98 -8.020 -9.380 3.647
690 1HG2 ILE 98 1HG2 ILE 98 -6.459 -9.309 1.607
691 2HG2 ILE 98 2HG2 ILE 98 -4.884 -10.081 1.723
692 3HG2 ILE 98 3HG2 ILE 98 -5.208 -8.606 2.628
693 1HD1 ILE 98 1HD1 ILE 98 -7.488 -7.820 5.360
694 2HD1 ILE 98 2HD1 ILE 98 -6.398 -7.659 3.971
695 3HD1 ILE 98 3HD1 ILE 98 -5.835 -8.450 5.456
696 H TYR 99 H TYR 99 -7.246 -11.964 0.582
697 HA TYR 99 HA TYR 99 -4.744 -13.330 -0.101
698 1HB TYR 99 1HB TYR 99 -6.167 -13.945 -2.225
699 2HB TYR 99 2HB TYR 99 -7.496 -13.542 -1.189
700 HD1 TYR 99 1HD TYR 99 -6.552 -14.647 1.405
701 HD2 TYR 99 2HD TYR 99 -6.329 -16.277 -2.496
702 HE1 TYR 99 1HE TYR 99 -6.441 -16.878 2.351
703 HE2 TYR 99 2HE TYR 99 -6.222 -18.541 -1.554
704 HH TYR 99 HH TYR 99 -6.835 -19.135 1.772
705 H VAL 100 H VAL 100 -3.621 -12.624 -1.742
706 HA VAL 100 HA VAL 100 -4.501 -10.218 -3.173
707 HB VAL 100 HB VAL 100 -2.227 -9.255 -3.035
708 1HG1 VAL 100 1HG1 VAL 100 -3.838 -8.486 -1.475
709 2HG1 VAL 100 2HG1 VAL 100 -2.246 -8.554 -0.718
710 3HG1 VAL 100 3HG1 VAL 100 -3.447 -9.801 -0.371
711 1HG2 VAL 100 1HG2 VAL 100 -0.575 -10.160 -1.446
712 2HG2 VAL 100 2HG2 VAL 100 -0.930 -11.310 -2.739
713 3HG2 VAL 100 3HG2 VAL 100 -1.642 -11.532 -1.143
714 H SER 101 H SER 101 -3.820 -10.029 -5.281
715 HA SER 101 HA SER 101 -2.637 -12.491 -6.407
716 1HB SER 101 1HB SER 101 -4.594 -10.613 -7.723
717 2HB SER 101 2HB SER 101 -5.023 -12.148 -6.969
718 HG SER 101 HG SER 101 -4.063 -11.664 -9.419
719 H THR 102 H THR 102 -0.798 -12.274 -7.539
720 HA THR 102 HA THR 102 0.226 -9.593 -8.129
721 HB THR 102 HB THR 102 1.578 -12.169 -8.926
722 HG1 THR 102 1HG THR 102 1.346 -11.063 -6.278
723 1HG2 THR 102 1HG2 THR 102 2.541 -9.979 -9.505
724 2HG2 THR 102 2HG2 THR 102 3.566 -10.835 -8.338
725 3HG2 THR 102 3HG2 THR 102 2.502 -9.530 -7.802
726 H LYS 103 H LYS 103 -1.579 -12.030 -9.593
727 HA LYS 103 HA LYS 103 -0.907 -11.173 -12.275
728 1HB LYS 103 1HB LYS 103 -3.013 -13.120 -11.301
729 2HB LYS 103 2HB LYS 103 -1.389 -13.566 -11.800
730 1HG LYS 103 1HG LYS 103 -1.877 -12.749 -14.069
731 2HG LYS 103 2HG LYS 103 -3.520 -12.362 -13.551
732 1HD LYS 103 1HD LYS 103 -3.942 -14.690 -13.039
733 2HD LYS 103 2HD LYS 103 -2.290 -15.111 -13.466
734 1HE LYS 103 1HE LYS 103 -2.721 -14.319 -15.773
735 2HE LYS 103 2HE LYS 103 -4.388 -13.977 -15.322
736 1HZ LYS 103 1HZ LYS 103 -4.209 -16.082 -16.436
737 2HZ LYS 103 2HZ LYS 103 -4.689 -16.338 -14.830
738 3HZ LYS 103 3HZ LYS 103 -3.102 -16.653 -15.296
739 H GLY 104 H GLY 104 -1.926 -9.531 -13.232
740 1HA GLY 104 1HA GLY 104 -4.617 -8.787 -12.298
741 2HA GLY 104 2HA GLY 104 -3.922 -8.362 -13.858
742 H ILE 105 H ILE 105 -1.365 -7.756 -12.454
743 HA ILE 105 HA ILE 105 -2.073 -5.326 -11.012
744 HB ILE 105 HB ILE 105 0.524 -6.880 -11.168
745 1HG1 ILE 105 1HG1 ILE 105 -1.158 -7.788 -9.684
746 2HG1 ILE 105 2HG1 ILE 105 -1.303 -6.220 -8.888
747 1HG2 ILE 105 1HG2 ILE 105 0.035 -4.241 -9.770
748 2HG2 ILE 105 2HG2 ILE 105 1.069 -4.487 -11.175
749 3HG2 ILE 105 3HG2 ILE 105 1.491 -5.228 -9.630
750 1HD1 ILE 105 1HD1 ILE 105 1.150 -7.938 -8.964
751 2HD1 ILE 105 2HD1 ILE 105 0.067 -7.689 -7.579
752 3HD1 ILE 105 3HD1 ILE 105 1.016 -6.354 -8.212
753 H LEU 106 H LEU 106 -1.851 -3.424 -11.929
754 HA LEU 106 HA LEU 106 -0.171 -3.228 -14.301
755 1HB LEU 106 1HB LEU 106 -2.306 -1.313 -13.284
756 2HB LEU 106 2HB LEU 106 -2.605 -2.546 -14.482
757 HG LEU 106 HG LEU 106 -2.480 -0.413 -15.582
758 1HD1 LEU 106 1HD1 LEU 106 -1.152 0.864 -14.015
759 2HD1 LEU 106 2HD1 LEU 106 -0.486 0.978 -15.643
760 3HD1 LEU 106 3HD1 LEU 106 0.285 -0.064 -14.447
761 1HD2 LEU 106 1HD2 LEU 106 -0.725 -0.843 -17.227
762 2HD2 LEU 106 2HD2 LEU 106 -1.603 -2.313 -16.807
763 3HD2 LEU 106 3HD2 LEU 106 0.001 -2.024 -16.139
764 HA PRO 107 HA PRO 107 2.437 -1.399 -11.041
765 1HB PRO 107 1HB PRO 107 4.123 -2.857 -11.712
766 2HB PRO 107 2HB PRO 107 4.731 -1.402 -12.511
767 1HG PRO 107 1HG PRO 107 4.245 -3.625 -13.899
768 2HG PRO 107 2HG PRO 107 3.868 -2.032 -14.577
769 1HD PRO 107 1HD PRO 107 2.034 -4.096 -13.449
770 2HD PRO 107 2HD PRO 107 1.786 -2.957 -14.790
771 H ASN 108 H ASN 108 2.814 0.679 -10.749
772 HA ASN 108 HA ASN 108 2.393 2.489 -12.998
773 1HB ASN 108 1HB ASN 108 1.627 2.563 -10.181
774 2HB ASN 108 2HB ASN 108 0.543 2.473 -11.593
775 1HD2 ASN 108 1HD2 ASN 108 0.619 4.255 -9.381
776 2HD2 ASN 108 2HD2 ASN 108 0.736 5.858 -9.949
777 H LYS 109 H LYS 109 3.935 3.439 -13.377
778 HA LYS 109 HA LYS 109 5.943 4.541 -13.565
779 1HB LYS 109 1HB LYS 109 5.605 5.270 -10.671
780 2HB LYS 109 2HB LYS 109 4.672 6.051 -11.929
781 1HG LYS 109 1HG LYS 109 6.460 7.528 -11.368
782 2HG LYS 109 2HG LYS 109 6.798 6.867 -12.959
783 1HD LYS 109 1HD LYS 109 8.319 5.221 -11.897
784 2HD LYS 109 2HD LYS 109 8.100 6.087 -10.373
785 1HE LYS 109 1HE LYS 109 8.933 8.139 -11.433
786 2HE LYS 109 2HE LYS 109 9.165 7.253 -12.938
787 1HZ LYS 109 1HZ LYS 109 10.552 6.747 -10.379
788 2HZ LYS 109 2HZ LYS 109 11.248 7.410 -11.758
789 3HZ LYS 109 3HZ LYS 109 10.731 5.800 -11.753
790 H ALA 110 H ALA 110 5.853 2.950 -10.575
791 HA ALA 110 HA ALA 110 8.648 2.119 -10.724
792 1HB ALA 110 1HB ALA 110 6.552 1.494 -8.632
793 2HB ALA 110 2HB ALA 110 7.698 2.827 -8.564
794 3HB ALA 110 3HB ALA 110 8.281 1.163 -8.489
795 H HIS 111 H HIS 111 8.023 -0.562 -9.383
796 HA HIS 111 HA HIS 111 6.764 -2.025 -11.435
797 1HB HIS 111 1HB HIS 111 8.718 -1.496 -12.769
798 2HB HIS 111 2HB HIS 111 8.729 -3.206 -12.381
799 HD1 HIS 111 1HD HIS 111 10.877 -0.289 -12.346
800 HD2 HIS 111 2HD HIS 111 10.659 -3.870 -10.249
801 HE1 HIS 111 1HE HIS 111 13.141 -0.621 -11.340
802 HE2 HIS 111 2HE HIS 111 12.920 -2.698 -9.934
803 H SER 112 H SER 112 6.869 -4.297 -11.171
804 HA SER 112 HA SER 112 7.998 -5.380 -8.787
805 1HB SER 112 1HB SER 112 5.805 -6.217 -7.968
806 2HB SER 112 2HB SER 112 4.993 -5.289 -9.229
807 HG SER 112 HG SER 112 6.755 -3.867 -7.732
Start of MODEL 3
1 1H MET 1 1HT MET 1 -2.024 -19.093 -11.335
2 2H MET 1 2HT MET 1 -1.546 -17.482 -11.095
3 3H MET 1 3HT MET 1 -2.783 -17.847 -12.149
4 HA MET 1 HA MET 1 -4.227 -18.556 -10.496
5 1HB MET 1 1HB MET 1 -3.624 -18.242 -8.074
6 2HB MET 1 2HB MET 1 -1.962 -17.993 -8.565
7 1HG MET 1 1HG MET 1 -3.542 -20.509 -9.050
8 2HG MET 1 2HG MET 1 -2.414 -20.268 -7.727
9 1HE MET 1 1HE MET 1 0.224 -20.071 -7.988
10 2HE MET 1 2HE MET 1 0.002 -18.688 -9.054
11 3HE MET 1 3HE MET 1 1.037 -20.024 -9.550
12 H SER 2 H SER 2 -5.644 -17.115 -9.508
13 HA SER 2 HA SER 2 -4.867 -14.301 -9.690
14 1HB SER 2 1HB SER 2 -7.252 -13.855 -10.111
15 2HB SER 2 2HB SER 2 -7.603 -15.580 -9.979
16 HG SER 2 HG SER 2 -6.189 -15.895 -11.782
17 H PHE 3 H PHE 3 -5.060 -13.147 -7.873
18 HA PHE 3 HA PHE 3 -5.328 -12.579 -5.710
19 1HB PHE 3 1HB PHE 3 -7.295 -13.455 -4.418
20 2HB PHE 3 2HB PHE 3 -7.610 -14.571 -5.739
21 HD1 PHE 3 1HD PHE 3 -8.802 -13.913 -7.649
22 HD2 PHE 3 2HD PHE 3 -7.467 -10.993 -4.856
23 HE1 PHE 3 1HE PHE 3 -10.166 -12.212 -8.783
24 HE2 PHE 3 2HE PHE 3 -8.834 -9.290 -5.983
25 HZ PHE 3 HZ PHE 3 -10.184 -9.894 -7.948
26 H GLU 4 H GLU 4 -3.632 -13.010 -4.625
27 HA GLU 4 HA GLU 4 -2.991 -15.765 -3.908
28 1HB GLU 4 1HB GLU 4 -0.696 -14.893 -3.775
29 2HB GLU 4 2HB GLU 4 -1.288 -13.289 -4.182
30 1HG GLU 4 1HG GLU 4 -2.119 -14.223 -6.342
31 2HG GLU 4 2HG GLU 4 -1.312 -15.736 -5.942
32 H LYS 5 H LYS 5 -2.509 -16.220 -1.805
33 HA LYS 5 HA LYS 5 -3.585 -14.612 0.334
34 1HB LYS 5 1HB LYS 5 -1.942 -17.096 0.184
35 2HB LYS 5 2HB LYS 5 -3.671 -17.035 0.473
36 1HG LYS 5 1HG LYS 5 -1.492 -16.235 2.402
37 2HG LYS 5 2HG LYS 5 -2.517 -17.663 2.495
38 1HD LYS 5 1HD LYS 5 -4.474 -16.318 2.912
39 2HD LYS 5 2HD LYS 5 -3.490 -14.845 2.804
40 1HE LYS 5 1HE LYS 5 -2.087 -15.690 4.637
41 2HE LYS 5 2HE LYS 5 -3.094 -17.123 4.760
42 1HZ LYS 5 1HZ LYS 5 -3.574 -15.493 6.429
43 2HZ LYS 5 2HZ LYS 5 -4.937 -15.809 5.513
44 3HZ LYS 5 3HZ LYS 5 -4.042 -14.360 5.278
45 H ILE 6 H ILE 6 -2.698 -13.032 1.193
46 HA ILE 6 HA ILE 6 0.223 -12.787 1.101
47 HB ILE 6 HB ILE 6 -0.879 -11.178 -0.304
48 1HG1 ILE 6 1HG1 ILE 6 0.352 -9.907 2.135
49 2HG1 ILE 6 2HG1 ILE 6 0.049 -9.064 0.620
50 1HG2 ILE 6 1HG2 ILE 6 -3.025 -10.953 0.689
51 2HG2 ILE 6 2HG2 ILE 6 -2.278 -9.359 0.566
52 3HG2 ILE 6 3HG2 ILE 6 -2.326 -10.189 2.119
53 1HD1 ILE 6 1HD1 ILE 6 1.874 -11.435 0.979
54 2HD1 ILE 6 2HD1 ILE 6 2.373 -9.755 0.782
55 3HD1 ILE 6 3HD1 ILE 6 1.558 -10.595 -0.539
56 H CYS 7 H CYS 7 -2.604 -11.964 3.008
57 HA CYS 7 HA CYS 7 -1.123 -12.406 5.454
58 1HB CYS 7 1HB CYS 7 -0.417 -10.153 5.058
59 2HB CYS 7 2HB CYS 7 -1.567 -10.139 6.371
60 HG CYS 7 HG CYS 7 -2.292 -7.924 5.128
61 H SER 8 H SER 8 -2.683 -11.151 7.242
62 HA SER 8 HA SER 8 -5.388 -12.196 6.858
63 1HB SER 8 1HB SER 8 -4.285 -13.872 8.177
64 2HB SER 8 2HB SER 8 -5.304 -12.921 9.243
65 HG SER 8 HG SER 8 -2.754 -11.897 9.067
66 H LEU 9 H LEU 9 -6.940 -11.193 8.093
67 HA LEU 9 HA LEU 9 -6.655 -8.343 8.416
68 1HB LEU 9 1HB LEU 9 -8.818 -10.077 9.577
69 2HB LEU 9 2HB LEU 9 -8.743 -9.824 7.862
70 HG LEU 9 HG LEU 9 -10.480 -8.429 8.796
71 1HD1 LEU 9 1HD1 LEU 9 -8.434 -7.194 10.604
72 2HD1 LEU 9 2HD1 LEU 9 -9.799 -8.208 11.080
73 3HD1 LEU 9 3HD1 LEU 9 -10.083 -6.618 10.368
74 1HD2 LEU 9 1HD2 LEU 9 -9.287 -7.495 6.929
75 2HD2 LEU 9 2HD2 LEU 9 -8.110 -6.749 8.013
76 3HD2 LEU 9 3HD2 LEU 9 -9.787 -6.211 8.029
77 H ASP 10 H ASP 10 -6.054 -11.049 10.360
78 HA ASP 10 HA ASP 10 -6.135 -10.048 13.004
79 1HB ASP 10 1HB ASP 10 -4.115 -11.984 11.830
80 2HB ASP 10 2HB ASP 10 -5.711 -12.450 12.395
81 H ASP 11 H ASP 11 -3.915 -9.656 10.370
82 HA ASP 11 HA ASP 11 -1.818 -8.416 11.884
83 1HB ASP 11 1HB ASP 11 -0.865 -7.813 9.682
84 2HB ASP 11 2HB ASP 11 -2.324 -8.380 8.892
85 H ILE 12 H ILE 12 -4.100 -7.284 9.421
86 HA ILE 12 HA ILE 12 -3.795 -4.658 10.612
87 HB ILE 12 HB ILE 12 -4.306 -3.556 8.550
88 1HG1 ILE 12 1HG1 ILE 12 -4.547 -4.614 6.412
89 2HG1 ILE 12 2HG1 ILE 12 -5.675 -5.389 7.504
90 1HG2 ILE 12 1HG2 ILE 12 -2.103 -5.567 8.286
91 2HG2 ILE 12 2HG2 ILE 12 -1.975 -3.983 9.066
92 3HG2 ILE 12 3HG2 ILE 12 -2.219 -4.103 7.312
93 1HD1 ILE 12 1HD1 ILE 12 -3.027 -6.542 6.731
94 2HD1 ILE 12 2HD1 ILE 12 -4.569 -6.971 6.007
95 3HD1 ILE 12 3HD1 ILE 12 -4.269 -7.334 7.711
96 H TRP 13 H TRP 13 -5.306 -3.876 11.564
97 HA TRP 13 HA TRP 13 -8.050 -4.752 11.190
98 1HB TRP 13 1HB TRP 13 -8.411 -3.693 13.389
99 2HB TRP 13 2HB TRP 13 -6.726 -3.170 13.402
100 HD1 TRP 13 HD TRP 13 -4.877 -5.204 13.378
101 HE1 TRP 13 1HE TRP 13 -4.972 -7.482 14.566
102 HE3 TRP 13 3HE TRP 13 -9.900 -5.467 14.192
103 HZ2 TRP 13 2HZ TRP 13 -6.924 -9.161 15.699
104 HZ3 TRP 13 3HZ TRP 13 -10.813 -7.446 15.338
105 HH2 TRP 13 HH TRP 13 -9.351 -9.254 16.076
106 H VAL 14 H VAL 14 -9.630 -2.870 11.571
107 HA VAL 14 HA VAL 14 -9.414 -1.041 9.531
108 HB VAL 14 HB VAL 14 -11.547 -1.585 10.581
109 1HG1 VAL 14 1HG1 VAL 14 -10.610 -0.055 12.990
110 2HG1 VAL 14 2HG1 VAL 14 -10.894 -1.791 12.890
111 3HG1 VAL 14 3HG1 VAL 14 -12.245 -0.665 12.740
112 1HG2 VAL 14 1HG2 VAL 14 -11.458 0.457 9.353
113 2HG2 VAL 14 2HG2 VAL 14 -10.912 1.348 10.780
114 3HG2 VAL 14 3HG2 VAL 14 -12.541 0.665 10.730
115 H GLY 15 H GLY 15 -7.958 0.516 9.185
116 1HA GLY 15 1HA GLY 15 -7.209 2.319 11.365
117 2HA GLY 15 2HA GLY 15 -6.998 2.612 9.645
118 H GLU 16 H GLU 16 -6.001 -0.441 9.860
119 HA GLU 16 HA GLU 16 -3.288 0.205 10.796
120 1HB GLU 16 1HB GLU 16 -4.449 -2.513 10.328
121 2HB GLU 16 2HB GLU 16 -4.646 -1.739 11.858
122 1HG GLU 16 1HG GLU 16 -2.054 -2.522 10.519
123 2HG GLU 16 2HG GLU 16 -2.788 -3.296 11.930
124 H MET 17 H MET 17 -1.516 -0.500 9.546
125 HA MET 17 HA MET 17 -1.969 -1.571 6.888
126 1HB MET 17 1HB MET 17 -2.170 0.817 6.493
127 2HB MET 17 2HB MET 17 -0.688 0.180 5.791
128 1HG MET 17 1HG MET 17 0.607 1.039 7.619
129 2HG MET 17 2HG MET 17 -0.804 1.673 8.420
130 1HE MET 17 1HE MET 17 0.070 3.980 8.711
131 2HE MET 17 2HE MET 17 0.830 4.957 7.465
132 3HE MET 17 3HE MET 17 1.631 3.492 8.047
133 H GLU 18 H GLU 18 -0.302 -2.798 6.270
134 HA GLU 18 HA GLU 18 2.328 -2.219 7.290
135 1HB GLU 18 1HB GLU 18 2.876 -4.495 7.963
136 2HB GLU 18 2HB GLU 18 1.217 -5.027 7.734
137 1HG GLU 18 1HG GLU 18 0.486 -3.674 9.591
138 2HG GLU 18 2HG GLU 18 2.100 -2.995 9.776
139 H THR 19 H THR 19 3.990 -3.260 6.069
140 HA THR 19 HA THR 19 3.007 -3.926 3.439
141 HB THR 19 HB THR 19 4.775 -2.204 3.539
142 HG1 THR 19 1HG THR 19 5.887 -4.565 2.438
143 1HG2 THR 19 1HG2 THR 19 5.975 -2.971 5.527
144 2HG2 THR 19 2HG2 THR 19 7.076 -2.825 4.141
145 3HG2 THR 19 3HG2 THR 19 6.490 -4.410 4.649
146 H PHE 20 H PHE 20 3.249 -5.778 2.484
147 HA PHE 20 HA PHE 20 4.829 -7.871 3.722
148 1HB PHE 20 1HB PHE 20 3.069 -9.530 3.051
149 2HB PHE 20 2HB PHE 20 2.005 -8.197 2.673
150 HD1 PHE 20 1HD PHE 20 3.654 -10.076 5.343
151 HD2 PHE 20 2HD PHE 20 0.937 -6.907 4.491
152 HE1 PHE 20 1HE PHE 20 2.921 -10.070 7.685
153 HE2 PHE 20 2HE PHE 20 0.202 -6.903 6.827
154 HZ PHE 20 HZ PHE 20 1.193 -8.486 8.434
155 H GLU 21 H GLU 21 5.560 -9.387 2.201
156 HA GLU 21 HA GLU 21 6.064 -7.996 -0.319
157 1HB GLU 21 1HB GLU 21 7.608 -10.215 1.006
158 2HB GLU 21 2HB GLU 21 7.942 -8.510 1.205
159 1HG GLU 21 1HG GLU 21 8.450 -8.326 -1.168
160 2HG GLU 21 2HG GLU 21 8.148 -10.055 -1.354
161 H THR 22 H THR 22 5.924 -8.983 -2.312
162 HA THR 22 HA THR 22 3.971 -11.085 -2.504
163 HB THR 22 HB THR 22 4.109 -10.663 -4.919
164 HG1 THR 22 1HG THR 22 5.567 -8.926 -5.548
165 1HG2 THR 22 1HG2 THR 22 4.264 -8.093 -3.380
166 2HG2 THR 22 2HG2 THR 22 2.797 -9.074 -3.541
167 3HG2 THR 22 3HG2 THR 22 3.521 -8.297 -4.959
168 H SER 23 H SER 23 4.515 -12.748 -4.376
169 HA SER 23 HA SER 23 6.680 -14.343 -3.548
170 1HB SER 23 1HB SER 23 5.995 -15.786 -5.393
171 2HB SER 23 2HB SER 23 5.010 -14.458 -6.022
172 HG SER 23 HG SER 23 3.494 -15.201 -4.784
173 H ASP 24 H ASP 24 6.482 -11.677 -5.527
174 HA ASP 24 HA ASP 24 8.709 -12.311 -7.310
175 1HB ASP 24 1HB ASP 24 6.891 -9.937 -6.977
176 2HB ASP 24 2HB ASP 24 6.873 -11.113 -8.277
177 H GLY 25 H GLY 25 8.223 -10.983 -4.239
178 1HA GLY 25 1HA GLY 25 10.943 -9.926 -4.237
179 2HA GLY 25 2HA GLY 25 9.939 -10.215 -2.818
180 H THR 26 H THR 26 7.774 -8.784 -4.538
181 HA THR 26 HA THR 26 8.717 -6.059 -4.140
182 HB THR 26 HB THR 26 6.283 -7.150 -5.518
183 HG1 THR 26 1HG THR 26 7.956 -7.386 -7.027
184 1HG2 THR 26 1HG2 THR 26 5.817 -4.921 -4.572
185 2HG2 THR 26 2HG2 THR 26 5.914 -4.831 -6.331
186 3HG2 THR 26 3HG2 THR 26 7.267 -4.277 -5.345
187 H GLU 27 H GLU 27 8.054 -4.845 -2.497
188 HA GLU 27 HA GLU 27 6.286 -6.136 -0.631
189 1HB GLU 27 1HB GLU 27 7.089 -4.482 0.976
190 2HB GLU 27 2HB GLU 27 8.005 -3.680 -0.289
191 1HG GLU 27 1HG GLU 27 9.300 -5.712 -0.627
192 2HG GLU 27 2HG GLU 27 8.364 -6.533 0.609
193 H VAL 28 H VAL 28 4.367 -5.588 -0.172
194 HA VAL 28 HA VAL 28 3.169 -3.306 -1.566
195 HB VAL 28 HB VAL 28 2.090 -6.014 -0.872
196 1HG1 VAL 28 1HG1 VAL 28 0.661 -3.776 -2.320
197 2HG1 VAL 28 2HG1 VAL 28 0.276 -4.403 -0.719
198 3HG1 VAL 28 3HG1 VAL 28 0.039 -5.418 -2.143
199 1HG2 VAL 28 1HG2 VAL 28 2.707 -4.820 -3.564
200 2HG2 VAL 28 2HG2 VAL 28 1.922 -6.378 -3.312
201 3HG2 VAL 28 3HG2 VAL 28 3.577 -6.118 -2.752
202 H LEU 29 H LEU 29 1.753 -2.146 -0.404
203 HA LEU 29 HA LEU 29 1.837 -2.422 2.515
204 1HB LEU 29 1HB LEU 29 0.840 -0.197 0.747
205 2HB LEU 29 2HB LEU 29 2.443 -0.271 1.421
206 HG LEU 29 HG LEU 29 -0.099 -0.065 3.026
207 1HD1 LEU 29 1HD1 LEU 29 2.784 0.113 3.863
208 2HD1 LEU 29 2HD1 LEU 29 1.651 -1.181 4.271
209 3HD1 LEU 29 3HD1 LEU 29 1.395 0.446 4.892
210 1HD2 LEU 29 1HD2 LEU 29 0.601 2.234 3.440
211 2HD2 LEU 29 2HD2 LEU 29 0.307 1.943 1.729
212 3HD2 LEU 29 3HD2 LEU 29 1.962 2.018 2.341
213 H ILE 30 H ILE 30 0.152 -3.504 3.354
214 HA ILE 30 HA ILE 30 -2.385 -3.371 1.935
215 HB ILE 30 HB ILE 30 -1.531 -5.287 4.156
216 1HG1 ILE 30 1HG1 ILE 30 -2.124 -5.694 1.247
217 2HG1 ILE 30 2HG1 ILE 30 -1.964 -7.049 2.363
218 1HG2 ILE 30 1HG2 ILE 30 -3.702 -6.393 3.831
219 2HG2 ILE 30 2HG2 ILE 30 -4.159 -5.138 2.683
220 3HG2 ILE 30 3HG2 ILE 30 -3.891 -4.724 4.374
221 1HD1 ILE 30 1HD1 ILE 30 0.377 -6.438 2.746
222 2HD1 ILE 30 2HD1 ILE 30 0.205 -5.111 1.610
223 3HD1 ILE 30 3HD1 ILE 30 0.048 -6.776 1.046
224 H VAL 31 H VAL 31 -3.680 -1.885 2.547
225 HA VAL 31 HA VAL 31 -3.560 -0.910 5.328
226 HB VAL 31 HB VAL 31 -4.539 0.554 2.876
227 1HG1 VAL 31 1HG1 VAL 31 -4.024 1.532 5.673
228 2HG1 VAL 31 2HG1 VAL 31 -5.595 1.317 4.907
229 3HG1 VAL 31 3HG1 VAL 31 -4.478 2.540 4.300
230 1HG2 VAL 31 1HG2 VAL 31 -2.158 0.195 2.705
231 2HG2 VAL 31 2HG2 VAL 31 -1.917 0.856 4.325
232 3HG2 VAL 31 3HG2 VAL 31 -2.501 1.891 3.025
233 H ASN 32 H ASN 32 -5.384 -1.205 6.481
234 HA ASN 32 HA ASN 32 -7.825 -1.676 4.936
235 1HB ASN 32 1HB ASN 32 -7.289 -2.300 7.865
236 2HB ASN 32 2HB ASN 32 -7.251 -3.480 6.559
237 1HD2 ASN 32 1HD2 ASN 32 -8.885 -3.540 8.872
238 2HD2 ASN 32 2HD2 ASN 32 -10.530 -3.524 8.375
239 H SER 33 H SER 33 -8.824 0.078 4.600
240 HA SER 33 HA SER 33 -8.371 2.474 6.095
241 1HB SER 33 1HB SER 33 -10.101 1.843 3.694
242 2HB SER 33 2HB SER 33 -8.474 2.495 3.644
243 HG SER 33 HG SER 33 -9.175 4.377 4.488
244 H GLU 34 H GLU 34 -9.868 3.644 7.184
245 HA GLU 34 HA GLU 34 -11.552 2.360 8.927
246 1HB GLU 34 1HB GLU 34 -12.332 4.493 9.646
247 2HB GLU 34 2HB GLU 34 -11.930 5.235 8.112
248 1HG GLU 34 1HG GLU 34 -9.771 4.086 9.834
249 2HG GLU 34 2HG GLU 34 -10.422 5.696 10.145
250 H GLU 35 H GLU 35 -12.477 4.188 6.027
251 HA GLU 35 HA GLU 35 -15.154 3.031 6.346
252 1HB GLU 35 1HB GLU 35 -16.009 4.865 5.044
253 2HB GLU 35 2HB GLU 35 -14.386 5.489 4.786
254 1HG GLU 35 1HG GLU 35 -14.163 5.931 7.164
255 2HG GLU 35 2HG GLU 35 -15.770 5.256 7.449
256 H HIS 36 H HIS 36 -12.534 3.493 4.017
257 HA HIS 36 HA HIS 36 -14.186 2.534 1.865
258 1HB HIS 36 1HB HIS 36 -11.215 3.083 1.854
259 2HB HIS 36 2HB HIS 36 -12.469 4.255 1.468
260 HD1 HIS 36 1HD HIS 36 -13.689 3.998 -0.808
261 HD2 HIS 36 2HD HIS 36 -10.611 1.294 -0.204
262 HE1 HIS 36 1HE HIS 36 -13.207 3.025 -3.057
263 HE2 HIS 36 2HE HIS 36 -11.154 1.663 -2.707
264 H GLY 37 H GLY 37 -11.893 1.070 4.037
265 1HA GLY 37 1HA GLY 37 -12.500 -1.453 2.690
266 2HA GLY 37 2HA GLY 37 -12.035 -1.281 4.372
267 H VAL 38 H VAL 38 -10.939 -2.864 2.145
268 HA VAL 38 HA VAL 38 -8.234 -2.389 2.998
269 HB VAL 38 HB VAL 38 -9.178 -4.633 3.294
270 1HG1 VAL 38 1HG1 VAL 38 -9.545 -6.133 1.390
271 2HG1 VAL 38 2HG1 VAL 38 -9.319 -4.771 0.297
272 3HG1 VAL 38 3HG1 VAL 38 -10.674 -4.779 1.427
273 1HG2 VAL 38 1HG2 VAL 38 -7.311 -5.935 2.332
274 2HG2 VAL 38 2HG2 VAL 38 -6.776 -4.440 3.099
275 3HG2 VAL 38 3HG2 VAL 38 -6.880 -4.539 1.341
276 H LYS 39 H LYS 39 -6.623 -1.866 1.801
277 HA LYS 39 HA LYS 39 -6.929 -1.563 -1.105
278 1HB LYS 39 1HB LYS 39 -5.496 0.416 -0.863
279 2HB LYS 39 2HB LYS 39 -5.561 0.228 0.867
280 1HG LYS 39 1HG LYS 39 -8.093 0.544 0.663
281 2HG LYS 39 2HG LYS 39 -7.783 1.013 -1.017
282 1HD LYS 39 1HD LYS 39 -6.108 2.693 -0.051
283 2HD LYS 39 2HD LYS 39 -6.894 2.232 1.489
284 1HE LYS 39 1HE LYS 39 -8.990 3.053 0.839
285 2HE LYS 39 2HE LYS 39 -8.453 3.333 -0.814
286 1HZ LYS 39 1HZ LYS 39 -8.544 5.403 0.394
287 2HZ LYS 39 2HZ LYS 39 -6.947 5.070 0.016
288 3HZ LYS 39 3HZ LYS 39 -7.507 4.845 1.591
289 H ALA 40 H ALA 40 -5.318 -2.526 -2.129
290 HA ALA 40 HA ALA 40 -2.840 -3.138 -0.680
291 1HB ALA 40 1HB ALA 40 -4.174 -5.175 -0.945
292 2HB ALA 40 2HB ALA 40 -2.675 -5.237 -1.878
293 3HB ALA 40 3HB ALA 40 -4.204 -4.911 -2.690
294 H TYR 41 H TYR 41 -1.336 -1.944 -1.540
295 HA TYR 41 HA TYR 41 -0.987 -1.917 -4.407
296 1HB TYR 41 1HB TYR 41 -2.261 0.077 -4.168
297 2HB TYR 41 2HB TYR 41 -0.590 0.607 -4.304
298 HD1 TYR 41 1HD TYR 41 -3.437 0.186 -2.041
299 HD2 TYR 41 2HD TYR 41 0.497 1.721 -2.459
300 HE1 TYR 41 1HE TYR 41 -3.721 1.434 0.045
301 HE2 TYR 41 2HE TYR 41 0.223 2.978 -0.361
302 HH TYR 41 HH TYR 41 -1.690 3.871 0.929
303 H GLN 42 H GLN 42 1.205 -1.343 -5.017
304 HA GLN 42 HA GLN 42 3.145 -2.436 -3.395
305 1HB GLN 42 1HB GLN 42 3.539 -2.187 -5.729
306 2HB GLN 42 2HB GLN 42 4.737 -1.180 -4.929
307 1HG GLN 42 1HG GLN 42 3.718 0.776 -5.566
308 2HG GLN 42 2HG GLN 42 2.156 0.012 -5.839
309 1HE2 GLN 42 1HE2 GLN 42 1.819 -1.147 -7.693
310 2HE2 GLN 42 2HE2 GLN 42 2.793 -0.967 -9.103
311 H ALA 43 H ALA 43 4.638 -1.641 -1.934
312 HA ALA 43 HA ALA 43 3.351 0.221 -0.226
313 1HB ALA 43 1HB ALA 43 4.948 -0.395 1.438
314 2HB ALA 43 2HB ALA 43 5.989 -1.124 0.220
315 3HB ALA 43 3HB ALA 43 4.414 -1.834 0.570
316 H MET 44 H MET 44 6.497 0.300 -1.728
317 HA MET 44 HA MET 44 6.965 2.894 -0.460
318 1HB MET 44 1HB MET 44 8.796 1.226 -0.484
319 2HB MET 44 2HB MET 44 9.249 2.757 -1.208
320 1HG MET 44 1HG MET 44 10.200 1.010 -2.519
321 2HG MET 44 2HG MET 44 8.919 1.761 -3.456
322 1HE MET 44 1HE MET 44 10.047 -1.372 -1.459
323 2HE MET 44 2HE MET 44 8.649 -2.421 -1.578
324 3HE MET 44 3HE MET 44 8.572 -0.979 -0.556
325 H CYS 45 H CYS 45 7.678 4.772 -1.649
326 HA CYS 45 HA CYS 45 6.599 4.955 -4.321
327 1HB CYS 45 1HB CYS 45 6.191 6.906 -2.910
328 2HB CYS 45 2HB CYS 45 7.350 7.383 -4.145
329 HA PRO 46 HA PRO 46 9.968 2.269 -5.556
330 1HB PRO 46 1HB PRO 46 10.312 2.756 -7.753
331 2HB PRO 46 2HB PRO 46 10.179 4.509 -7.506
332 1HG PRO 46 1HG PRO 46 8.047 2.487 -7.858
333 2HG PRO 46 2HG PRO 46 7.936 4.247 -7.980
334 1HD PRO 46 1HD PRO 46 7.400 2.503 -5.648
335 2HD PRO 46 2HD PRO 46 6.848 4.154 -6.000
336 H HIS 47 H HIS 47 10.875 4.010 -3.338
337 HA HIS 47 HA HIS 47 13.672 4.263 -4.036
338 1HB HIS 47 1HB HIS 47 13.809 6.581 -3.010
339 2HB HIS 47 2HB HIS 47 12.051 6.655 -3.123
340 HD2 HIS 47 2HD HIS 47 14.853 5.717 -5.695
341 HE1 HIS 47 1HE HIS 47 11.981 8.065 -7.658
342 HE2 HIS 47 2HE HIS 47 14.218 6.946 -7.819
343 H GLN 48 H GLN 48 14.897 3.589 -2.542
344 HA GLN 48 HA GLN 48 15.848 3.064 -0.663
345 1HB GLN 48 1HB GLN 48 13.955 5.006 0.649
346 2HB GLN 48 2HB GLN 48 15.572 5.348 0.056
347 1HG GLN 48 1HG GLN 48 16.463 3.729 1.720
348 2HG GLN 48 2HG GLN 48 14.833 3.548 2.354
349 1HE2 GLN 48 1HE2 GLN 48 17.564 5.612 2.105
350 2HE2 GLN 48 2HE2 GLN 48 17.076 6.786 3.265
351 H GLU 49 H GLU 49 15.910 1.303 0.302
352 HA GLU 49 HA GLU 49 13.469 -0.054 0.895
353 1HB GLU 49 1HB GLU 49 15.026 -1.466 -0.222
354 2HB GLU 49 2HB GLU 49 14.949 -2.014 1.440
355 1HG GLU 49 1HG GLU 49 17.192 -2.160 0.741
356 2HG GLU 49 2HG GLU 49 17.073 -0.850 1.913
357 H ILE 50 H ILE 50 12.512 0.481 2.665
358 HA ILE 50 HA ILE 50 13.847 0.270 5.220
359 HB ILE 50 HB ILE 50 14.253 2.642 4.566
360 1HG1 ILE 50 1HG1 ILE 50 12.160 2.388 6.743
361 2HG1 ILE 50 2HG1 ILE 50 13.178 3.801 6.501
362 1HG2 ILE 50 1HG2 ILE 50 12.464 2.985 3.012
363 2HG2 ILE 50 2HG2 ILE 50 12.407 4.226 4.264
364 3HG2 ILE 50 3HG2 ILE 50 11.271 2.878 4.305
365 1HD1 ILE 50 1HD1 ILE 50 15.164 2.453 6.960
366 2HD1 ILE 50 2HD1 ILE 50 14.130 1.048 7.244
367 3HD1 ILE 50 3HD1 ILE 50 14.025 2.449 8.303
368 H LEU 51 H LEU 51 12.159 0.068 6.928
369 HA LEU 51 HA LEU 51 9.743 -0.925 5.776
370 1HB LEU 51 1HB LEU 51 9.035 -1.452 8.154
371 2HB LEU 51 2HB LEU 51 10.565 -0.803 8.694
372 HG LEU 51 HG LEU 51 10.324 -3.180 6.850
373 1HD1 LEU 51 1HD1 LEU 51 12.632 -3.642 7.453
374 2HD1 LEU 51 2HD1 LEU 51 12.669 -2.167 8.420
375 3HD1 LEU 51 3HD1 LEU 51 12.457 -2.067 6.674
376 1HD2 LEU 51 1HD2 LEU 51 10.742 -3.159 9.831
377 2HD2 LEU 51 2HD2 LEU 51 10.826 -4.577 8.786
378 3HD2 LEU 51 3HD2 LEU 51 9.300 -3.717 8.984
379 H LEU 52 H LEU 52 9.010 0.788 4.832
380 HA LEU 52 HA LEU 52 8.365 3.194 6.161
381 1HB LEU 52 1HB LEU 52 9.017 3.378 3.866
382 2HB LEU 52 2HB LEU 52 7.402 3.988 4.045
383 HG LEU 52 HG LEU 52 7.778 2.833 1.909
384 1HD1 LEU 52 1HD1 LEU 52 8.035 0.297 3.459
385 2HD1 LEU 52 2HD1 LEU 52 9.294 1.111 2.531
386 3HD1 LEU 52 3HD1 LEU 52 7.883 0.442 1.707
387 1HD2 LEU 52 1HD2 LEU 52 5.522 3.013 2.734
388 2HD2 LEU 52 2HD2 LEU 52 5.703 1.504 3.628
389 3HD2 LEU 52 3HD2 LEU 52 5.742 1.498 1.862
390 H SER 53 H SER 53 6.699 0.309 5.990
391 HA SER 53 HA SER 53 3.988 1.008 5.643
392 1HB SER 53 1HB SER 53 4.811 -1.142 5.380
393 2HB SER 53 2HB SER 53 3.623 -1.158 6.643
394 HG SER 53 HG SER 53 5.258 -1.454 8.126
395 H GLU 54 H GLU 54 5.897 1.567 8.500
396 HA GLU 54 HA GLU 54 3.461 1.938 10.052
397 1HB GLU 54 1HB GLU 54 4.934 2.819 11.853
398 2HB GLU 54 2HB GLU 54 6.307 2.631 10.777
399 1HG GLU 54 1HG GLU 54 6.084 0.268 10.767
400 2HG GLU 54 2HG GLU 54 4.574 0.362 11.680
401 H GLY 55 H GLY 55 5.073 3.767 7.806
402 1HA GLY 55 1HA GLY 55 5.292 6.306 8.397
403 2HA GLY 55 2HA GLY 55 3.548 6.125 8.580
404 H SER 56 H SER 56 2.401 5.234 6.719
405 HA SER 56 HA SER 56 3.588 6.103 4.188
406 1HB SER 56 1HB SER 56 2.626 4.208 3.073
407 2HB SER 56 2HB SER 56 1.887 3.670 4.581
408 HG SER 56 HG SER 56 4.440 3.913 5.072
409 H TYR 57 H TYR 57 0.590 4.764 5.219
410 HA TYR 57 HA TYR 57 -0.851 6.677 3.561
411 1HB TYR 57 1HB TYR 57 -1.629 4.194 5.075
412 2HB TYR 57 2HB TYR 57 -1.338 4.322 3.358
413 HD1 TYR 57 1HD TYR 57 -3.768 4.959 6.012
414 HD2 TYR 57 2HD TYR 57 -2.988 5.154 1.846
415 HE1 TYR 57 1HE TYR 57 -6.179 5.169 5.574
416 HE2 TYR 57 2HE TYR 57 -5.382 5.377 1.400
417 HH TYR 57 HH TYR 57 -7.612 6.041 3.822
418 H GLU 58 H GLU 58 -1.262 8.531 4.516
419 HA GLU 58 HA GLU 58 -2.442 8.470 7.191
420 1HB GLU 58 1HB GLU 58 -0.958 10.735 5.851
421 2HB GLU 58 2HB GLU 58 -0.271 9.668 7.064
422 1HG GLU 58 1HG GLU 58 -1.915 10.465 8.687
423 2HG GLU 58 2HG GLU 58 -2.564 11.558 7.465
424 H GLY 59 H GLY 59 -4.588 8.436 6.779
425 1HA GLY 59 1HA GLY 59 -5.888 10.686 5.621
426 2HA GLY 59 2HA GLY 59 -6.662 9.199 6.154
427 H GLY 60 H GLY 60 -4.748 10.521 3.603
428 1HA GLY 60 1HA GLY 60 -6.215 10.118 1.377
429 2HA GLY 60 2HA GLY 60 -5.575 8.505 1.674
430 H VAL 61 H VAL 61 -3.207 10.154 2.920
431 HA VAL 61 HA VAL 61 -1.858 10.775 0.390
432 HB VAL 61 HB VAL 61 -1.203 11.744 3.194
433 1HG1 VAL 61 1HG1 VAL 61 0.763 11.638 1.781
434 2HG1 VAL 61 2HG1 VAL 61 0.325 13.318 2.085
435 3HG1 VAL 61 3HG1 VAL 61 -0.058 12.572 0.532
436 1HG2 VAL 61 1HG2 VAL 61 -2.523 13.244 0.930
437 2HG2 VAL 61 2HG2 VAL 61 -2.023 13.945 2.466
438 3HG2 VAL 61 3HG2 VAL 61 -3.299 12.729 2.425
439 H ILE 62 H ILE 62 -0.073 9.602 -0.066
440 HA ILE 62 HA ILE 62 0.823 7.636 1.925
441 HB ILE 62 HB ILE 62 1.586 7.682 -1.044
442 1HG1 ILE 62 1HG1 ILE 62 -0.032 5.870 -1.344
443 2HG1 ILE 62 2HG1 ILE 62 -0.818 7.362 -0.847
444 1HG2 ILE 62 1HG2 ILE 62 2.283 5.398 -0.702
445 2HG2 ILE 62 2HG2 ILE 62 1.865 5.513 1.008
446 3HG2 ILE 62 3HG2 ILE 62 3.170 6.501 0.352
447 1HD1 ILE 62 1HD1 ILE 62 -1.012 6.543 1.413
448 2HD1 ILE 62 2HD1 ILE 62 -0.195 5.046 0.944
449 3HD1 ILE 62 3HD1 ILE 62 -1.767 5.458 0.246
450 H THR 63 H THR 63 2.941 7.634 2.634
451 HA THR 63 HA THR 63 4.188 10.200 2.425
452 HB THR 63 HB THR 63 4.997 7.756 4.020
453 HG1 THR 63 1HG THR 63 2.839 8.942 4.296
454 1HG2 THR 63 1HG2 THR 63 5.728 10.686 4.328
455 2HG2 THR 63 2HG2 THR 63 6.811 9.420 3.748
456 3HG2 THR 63 3HG2 THR 63 6.222 9.382 5.409
457 H CYS 64 H CYS 64 5.475 10.618 0.854
458 HA CYS 64 HA CYS 64 7.126 8.705 -0.543
459 1HB CYS 64 1HB CYS 64 6.631 11.667 -0.732
460 2HB CYS 64 2HB CYS 64 6.217 10.433 -1.897
461 H ARG 65 H ARG 65 9.052 8.101 0.102
462 HA ARG 65 HA ARG 65 9.985 8.810 2.597
463 1HB ARG 65 1HB ARG 65 11.470 7.294 0.461
464 2HB ARG 65 2HB ARG 65 10.278 6.609 1.557
465 1HG ARG 65 1HG ARG 65 12.891 7.860 2.389
466 2HG ARG 65 2HG ARG 65 12.568 6.128 2.272
467 1HD ARG 65 1HD ARG 65 10.809 6.340 3.971
468 2HD ARG 65 2HD ARG 65 11.131 8.068 4.095
469 HE ARG 65 HE ARG 65 13.500 6.680 4.532
470 1HH1 ARG 65 1HH1 ARG 65 10.370 7.189 6.121
471 2HH1 ARG 65 2HH1 ARG 65 10.975 7.095 7.709
472 1HH2 ARG 65 1HH2 ARG 65 14.346 6.514 6.724
473 2HH2 ARG 65 2HH2 ARG 65 13.300 6.668 8.055
474 H ALA 66 H ALA 66 11.730 9.549 -0.568
475 HA ALA 66 HA ALA 66 13.314 11.364 1.101
476 1HB ALA 66 1HB ALA 66 15.143 11.046 -0.437
477 2HB ALA 66 2HB ALA 66 14.131 10.024 -1.461
478 3HB ALA 66 3HB ALA 66 14.572 9.485 0.159
479 H HIS 67 H HIS 67 11.682 11.038 -1.952
480 HA HIS 67 HA HIS 67 12.478 13.504 -3.011
481 1HB HIS 67 1HB HIS 67 10.204 13.342 -4.351
482 2HB HIS 67 2HB HIS 67 10.282 11.692 -3.735
483 HD2 HIS 67 2HD HIS 67 12.806 14.068 -5.570
484 HE1 HIS 67 1HE HIS 67 13.177 10.188 -7.153
485 HE2 HIS 67 2HE HIS 67 13.695 12.625 -7.469
486 H LEU 68 H LEU 68 9.586 13.000 -1.069
487 HA LEU 68 HA LEU 68 9.743 15.753 -0.341
488 1HB LEU 68 1HB LEU 68 7.206 14.886 -1.815
489 2HB LEU 68 2HB LEU 68 8.513 15.708 -2.610
490 HG LEU 68 HG LEU 68 6.735 17.262 -2.233
491 1HD1 LEU 68 1HD1 LEU 68 6.979 16.699 0.696
492 2HD1 LEU 68 2HD1 LEU 68 5.618 16.289 -0.348
493 3HD1 LEU 68 3HD1 LEU 68 6.013 17.979 -0.035
494 1HD2 LEU 68 1HD2 LEU 68 7.929 19.023 -1.032
495 2HD2 LEU 68 2HD2 LEU 68 8.975 18.147 -2.144
496 3HD2 LEU 68 3HD2 LEU 68 9.062 17.825 -0.411
497 H TRP 69 H TRP 69 6.695 14.106 -0.352
498 HA TRP 69 HA TRP 69 6.831 12.317 1.640
499 1HB TRP 69 1HB TRP 69 7.514 14.010 3.296
500 2HB TRP 69 2HB TRP 69 5.939 13.375 3.702
501 HD1 TRP 69 HD TRP 69 3.784 15.044 3.126
502 HE1 TRP 69 1HE TRP 69 3.622 17.581 3.365
503 HE3 TRP 69 3HE TRP 69 8.778 16.148 3.197
504 HZ2 TRP 69 2HZ TRP 69 5.387 19.789 3.577
505 HZ3 TRP 69 3HZ TRP 69 9.455 18.498 3.434
506 HH2 TRP 69 HH TRP 69 7.796 20.281 3.616
507 H THR 70 H THR 70 5.060 14.452 -0.353
508 HA THR 70 HA THR 70 2.533 13.310 0.501
509 HB THR 70 HB THR 70 1.629 14.970 -1.144
510 HG1 THR 70 1HG THR 70 3.708 15.142 -2.320
511 1HG2 THR 70 1HG2 THR 70 1.739 15.488 1.254
512 2HG2 THR 70 2HG2 THR 70 2.041 16.929 0.282
513 3HG2 THR 70 3HG2 THR 70 3.385 16.084 1.048
514 H PHE 71 H PHE 71 1.688 11.710 -0.598
515 HA PHE 71 HA PHE 71 2.008 11.590 -3.475
516 1HB PHE 71 1HB PHE 71 2.193 9.289 -1.536
517 2HB PHE 71 2HB PHE 71 3.504 9.909 -2.519
518 HD1 PHE 71 1HD PHE 71 3.792 9.304 -4.765
519 HD2 PHE 71 2HD PHE 71 0.332 8.047 -2.653
520 HE1 PHE 71 1HE PHE 71 3.235 7.763 -6.582
521 HE2 PHE 71 2HE PHE 71 -0.231 6.507 -4.465
522 HZ PHE 71 HZ PHE 71 1.212 6.364 -6.426
523 H ASN 72 H ASN 72 0.029 11.099 -4.484
524 HA ASN 72 HA ASN 72 -2.260 11.319 -2.714
525 1HB ASN 72 1HB ASN 72 -2.063 11.483 -5.725
526 2HB ASN 72 2HB ASN 72 -2.156 12.840 -4.612
527 1HD2 ASN 72 1HD2 ASN 72 -4.123 13.280 -3.564
528 2HD2 ASN 72 2HD2 ASN 72 -5.595 12.660 -4.176
529 H ASP 73 H ASP 73 -3.138 9.542 -1.923
530 HA ASP 73 HA ASP 73 -2.823 6.938 -3.094
531 1HB ASP 73 1HB ASP 73 -4.454 7.923 -0.752
532 2HB ASP 73 2HB ASP 73 -2.905 7.105 -0.692
533 H GLY 74 H GLY 74 -5.343 9.337 -3.053
534 1HA GLY 74 1HA GLY 74 -7.339 9.506 -4.164
535 2HA GLY 74 2HA GLY 74 -7.570 7.814 -3.756
536 H THR 75 H THR 75 -5.174 9.308 -5.828
537 HA THR 75 HA THR 75 -6.395 8.116 -8.190
538 HB THR 75 HB THR 75 -3.930 9.863 -7.959
539 HG1 THR 75 1HG THR 75 -5.647 11.009 -7.167
540 1HG2 THR 75 1HG2 THR 75 -5.777 9.286 -10.287
541 2HG2 THR 75 2HG2 THR 75 -4.149 8.639 -10.093
542 3HG2 THR 75 3HG2 THR 75 -4.387 10.371 -10.327
543 H GLY 76 H GLY 76 -3.677 7.731 -6.003
544 1HA GLY 76 1HA GLY 76 -2.943 5.228 -7.241
545 2HA GLY 76 2HA GLY 76 -2.260 5.923 -5.773
546 H HIS 77 H HIS 77 -1.961 8.481 -7.336
547 HA HIS 77 HA HIS 77 0.549 7.824 -8.692
548 1HB HIS 77 1HB HIS 77 -1.570 9.712 -9.788
549 2HB HIS 77 2HB HIS 77 -1.376 8.064 -10.345
550 HD1 HIS 77 1HD HIS 77 -0.654 8.411 -12.695
551 HD2 HIS 77 2HD HIS 77 1.607 10.654 -10.032
552 HE1 HIS 77 1HE HIS 77 1.204 9.408 -14.048
553 HE2 HIS 77 2HE HIS 77 2.641 10.610 -12.391
554 H GLY 78 H GLY 78 2.145 9.378 -8.163
555 1HA GLY 78 1HA GLY 78 3.007 10.987 -6.793
556 2HA GLY 78 2HA GLY 78 1.411 11.206 -6.090
557 H ILE 79 H ILE 79 1.108 13.339 -6.180
558 HA ILE 79 HA ILE 79 0.967 14.596 -8.778
559 HB ILE 79 HB ILE 79 0.506 15.766 -6.003
560 1HG1 ILE 79 1HG1 ILE 79 -1.098 13.990 -6.593
561 2HG1 ILE 79 2HG1 ILE 79 -1.479 14.822 -8.092
562 1HG2 ILE 79 1HG2 ILE 79 1.104 17.502 -7.622
563 2HG2 ILE 79 2HG2 ILE 79 -0.600 17.630 -7.177
564 3HG2 ILE 79 3HG2 ILE 79 -0.146 16.916 -8.723
565 1HD1 ILE 79 1HD1 ILE 79 -3.210 15.188 -6.436
566 2HD1 ILE 79 2HD1 ILE 79 -2.391 16.700 -6.827
567 3HD1 ILE 79 3HD1 ILE 79 -2.022 15.862 -5.320
568 H ASN 80 H ASN 80 2.821 14.856 -5.799
569 HA ASN 80 HA ASN 80 5.163 15.509 -7.287
570 1HB ASN 80 1HB ASN 80 4.242 17.304 -5.075
571 2HB ASN 80 2HB ASN 80 4.230 17.797 -6.775
572 1HD2 ASN 80 1HD2 ASN 80 5.582 19.047 -4.584
573 2HD2 ASN 80 2HD2 ASN 80 7.277 19.033 -4.909
574 HA PRO 81 HA PRO 81 6.979 14.786 -7.309
575 1HB PRO 81 1HB PRO 81 8.773 13.543 -6.583
576 2HB PRO 81 2HB PRO 81 8.028 12.307 -7.607
577 1HG PRO 81 1HG PRO 81 8.471 11.822 -5.035
578 2HG PRO 81 2HG PRO 81 6.965 11.286 -5.804
579 1HD PRO 81 1HD PRO 81 7.434 13.572 -3.947
580 2HD PRO 81 2HD PRO 81 6.024 12.504 -4.092
581 H ASP 82 H ASP 82 6.494 14.111 -9.389
582 HA ASP 82 HA ASP 82 3.839 12.988 -9.761
583 1HB ASP 82 1HB ASP 82 5.799 14.327 -11.629
584 2HB ASP 82 2HB ASP 82 4.400 15.065 -10.864
585 H ASP 83 H ASP 83 7.110 12.152 -10.156
586 HA ASP 83 HA ASP 83 6.983 10.374 -12.307
587 1HB ASP 83 1HB ASP 83 8.914 10.457 -10.056
588 2HB ASP 83 2HB ASP 83 9.065 11.327 -11.583
589 H CYS 84 H CYS 84 6.437 9.701 -8.860
590 HA CYS 84 HA CYS 84 6.332 6.927 -9.618
591 1HB CYS 84 1HB CYS 84 6.239 6.372 -7.256
592 2HB CYS 84 2HB CYS 84 6.238 8.072 -6.821
593 HG CYS 84 HG CYS 84 8.654 8.074 -6.455
594 H CYS 85 H CYS 85 4.788 5.693 -9.130
595 HA CYS 85 HA CYS 85 2.277 6.537 -8.161
596 1HB CYS 85 1HB CYS 85 1.689 7.076 -10.281
597 2HB CYS 85 2HB CYS 85 1.130 5.423 -10.097
598 HG CYS 85 HG CYS 85 3.862 6.371 -11.951
599 H LEU 86 H LEU 86 1.138 5.014 -7.462
600 HA LEU 86 HA LEU 86 2.472 2.426 -7.121
601 1HB LEU 86 1HB LEU 86 1.066 2.380 -4.940
602 2HB LEU 86 2HB LEU 86 0.894 4.095 -5.210
603 HG LEU 86 HG LEU 86 3.479 2.611 -4.685
604 1HD1 LEU 86 1HD1 LEU 86 4.608 4.751 -4.589
605 2HD1 LEU 86 2HD1 LEU 86 3.130 5.554 -5.109
606 3HD1 LEU 86 3HD1 LEU 86 3.954 4.429 -6.194
607 1HD2 LEU 86 1HD2 LEU 86 2.155 2.872 -2.695
608 2HD2 LEU 86 2HD2 LEU 86 1.975 4.599 -3.007
609 3HD2 LEU 86 3HD2 LEU 86 3.560 3.931 -2.623
610 H ALA 87 H ALA 87 1.540 1.198 -8.467
611 HA ALA 87 HA ALA 87 -1.242 1.318 -9.187
612 1HB ALA 87 1HB ALA 87 -0.766 -0.646 -10.571
613 2HB ALA 87 2HB ALA 87 0.820 -0.803 -9.813
614 3HB ALA 87 3HB ALA 87 0.459 0.600 -10.813
615 H GLU 88 H GLU 88 -2.860 0.366 -8.250
616 HA GLU 88 HA GLU 88 -2.425 -1.193 -5.900
617 1HB GLU 88 1HB GLU 88 -4.741 -1.053 -5.513
618 2HB GLU 88 2HB GLU 88 -5.112 -0.789 -7.202
619 1HG GLU 88 1HG GLU 88 -3.553 1.270 -5.721
620 2HG GLU 88 2HG GLU 88 -5.296 1.171 -5.494
621 H TYR 89 H TYR 89 -3.497 -3.221 -5.565
622 HA TYR 89 HA TYR 89 -3.596 -4.902 -7.969
623 1HB TYR 89 1HB TYR 89 -2.877 -6.752 -6.503
624 2HB TYR 89 2HB TYR 89 -2.846 -5.666 -5.124
625 HD1 TYR 89 1HD TYR 89 -1.103 -6.661 -8.190
626 HD2 TYR 89 2HD TYR 89 -1.044 -4.083 -4.811
627 HE1 TYR 89 1HE TYR 89 1.258 -6.128 -8.638
628 HE2 TYR 89 2HE TYR 89 1.309 -3.543 -5.252
629 HH TYR 89 HH TYR 89 2.848 -4.410 -8.168
630 HA PRO 90 HA PRO 90 -7.828 -5.670 -6.686
631 1HB PRO 90 1HB PRO 90 -8.610 -7.293 -8.123
632 2HB PRO 90 2HB PRO 90 -7.441 -8.478 -7.539
633 1HG PRO 90 1HG PRO 90 -7.133 -6.379 -9.628
634 2HG PRO 90 2HG PRO 90 -6.522 -8.043 -9.614
635 1HD PRO 90 1HD PRO 90 -4.945 -5.940 -9.082
636 2HD PRO 90 2HD PRO 90 -4.725 -7.493 -8.247
637 H VAL 91 H VAL 91 -8.337 -5.980 -4.639
638 HA VAL 91 HA VAL 91 -7.022 -8.146 -3.200
639 HB VAL 91 HB VAL 91 -5.980 -6.079 -2.514
640 1HG1 VAL 91 1HG1 VAL 91 -7.226 -4.258 -1.439
641 2HG1 VAL 91 2HG1 VAL 91 -8.732 -5.099 -1.798
642 3HG1 VAL 91 3HG1 VAL 91 -7.725 -4.505 -3.115
643 1HG2 VAL 91 1HG2 VAL 91 -6.387 -6.144 -0.100
644 2HG2 VAL 91 2HG2 VAL 91 -6.335 -7.777 -0.777
645 3HG2 VAL 91 3HG2 VAL 91 -7.880 -7.034 -0.380
646 H GLU 92 H GLU 92 -8.202 -9.393 -2.040
647 HA GLU 92 HA GLU 92 -11.018 -8.691 -1.570
648 1HB GLU 92 1HB GLU 92 -11.478 -11.118 -1.640
649 2HB GLU 92 2HB GLU 92 -9.833 -11.366 -2.121
650 1HG GLU 92 1HG GLU 92 -10.182 -10.279 -4.212
651 2HG GLU 92 2HG GLU 92 -11.811 -9.791 -3.727
652 H VAL 93 H VAL 93 -11.692 -8.902 0.443
653 HA VAL 93 HA VAL 93 -9.910 -10.193 2.357
654 HB VAL 93 HB VAL 93 -10.078 -7.802 2.778
655 1HG1 VAL 93 1HG1 VAL 93 -12.174 -6.707 3.434
656 2HG1 VAL 93 2HG1 VAL 93 -13.049 -8.180 3.020
657 3HG1 VAL 93 3HG1 VAL 93 -12.194 -7.280 1.765
658 1HG2 VAL 93 1HG2 VAL 93 -9.844 -9.221 4.735
659 2HG2 VAL 93 2HG2 VAL 93 -11.593 -9.398 4.840
660 3HG2 VAL 93 3HG2 VAL 93 -10.847 -7.823 5.125
661 H LYS 94 H LYS 94 -10.623 -12.011 3.229
662 HA LYS 94 HA LYS 94 -13.533 -12.436 3.308
663 1HB LYS 94 1HB LYS 94 -13.280 -14.773 2.907
664 2HB LYS 94 2HB LYS 94 -11.548 -14.706 3.121
665 1HG LYS 94 1HG LYS 94 -12.841 -13.329 0.820
666 2HG LYS 94 2HG LYS 94 -12.457 -15.048 0.762
667 1HD LYS 94 1HD LYS 94 -10.098 -14.516 1.273
668 2HD LYS 94 2HD LYS 94 -10.496 -12.807 1.314
669 1HE LYS 94 1HE LYS 94 -9.496 -13.487 -0.803
670 2HE LYS 94 2HE LYS 94 -11.106 -12.818 -0.964
671 1HZ LYS 94 1HZ LYS 94 -10.444 -15.741 -0.999
672 2HZ LYS 94 2HZ LYS 94 -10.790 -14.834 -2.361
673 3HZ LYS 94 3HZ LYS 94 -11.976 -15.087 -1.204
674 H GLY 95 H GLY 95 -13.655 -11.701 5.381
675 1HA GLY 95 1HA GLY 95 -13.304 -13.591 7.416
676 2HA GLY 95 2HA GLY 95 -13.633 -11.881 7.658
677 H ASP 96 H ASP 96 -11.377 -14.266 7.704
678 HA ASP 96 HA ASP 96 -9.543 -12.551 9.198
679 1HB ASP 96 1HB ASP 96 -8.349 -14.655 9.717
680 2HB ASP 96 2HB ASP 96 -9.510 -15.534 8.749
681 H ASP 97 H ASP 97 -9.816 -13.749 6.031
682 HA ASP 97 HA ASP 97 -6.895 -13.626 5.710
683 1HB ASP 97 1HB ASP 97 -7.166 -14.998 3.733
684 2HB ASP 97 2HB ASP 97 -8.859 -15.219 4.059
685 H ILE 98 H ILE 98 -5.980 -12.617 4.025
686 HA ILE 98 HA ILE 98 -7.744 -11.093 2.303
687 HB ILE 98 HB ILE 98 -5.298 -10.118 3.773
688 1HG1 ILE 98 1HG1 ILE 98 -7.556 -9.994 4.839
689 2HG1 ILE 98 2HG1 ILE 98 -8.066 -8.993 3.494
690 1HG2 ILE 98 1HG2 ILE 98 -5.059 -9.407 1.417
691 2HG2 ILE 98 2HG2 ILE 98 -5.433 -8.027 2.450
692 3HG2 ILE 98 3HG2 ILE 98 -6.694 -8.745 1.455
693 1HD1 ILE 98 1HD1 ILE 98 -7.591 -7.656 5.402
694 2HD1 ILE 98 2HD1 ILE 98 -6.472 -7.298 4.071
695 3HD1 ILE 98 3HD1 ILE 98 -5.944 -8.287 5.448
696 H TYR 99 H TYR 99 -7.369 -11.220 0.287
697 HA TYR 99 HA TYR 99 -4.922 -12.530 -0.668
698 1HB TYR 99 1HB TYR 99 -6.499 -13.199 -2.624
699 2HB TYR 99 2HB TYR 99 -7.740 -12.724 -1.531
700 HD1 TYR 99 1HD TYR 99 -7.818 -13.955 0.801
701 HD2 TYR 99 2HD TYR 99 -5.625 -15.391 -2.544
702 HE1 TYR 99 1HE TYR 99 -7.778 -16.204 1.795
703 HE2 TYR 99 2HE TYR 99 -5.576 -17.639 -1.559
704 HH TYR 99 HH TYR 99 -5.776 -18.702 0.582
705 H VAL 100 H VAL 100 -3.946 -11.602 -2.259
706 HA VAL 100 HA VAL 100 -5.136 -9.272 -3.585
707 HB VAL 100 HB VAL 100 -3.032 -8.047 -3.500
708 1HG1 VAL 100 1HG1 VAL 100 -2.870 -7.536 -1.107
709 2HG1 VAL 100 2HG1 VAL 100 -3.896 -8.940 -0.775
710 3HG1 VAL 100 3HG1 VAL 100 -4.518 -7.588 -1.721
711 1HG2 VAL 100 1HG2 VAL 100 -1.107 -8.794 -2.133
712 2HG2 VAL 100 2HG2 VAL 100 -1.430 -9.882 -3.483
713 3HG2 VAL 100 3HG2 VAL 100 -1.936 -10.328 -1.854
714 H SER 101 H SER 101 -4.718 -9.232 -5.743
715 HA SER 101 HA SER 101 -3.289 -11.604 -6.674
716 1HB SER 101 1HB SER 101 -4.940 -9.699 -8.347
717 2HB SER 101 2HB SER 101 -5.643 -11.054 -7.470
718 HG SER 101 HG SER 101 -4.271 -11.007 -9.800
719 H THR 102 H THR 102 -1.172 -11.345 -7.122
720 HA THR 102 HA THR 102 -0.214 -8.701 -7.924
721 HB THR 102 HB THR 102 1.349 -11.181 -7.153
722 HG1 THR 102 1HG THR 102 -0.113 -9.667 -5.638
723 1HG2 THR 102 1HG2 THR 102 2.174 -8.274 -7.367
724 2HG2 THR 102 2HG2 THR 102 2.622 -9.557 -8.490
725 3HG2 THR 102 3HG2 THR 102 3.209 -9.596 -6.827
726 H LYS 103 H LYS 103 -0.294 -12.091 -8.778
727 HA LYS 103 HA LYS 103 1.283 -12.165 -11.011
728 1HB LYS 103 1HB LYS 103 -1.251 -13.719 -10.492
729 2HB LYS 103 2HB LYS 103 0.352 -14.145 -9.924
730 1HG LYS 103 1HG LYS 103 -0.477 -13.966 -12.808
731 2HG LYS 103 2HG LYS 103 -0.325 -15.459 -11.879
732 1HD LYS 103 1HD LYS 103 2.049 -14.972 -11.512
733 2HD LYS 103 2HD LYS 103 1.887 -13.485 -12.444
734 1HE LYS 103 1HE LYS 103 1.310 -14.743 -14.420
735 2HE LYS 103 2HE LYS 103 1.406 -16.248 -13.510
736 1HZ LYS 103 1HZ LYS 103 3.651 -14.364 -13.934
737 2HZ LYS 103 2HZ LYS 103 3.436 -15.818 -14.760
738 3HZ LYS 103 3HZ LYS 103 3.720 -15.817 -13.094
739 H GLY 104 H GLY 104 1.186 -10.849 -12.691
740 1HA GLY 104 1HA GLY 104 -1.433 -10.446 -13.960
741 2HA GLY 104 2HA GLY 104 0.071 -10.641 -14.853
742 H ILE 105 H ILE 105 0.054 -8.759 -11.949
743 HA ILE 105 HA ILE 105 -0.100 -6.312 -13.542
744 HB ILE 105 HB ILE 105 -0.414 -6.698 -10.549
745 1HG1 ILE 105 1HG1 ILE 105 -2.289 -7.543 -11.885
746 2HG1 ILE 105 2HG1 ILE 105 -2.417 -5.988 -12.694
747 1HG2 ILE 105 1HG2 ILE 105 -0.706 -4.176 -12.208
748 2HG2 ILE 105 2HG2 ILE 105 0.595 -4.508 -11.069
749 3HG2 ILE 105 3HG2 ILE 105 -1.058 -4.323 -10.486
750 1HD1 ILE 105 1HD1 ILE 105 -2.958 -4.928 -10.582
751 2HD1 ILE 105 2HD1 ILE 105 -2.859 -6.497 -9.781
752 3HD1 ILE 105 3HD1 ILE 105 -4.098 -6.204 -11.005
753 H LEU 106 H LEU 106 1.603 -4.989 -13.724
754 HA LEU 106 HA LEU 106 4.087 -5.900 -12.656
755 1HB LEU 106 1HB LEU 106 4.938 -4.164 -14.212
756 2HB LEU 106 2HB LEU 106 3.304 -3.859 -14.720
757 HG LEU 106 HG LEU 106 4.698 -6.511 -15.145
758 1HD1 LEU 106 1HD1 LEU 106 2.287 -6.731 -15.099
759 2HD1 LEU 106 2HD1 LEU 106 2.917 -6.985 -16.726
760 3HD1 LEU 106 3HD1 LEU 106 2.132 -5.461 -16.314
761 1HD2 LEU 106 1HD2 LEU 106 4.927 -5.832 -17.482
762 2HD2 LEU 106 2HD2 LEU 106 5.825 -4.764 -16.402
763 3HD2 LEU 106 3HD2 LEU 106 4.286 -4.239 -17.080
764 HA PRO 107 HA PRO 107 3.789 -2.484 -9.626
765 1HB PRO 107 1HB PRO 107 5.334 -3.131 -8.045
766 2HB PRO 107 2HB PRO 107 6.636 -3.147 -9.234
767 1HG PRO 107 1HG PRO 107 4.710 -5.314 -8.506
768 2HG PRO 107 2HG PRO 107 6.435 -5.426 -8.900
769 1HD PRO 107 1HD PRO 107 4.528 -6.098 -10.658
770 2HD PRO 107 2HD PRO 107 6.052 -5.344 -11.173
771 H ASN 108 H ASN 108 4.712 -0.262 -9.756
772 HA ASN 108 HA ASN 108 6.089 0.184 -12.263
773 1HB ASN 108 1HB ASN 108 5.621 2.492 -11.776
774 2HB ASN 108 2HB ASN 108 5.102 2.060 -10.178
775 1HD2 ASN 108 1HD2 ASN 108 3.055 2.948 -10.465
776 2HD2 ASN 108 2HD2 ASN 108 1.829 2.320 -11.506
777 H LYS 109 H LYS 109 8.112 0.230 -12.123
778 HA LYS 109 HA LYS 109 10.167 -0.295 -11.244
779 1HB LYS 109 1HB LYS 109 9.684 2.254 -9.653
780 2HB LYS 109 2HB LYS 109 10.355 2.175 -11.274
781 1HG LYS 109 1HG LYS 109 12.282 0.919 -10.420
782 2HG LYS 109 2HG LYS 109 11.629 1.015 -8.788
783 1HD LYS 109 1HD LYS 109 11.796 3.470 -8.865
784 2HD LYS 109 2HD LYS 109 12.434 3.365 -10.495
785 1HE LYS 109 1HE LYS 109 14.232 3.688 -8.894
786 2HE LYS 109 2HE LYS 109 14.380 2.113 -9.664
787 1HZ LYS 109 1HZ LYS 109 13.416 1.093 -7.653
788 2HZ LYS 109 2HZ LYS 109 13.314 2.614 -6.918
789 3HZ LYS 109 3HZ LYS 109 14.790 1.973 -7.285
790 H ALA 110 H ALA 110 9.102 1.042 -8.352
791 HA ALA 110 HA ALA 110 9.052 0.307 -6.155
792 1HB ALA 110 1HB ALA 110 6.898 -0.435 -7.025
793 2HB ALA 110 2HB ALA 110 7.481 -1.568 -5.806
794 3HB ALA 110 3HB ALA 110 7.604 -1.975 -7.515
795 H HIS 111 H HIS 111 8.989 -2.386 -5.151
796 HA HIS 111 HA HIS 111 10.178 -4.273 -4.637
797 1HB HIS 111 1HB HIS 111 11.683 -3.777 -7.230
798 2HB HIS 111 2HB HIS 111 10.135 -4.586 -7.156
799 HD1 HIS 111 1HD HIS 111 10.178 -7.063 -7.055
800 HD2 HIS 111 2HD HIS 111 13.782 -5.375 -5.819
801 HE1 HIS 111 1HE HIS 111 11.735 -8.965 -6.748
802 HE2 HIS 111 2HE HIS 111 13.950 -7.913 -6.344
803 H SER 112 H SER 112 11.518 -4.217 -2.955
804 HA SER 112 HA SER 112 13.159 -3.813 -1.615
805 1HB SER 112 1HB SER 112 15.353 -2.884 -2.375
806 2HB SER 112 2HB SER 112 14.651 -2.616 -3.970
807 HG SER 112 HG SER 112 15.139 -4.560 -4.372
Start of MODEL 4
1 1H MET 1 1HT MET 1 1.170 -13.865 -8.279
2 2H MET 1 2HT MET 1 1.461 -12.551 -9.339
3 3H MET 1 3HT MET 1 2.660 -13.686 -9.088
4 HA MET 1 HA MET 1 1.628 -13.934 -11.212
5 1HB MET 1 1HB MET 1 1.021 -16.180 -9.284
6 2HB MET 1 2HB MET 1 2.547 -15.915 -10.123
7 1HG MET 1 1HG MET 1 1.490 -16.326 -12.252
8 2HG MET 1 2HG MET 1 -0.083 -16.452 -11.485
9 1HE MET 1 1HE MET 1 3.266 -19.558 -10.843
10 2HE MET 1 2HE MET 1 3.283 -17.972 -10.079
11 3HE MET 1 3HE MET 1 3.461 -18.111 -11.832
12 H SER 2 H SER 2 -0.694 -14.595 -8.550
13 HA SER 2 HA SER 2 -2.901 -13.830 -10.251
14 1HB SER 2 1HB SER 2 -2.516 -16.536 -8.922
15 2HB SER 2 2HB SER 2 -2.468 -16.256 -10.656
16 HG SER 2 HG SER 2 -4.471 -17.067 -9.570
17 H PHE 3 H PHE 3 -4.550 -15.160 -8.222
18 HA PHE 3 HA PHE 3 -4.400 -13.251 -6.065
19 1HB PHE 3 1HB PHE 3 -6.391 -14.599 -5.229
20 2HB PHE 3 2HB PHE 3 -6.235 -15.559 -6.684
21 HD1 PHE 3 1HD PHE 3 -6.663 -14.563 -8.909
22 HD2 PHE 3 2HD PHE 3 -7.377 -12.422 -5.301
23 HE1 PHE 3 1HE PHE 3 -8.065 -12.952 -10.139
24 HE2 PHE 3 2HE PHE 3 -8.769 -10.818 -6.517
25 HZ PHE 3 HZ PHE 3 -9.119 -11.064 -8.931
26 H GLU 4 H GLU 4 -2.660 -13.568 -4.908
27 HA GLU 4 HA GLU 4 -2.204 -16.217 -3.729
28 1HB GLU 4 1HB GLU 4 -0.007 -15.108 -2.942
29 2HB GLU 4 2HB GLU 4 -0.372 -13.828 -4.067
30 1HG GLU 4 1HG GLU 4 0.105 -16.694 -4.852
31 2HG GLU 4 2HG GLU 4 1.299 -15.414 -4.922
32 H LYS 5 H LYS 5 -2.193 -16.396 -1.513
33 HA LYS 5 HA LYS 5 -3.544 -14.347 0.029
34 1HB LYS 5 1HB LYS 5 -2.135 -16.857 0.917
35 2HB LYS 5 2HB LYS 5 -3.848 -16.755 0.511
36 1HG LYS 5 1HG LYS 5 -4.243 -15.249 2.355
37 2HG LYS 5 2HG LYS 5 -2.521 -15.175 2.716
38 1HD LYS 5 1HD LYS 5 -4.230 -17.644 2.902
39 2HD LYS 5 2HD LYS 5 -3.711 -16.644 4.261
40 1HE LYS 5 1HE LYS 5 -1.361 -17.116 3.673
41 2HE LYS 5 2HE LYS 5 -1.924 -18.173 2.385
42 1HZ LYS 5 1HZ LYS 5 -3.011 -19.559 4.055
43 2HZ LYS 5 2HZ LYS 5 -2.399 -18.580 5.285
44 3HZ LYS 5 3HZ LYS 5 -1.355 -19.448 4.307
45 H ILE 6 H ILE 6 -2.677 -12.750 0.895
46 HA ILE 6 HA ILE 6 0.186 -12.596 0.967
47 HB ILE 6 HB ILE 6 -1.020 -10.634 0.238
48 1HG1 ILE 6 1HG1 ILE 6 0.342 -10.199 2.886
49 2HG1 ILE 6 2HG1 ILE 6 -0.071 -8.899 1.773
50 1HG2 ILE 6 1HG2 ILE 6 -2.435 -9.256 1.684
51 2HG2 ILE 6 2HG2 ILE 6 -2.350 -10.515 2.916
52 3HG2 ILE 6 3HG2 ILE 6 -3.110 -10.859 1.366
53 1HD1 ILE 6 1HD1 ILE 6 1.785 -11.199 1.188
54 2HD1 ILE 6 2HD1 ILE 6 2.255 -9.536 1.534
55 3HD1 ILE 6 3HD1 ILE 6 1.350 -9.908 0.071
56 H CYS 7 H CYS 7 -2.469 -12.387 3.230
57 HA CYS 7 HA CYS 7 -1.318 -13.851 5.320
58 1HB CYS 7 1HB CYS 7 -1.237 -11.933 7.015
59 2HB CYS 7 2HB CYS 7 -1.277 -10.825 5.657
60 HG CYS 7 HG CYS 7 1.078 -12.582 4.775
61 H SER 8 H SER 8 -2.740 -12.994 7.434
62 HA SER 8 HA SER 8 -5.417 -13.146 6.365
63 1HB SER 8 1HB SER 8 -5.171 -15.050 7.803
64 2HB SER 8 2HB SER 8 -5.971 -13.829 8.739
65 HG SER 8 HG SER 8 -3.380 -13.405 9.177
66 H LEU 9 H LEU 9 -7.116 -11.932 7.223
67 HA LEU 9 HA LEU 9 -6.674 -9.209 7.787
68 1HB LEU 9 1HB LEU 9 -9.045 -10.929 8.442
69 2HB LEU 9 2HB LEU 9 -8.754 -10.241 6.878
70 HG LEU 9 HG LEU 9 -9.333 -8.688 9.419
71 1HD1 LEU 9 1HD1 LEU 9 -9.091 -7.706 6.583
72 2HD1 LEU 9 2HD1 LEU 9 -7.929 -7.408 7.879
73 3HD1 LEU 9 3HD1 LEU 9 -9.552 -6.729 7.975
74 1HD2 LEU 9 1HD2 LEU 9 -11.084 -9.236 7.028
75 2HD2 LEU 9 2HD2 LEU 9 -11.484 -8.168 8.368
76 3HD2 LEU 9 3HD2 LEU 9 -11.289 -9.895 8.653
77 H ASP 10 H ASP 10 -6.654 -11.973 9.676
78 HA ASP 10 HA ASP 10 -6.982 -10.962 12.300
79 1HB ASP 10 1HB ASP 10 -5.387 -13.309 11.269
80 2HB ASP 10 2HB ASP 10 -7.020 -13.342 11.919
81 H ASP 11 H ASP 11 -4.334 -10.756 10.063
82 HA ASP 11 HA ASP 11 -2.454 -9.845 12.114
83 1HB ASP 11 1HB ASP 11 -0.804 -9.774 10.316
84 2HB ASP 11 2HB ASP 11 -2.049 -10.077 9.115
85 H ILE 12 H ILE 12 -4.132 -8.706 9.254
86 HA ILE 12 HA ILE 12 -3.218 -5.985 9.781
87 HB ILE 12 HB ILE 12 -2.667 -6.497 7.686
88 1HG1 ILE 12 1HG1 ILE 12 -5.281 -5.024 7.355
89 2HG1 ILE 12 2HG1 ILE 12 -4.087 -5.175 6.085
90 1HG2 ILE 12 1HG2 ILE 12 -3.842 -8.561 7.320
91 2HG2 ILE 12 2HG2 ILE 12 -4.110 -7.511 5.931
92 3HG2 ILE 12 3HG2 ILE 12 -5.374 -7.699 7.151
93 1HD1 ILE 12 1HD1 ILE 12 -3.895 -3.029 7.221
94 2HD1 ILE 12 2HD1 ILE 12 -2.440 -4.005 7.435
95 3HD1 ILE 12 3HD1 ILE 12 -3.607 -3.860 8.749
96 H TRP 13 H TRP 13 -4.412 -4.640 10.704
97 HA TRP 13 HA TRP 13 -7.254 -5.205 10.960
98 1HB TRP 13 1HB TRP 13 -7.093 -3.828 13.061
99 2HB TRP 13 2HB TRP 13 -5.349 -3.834 12.818
100 HD1 TRP 13 HD TRP 13 -4.256 -6.434 12.608
101 HE1 TRP 13 1HE TRP 13 -4.835 -8.491 14.041
102 HE3 TRP 13 3HE TRP 13 -8.802 -4.921 14.381
103 HZ2 TRP 13 2HZ TRP 13 -6.940 -9.352 15.709
104 HZ3 TRP 13 3HZ TRP 13 -10.039 -6.420 15.891
105 HH2 TRP 13 HH TRP 13 -9.131 -8.584 16.539
106 H VAL 14 H VAL 14 -8.581 -3.292 11.525
107 HA VAL 14 HA VAL 14 -8.550 -1.525 9.295
108 HB VAL 14 HB VAL 14 -10.220 -1.314 11.809
109 1HG1 VAL 14 1HG1 VAL 14 -11.837 -0.185 10.367
110 2HG1 VAL 14 2HG1 VAL 14 -10.741 -0.362 9.001
111 3HG1 VAL 14 3HG1 VAL 14 -10.282 0.651 10.366
112 1HG2 VAL 14 1HG2 VAL 14 -10.429 -3.559 10.894
113 2HG2 VAL 14 2HG2 VAL 14 -10.805 -2.885 9.305
114 3HG2 VAL 14 3HG2 VAL 14 -11.910 -2.630 10.662
115 H GLY 15 H GLY 15 -7.493 0.348 9.160
116 1HA GLY 15 1HA GLY 15 -6.950 1.878 11.593
117 2HA GLY 15 2HA GLY 15 -6.864 2.479 9.937
118 H GLU 16 H GLU 16 -5.562 -0.543 10.085
119 HA GLU 16 HA GLU 16 -2.860 0.370 10.750
120 1HB GLU 16 1HB GLU 16 -2.344 -2.074 10.836
121 2HB GLU 16 2HB GLU 16 -4.038 -2.394 10.515
122 1HG GLU 16 1HG GLU 16 -3.553 -2.658 12.852
123 2HG GLU 16 2HG GLU 16 -4.663 -1.312 12.587
124 H MET 17 H MET 17 -1.139 -0.401 9.400
125 HA MET 17 HA MET 17 -1.788 -1.582 6.892
126 1HB MET 17 1HB MET 17 -1.955 0.788 6.351
127 2HB MET 17 2HB MET 17 -0.596 0.057 5.531
128 1HG MET 17 1HG MET 17 0.918 1.029 7.196
129 2HG MET 17 2HG MET 17 -0.456 1.816 7.963
130 1HE MET 17 1HE MET 17 1.453 4.757 6.221
131 2HE MET 17 2HE MET 17 2.160 3.318 6.961
132 3HE MET 17 3HE MET 17 0.801 4.132 7.735
133 H GLU 18 H GLU 18 -0.135 -2.819 6.167
134 HA GLU 18 HA GLU 18 2.338 -2.643 7.619
135 1HB GLU 18 1HB GLU 18 0.525 -5.049 7.866
136 2HB GLU 18 2HB GLU 18 1.019 -3.899 9.115
137 1HG GLU 18 1HG GLU 18 2.855 -5.825 7.746
138 2HG GLU 18 2HG GLU 18 2.173 -6.025 9.356
139 H THR 19 H THR 19 4.016 -3.946 6.752
140 HA THR 19 HA THR 19 3.700 -4.450 3.915
141 HB THR 19 HB THR 19 6.114 -4.102 5.660
142 HG1 THR 19 1HG THR 19 5.093 -2.433 3.592
143 1HG2 THR 19 1HG2 THR 19 5.934 -4.402 2.664
144 2HG2 THR 19 2HG2 THR 19 6.623 -5.574 3.786
145 3HG2 THR 19 3HG2 THR 19 7.401 -4.009 3.559
146 H PHE 20 H PHE 20 3.750 -6.371 3.148
147 HA PHE 20 HA PHE 20 5.019 -8.580 4.542
148 1HB PHE 20 1HB PHE 20 3.077 -10.047 3.899
149 2HB PHE 20 2HB PHE 20 2.226 -8.604 3.384
150 HD1 PHE 20 1HD PHE 20 3.860 -9.967 6.439
151 HD2 PHE 20 2HD PHE 20 0.731 -7.605 4.783
152 HE1 PHE 20 1HE PHE 20 2.872 -9.704 8.681
153 HE2 PHE 20 2HE PHE 20 -0.256 -7.337 7.017
154 HZ PHE 20 HZ PHE 20 0.814 -8.387 8.969
155 H GLU 21 H GLU 21 5.515 -10.316 2.942
156 HA GLU 21 HA GLU 21 5.690 -9.138 0.273
157 1HB GLU 21 1HB GLU 21 7.452 -11.310 1.440
158 2HB GLU 21 2HB GLU 21 7.877 -9.604 1.403
159 1HG GLU 21 1HG GLU 21 7.789 -9.649 -1.053
160 2HG GLU 21 2HG GLU 21 7.425 -11.369 -0.994
161 H THR 22 H THR 22 5.130 -10.363 -1.515
162 HA THR 22 HA THR 22 3.031 -12.240 -0.927
163 HB THR 22 HB THR 22 2.524 -12.147 -3.284
164 HG1 THR 22 1HG THR 22 3.827 -11.033 -4.710
165 1HG2 THR 22 1HG2 THR 22 2.161 -9.753 -3.606
166 2HG2 THR 22 2HG2 THR 22 3.343 -9.404 -2.364
167 3HG2 THR 22 3HG2 THR 22 1.811 -10.194 -1.926
168 H SER 23 H SER 23 2.892 -14.289 -2.291
169 HA SER 23 HA SER 23 5.138 -15.926 -1.939
170 1HB SER 23 1HB SER 23 3.760 -17.583 -3.001
171 2HB SER 23 2HB SER 23 2.769 -16.314 -3.720
172 HG SER 23 HG SER 23 2.952 -17.082 -0.996
173 H ASP 24 H ASP 24 4.181 -13.728 -4.372
174 HA ASP 24 HA ASP 24 5.615 -14.942 -6.575
175 1HB ASP 24 1HB ASP 24 4.368 -12.206 -6.325
176 2HB ASP 24 2HB ASP 24 3.490 -13.649 -6.819
177 H GLY 25 H GLY 25 6.345 -12.951 -3.924
178 1HA GLY 25 1HA GLY 25 9.001 -12.415 -5.051
179 2HA GLY 25 2HA GLY 25 8.586 -12.420 -3.345
180 H THR 26 H THR 26 6.130 -10.728 -4.314
181 HA THR 26 HA THR 26 7.521 -8.195 -4.734
182 HB THR 26 HB THR 26 4.557 -8.815 -4.764
183 HG1 THR 26 1HG THR 26 6.588 -9.110 -6.624
184 1HG2 THR 26 1HG2 THR 26 4.398 -6.680 -5.995
185 2HG2 THR 26 2HG2 THR 26 6.141 -6.451 -5.799
186 3HG2 THR 26 3HG2 THR 26 5.088 -6.442 -4.387
187 H GLU 27 H GLU 27 7.848 -6.822 -2.997
188 HA GLU 27 HA GLU 27 6.490 -7.553 -0.548
189 1HB GLU 27 1HB GLU 27 8.551 -5.385 -1.031
190 2HB GLU 27 2HB GLU 27 8.929 -7.045 -0.585
191 1HG GLU 27 1HG GLU 27 7.659 -6.748 1.490
192 2HG GLU 27 2HG GLU 27 7.445 -5.051 1.080
193 H VAL 28 H VAL 28 4.768 -6.546 0.189
194 HA VAL 28 HA VAL 28 3.851 -4.153 -1.258
195 HB VAL 28 HB VAL 28 2.200 -6.580 -0.510
196 1HG1 VAL 28 1HG1 VAL 28 0.395 -5.565 -1.785
197 2HG1 VAL 28 2HG1 VAL 28 1.369 -4.107 -1.997
198 3HG1 VAL 28 3HG1 VAL 28 0.844 -4.596 -0.384
199 1HG2 VAL 28 1HG2 VAL 28 3.636 -7.071 -2.398
200 2HG2 VAL 28 2HG2 VAL 28 3.065 -5.627 -3.232
201 3HG2 VAL 28 3HG2 VAL 28 1.955 -6.964 -2.921
202 H LEU 29 H LEU 29 2.626 -2.750 -0.077
203 HA LEU 29 HA LEU 29 2.552 -3.113 2.861
204 1HB LEU 29 1HB LEU 29 2.360 -0.548 1.248
205 2HB LEU 29 2HB LEU 29 3.895 -1.184 1.782
206 HG LEU 29 HG LEU 29 3.174 -0.900 4.147
207 1HD1 LEU 29 1HD1 LEU 29 4.545 0.763 3.055
208 2HD1 LEU 29 2HD1 LEU 29 3.414 1.531 4.172
209 3HD1 LEU 29 3HD1 LEU 29 3.108 1.574 2.437
210 1HD2 LEU 29 1HD2 LEU 29 0.739 -0.937 3.836
211 2HD2 LEU 29 2HD2 LEU 29 0.834 0.567 2.922
212 3HD2 LEU 29 3HD2 LEU 29 1.261 0.548 4.633
213 H ILE 30 H ILE 30 0.608 -3.773 3.415
214 HA ILE 30 HA ILE 30 -1.675 -3.145 1.713
215 HB ILE 30 HB ILE 30 -1.446 -5.137 4.008
216 1HG1 ILE 30 1HG1 ILE 30 -1.617 -5.566 1.020
217 2HG1 ILE 30 2HG1 ILE 30 -1.876 -6.863 2.176
218 1HG2 ILE 30 1HG2 ILE 30 -3.679 -5.930 3.373
219 2HG2 ILE 30 2HG2 ILE 30 -3.796 -4.617 2.200
220 3HG2 ILE 30 3HG2 ILE 30 -3.689 -4.252 3.920
221 1HD1 ILE 30 1HD1 ILE 30 0.677 -5.317 1.829
222 2HD1 ILE 30 2HD1 ILE 30 0.361 -6.940 1.233
223 3HD1 ILE 30 3HD1 ILE 30 0.416 -6.634 2.971
224 H VAL 31 H VAL 31 -2.924 -1.548 2.245
225 HA VAL 31 HA VAL 31 -2.914 -0.635 5.034
226 HB VAL 31 HB VAL 31 -2.035 1.066 3.410
227 1HG1 VAL 31 1HG1 VAL 31 -3.448 2.102 1.756
228 2HG1 VAL 31 2HG1 VAL 31 -4.694 0.899 2.089
229 3HG1 VAL 31 3HG1 VAL 31 -3.139 0.394 1.424
230 1HG2 VAL 31 1HG2 VAL 31 -4.735 1.804 4.528
231 2HG2 VAL 31 2HG2 VAL 31 -3.504 2.942 3.990
232 3HG2 VAL 31 3HG2 VAL 31 -3.200 1.922 5.388
233 H ASN 32 H ASN 32 -4.783 -1.043 6.131
234 HA ASN 32 HA ASN 32 -7.215 -1.166 4.469
235 1HB ASN 32 1HB ASN 32 -6.696 -2.481 7.155
236 2HB ASN 32 2HB ASN 32 -6.742 -3.307 5.608
237 1HD2 ASN 32 1HD2 ASN 32 -8.343 -3.787 7.963
238 2HD2 ASN 32 2HD2 ASN 32 -9.996 -3.610 7.485
239 H SER 33 H SER 33 -8.010 0.842 4.526
240 HA SER 33 HA SER 33 -8.285 2.082 7.130
241 1HB SER 33 1HB SER 33 -7.213 3.527 5.510
242 2HB SER 33 2HB SER 33 -8.838 4.142 5.805
243 HG SER 33 HG SER 33 -7.764 3.557 3.562
244 H GLU 34 H GLU 34 -10.337 2.792 7.797
245 HA GLU 34 HA GLU 34 -12.459 1.060 7.014
246 1HB GLU 34 1HB GLU 34 -12.446 3.527 8.743
247 2HB GLU 34 2HB GLU 34 -12.206 1.880 9.303
248 1HG GLU 34 1HG GLU 34 -14.456 1.304 8.655
249 2HG GLU 34 2HG GLU 34 -14.710 2.931 8.025
250 H GLU 35 H GLU 35 -11.574 4.363 6.392
251 HA GLU 35 HA GLU 35 -14.097 5.002 5.170
252 1HB GLU 35 1HB GLU 35 -11.589 6.614 5.517
253 2HB GLU 35 2HB GLU 35 -12.916 6.539 6.658
254 1HG GLU 35 1HG GLU 35 -14.400 7.544 4.997
255 2HG GLU 35 2HG GLU 35 -13.025 7.695 3.896
256 H HIS 36 H HIS 36 -10.846 4.180 4.057
257 HA HIS 36 HA HIS 36 -11.735 4.788 1.323
258 1HB HIS 36 1HB HIS 36 -9.254 4.613 0.719
259 2HB HIS 36 2HB HIS 36 -8.944 4.629 2.449
260 HD1 HIS 36 1HD HIS 36 -8.415 6.819 0.021
261 HD2 HIS 36 2HD HIS 36 -10.840 7.105 3.371
262 HE1 HIS 36 1HE HIS 36 -8.754 9.274 0.399
263 HE2 HIS 36 2HE HIS 36 -9.879 9.383 2.624
264 H GLY 37 H GLY 37 -10.777 2.177 3.354
265 1HA GLY 37 1HA GLY 37 -11.269 0.403 1.073
266 2HA GLY 37 2HA GLY 37 -11.592 0.012 2.758
267 H VAL 38 H VAL 38 -10.187 -1.781 1.371
268 HA VAL 38 HA VAL 38 -7.547 -1.457 2.514
269 HB VAL 38 HB VAL 38 -8.765 -3.421 3.281
270 1HG1 VAL 38 1HG1 VAL 38 -8.871 -4.291 0.408
271 2HG1 VAL 38 2HG1 VAL 38 -10.237 -3.809 1.418
272 3HG1 VAL 38 3HG1 VAL 38 -9.339 -5.279 1.792
273 1HG2 VAL 38 1HG2 VAL 38 -7.107 -5.168 2.776
274 2HG2 VAL 38 2HG2 VAL 38 -6.350 -3.619 3.141
275 3HG2 VAL 38 3HG2 VAL 38 -6.472 -4.169 1.468
276 H LYS 39 H LYS 39 -5.899 -1.036 1.351
277 HA LYS 39 HA LYS 39 -5.916 -1.659 -1.529
278 1HB LYS 39 1HB LYS 39 -4.130 0.239 -1.664
279 2HB LYS 39 2HB LYS 39 -4.682 0.653 -0.076
280 1HG LYS 39 1HG LYS 39 -6.573 0.625 -2.377
281 2HG LYS 39 2HG LYS 39 -5.615 2.034 -1.938
282 1HD LYS 39 1HD LYS 39 -6.602 2.002 0.306
283 2HD LYS 39 2HD LYS 39 -7.615 0.639 -0.183
284 1HE LYS 39 1HE LYS 39 -8.805 2.784 -0.337
285 2HE LYS 39 2HE LYS 39 -8.658 1.987 -1.899
286 1HZ LYS 39 1HZ LYS 39 -8.172 4.394 -1.974
287 2HZ LYS 39 2HZ LYS 39 -6.873 3.475 -2.494
288 3HZ LYS 39 3HZ LYS 39 -6.838 4.184 -0.987
289 H ALA 40 H ALA 40 -4.067 -2.467 -2.393
290 HA ALA 40 HA ALA 40 -1.890 -3.075 -0.539
291 1HB ALA 40 1HB ALA 40 -3.101 -5.129 -1.083
292 2HB ALA 40 2HB ALA 40 -1.525 -5.141 -1.875
293 3HB ALA 40 3HB ALA 40 -2.978 -4.762 -2.800
294 H TYR 41 H TYR 41 -0.235 -1.830 -1.128
295 HA TYR 41 HA TYR 41 0.236 -1.510 -3.982
296 1HB TYR 41 1HB TYR 41 -0.822 0.563 -3.303
297 2HB TYR 41 2HB TYR 41 0.870 0.855 -3.654
298 HD1 TYR 41 1HD TYR 41 -1.624 0.665 -0.947
299 HD2 TYR 41 2HD TYR 41 2.387 1.647 -1.969
300 HE1 TYR 41 1HE TYR 41 -1.360 1.818 1.206
301 HE2 TYR 41 2HE TYR 41 2.657 2.798 0.185
302 HH TYR 41 HH TYR 41 0.451 2.499 2.749
303 H GLN 42 H GLN 42 2.453 -0.747 -4.428
304 HA GLN 42 HA GLN 42 4.327 -2.525 -3.460
305 1HB GLN 42 1HB GLN 42 4.758 -1.269 -5.584
306 2HB GLN 42 2HB GLN 42 6.064 -1.083 -4.450
307 1HG GLN 42 1HG GLN 42 5.323 1.105 -3.834
308 2HG GLN 42 2HG GLN 42 3.915 0.947 -4.887
309 1HE2 GLN 42 1HE2 GLN 42 4.183 1.077 -7.103
310 2HE2 GLN 42 2HE2 GLN 42 5.672 1.669 -7.784
311 H ALA 43 H ALA 43 5.797 -2.574 -1.839
312 HA ALA 43 HA ALA 43 5.580 -0.476 0.223
313 1HB ALA 43 1HB ALA 43 6.453 -2.172 1.743
314 2HB ALA 43 2HB ALA 43 6.612 -3.292 0.391
315 3HB ALA 43 3HB ALA 43 5.014 -2.764 0.906
316 H MET 44 H MET 44 7.316 -0.948 -2.310
317 HA MET 44 HA MET 44 9.916 -1.292 -1.248
318 1HB MET 44 1HB MET 44 9.193 -0.384 -4.020
319 2HB MET 44 2HB MET 44 9.177 -2.063 -3.504
320 1HG MET 44 1HG MET 44 11.569 -0.256 -3.499
321 2HG MET 44 2HG MET 44 11.222 -1.519 -4.685
322 1HE MET 44 1HE MET 44 13.982 -1.518 -3.233
323 2HE MET 44 2HE MET 44 13.425 -2.810 -4.311
324 3HE MET 44 3HE MET 44 14.109 -3.215 -2.733
325 H CYS 45 H CYS 45 10.096 0.360 0.224
326 HA CYS 45 HA CYS 45 11.488 2.574 -0.877
327 1HB CYS 45 1HB CYS 45 9.038 3.166 0.829
328 2HB CYS 45 2HB CYS 45 9.288 3.667 -0.840
329 HA PRO 46 HA PRO 46 13.356 1.305 3.064
330 1HB PRO 46 1HB PRO 46 15.015 -0.131 2.385
331 2HB PRO 46 2HB PRO 46 15.867 1.211 1.621
332 1HG PRO 46 1HG PRO 46 13.974 -0.752 0.429
333 2HG PRO 46 2HG PRO 46 15.329 0.100 -0.326
334 1HD PRO 46 1HD PRO 46 12.807 0.798 -0.858
335 2HD PRO 46 2HD PRO 46 14.094 2.020 -0.679
336 H HIS 47 H HIS 47 13.209 3.697 1.007
337 HA HIS 47 HA HIS 47 15.323 5.490 1.864
338 1HB HIS 47 1HB HIS 47 12.857 5.995 0.136
339 2HB HIS 47 2HB HIS 47 14.369 5.342 -0.474
340 HD2 HIS 47 2HD HIS 47 16.241 7.567 1.185
341 HE1 HIS 47 1HE HIS 47 14.598 10.181 -1.670
342 HE2 HIS 47 2HE HIS 47 16.518 9.698 -0.178
343 H GLN 48 H GLN 48 12.213 4.479 2.773
344 HA GLN 48 HA GLN 48 11.044 6.877 3.621
345 1HB GLN 48 1HB GLN 48 10.304 4.021 4.212
346 2HB GLN 48 2HB GLN 48 9.790 4.940 2.818
347 1HG GLN 48 1HG GLN 48 8.674 6.533 4.421
348 2HG GLN 48 2HG GLN 48 8.955 5.313 5.665
349 1HE2 GLN 48 1HE2 GLN 48 6.436 6.303 4.520
350 2HE2 GLN 48 2HE2 GLN 48 5.646 4.895 3.888
351 H GLU 49 H GLU 49 10.551 7.589 5.515
352 HA GLU 49 HA GLU 49 12.428 7.890 7.480
353 1HB GLU 49 1HB GLU 49 9.445 8.179 7.705
354 2HB GLU 49 2HB GLU 49 10.532 9.368 7.020
355 1HG GLU 49 1HG GLU 49 10.581 8.456 9.874
356 2HG GLU 49 2HG GLU 49 9.824 9.937 9.286
357 H ILE 50 H ILE 50 13.250 6.072 8.376
358 HA ILE 50 HA ILE 50 13.614 4.507 9.918
359 HB ILE 50 HB ILE 50 11.036 5.451 11.206
360 1HG1 ILE 50 1HG1 ILE 50 12.497 6.802 12.662
361 2HG1 ILE 50 2HG1 ILE 50 12.681 7.261 10.975
362 1HG2 ILE 50 1HG2 ILE 50 11.929 4.468 13.283
363 2HG2 ILE 50 2HG2 ILE 50 13.306 3.834 12.380
364 3HG2 ILE 50 3HG2 ILE 50 11.681 3.244 12.033
365 1HD1 ILE 50 1HD1 ILE 50 14.770 6.020 10.837
366 2HD1 ILE 50 2HD1 ILE 50 14.589 5.526 12.520
367 3HD1 ILE 50 3HD1 ILE 50 14.819 7.227 12.123
368 H LEU 51 H LEU 51 10.057 4.118 9.894
369 HA LEU 51 HA LEU 51 10.545 1.309 9.156
370 1HB LEU 51 1HB LEU 51 8.213 2.253 10.811
371 2HB LEU 51 2HB LEU 51 9.760 1.997 11.579
372 HG LEU 51 HG LEU 51 8.242 0.116 11.920
373 1HD1 LEU 51 1HD1 LEU 51 8.360 -0.249 8.955
374 2HD1 LEU 51 2HD1 LEU 51 6.939 0.159 9.926
375 3HD1 LEU 51 3HD1 LEU 51 7.710 -1.414 10.104
376 1HD2 LEU 51 1HD2 LEU 51 9.780 -1.668 11.290
377 2HD2 LEU 51 2HD2 LEU 51 10.624 -0.271 11.960
378 3HD2 LEU 51 3HD2 LEU 51 10.630 -0.554 10.220
379 H LEU 52 H LEU 52 9.659 0.843 7.260
380 HA LEU 52 HA LEU 52 8.327 2.774 5.734
381 1HB LEU 52 1HB LEU 52 9.777 1.136 4.689
382 2HB LEU 52 2HB LEU 52 8.199 1.159 3.946
383 HG LEU 52 HG LEU 52 7.621 -0.958 5.113
384 1HD1 LEU 52 1HD1 LEU 52 9.026 -2.391 3.742
385 2HD1 LEU 52 2HD1 LEU 52 10.120 -1.040 3.444
386 3HD1 LEU 52 3HD1 LEU 52 8.465 -0.985 2.841
387 1HD2 LEU 52 1HD2 LEU 52 9.411 -2.296 6.113
388 2HD2 LEU 52 2HD2 LEU 52 9.144 -0.816 7.022
389 3HD2 LEU 52 3HD2 LEU 52 10.531 -0.946 5.934
390 H SER 53 H SER 53 6.940 -0.198 7.193
391 HA SER 53 HA SER 53 4.418 0.227 5.925
392 1HB SER 53 1HB SER 53 5.266 -1.926 6.388
393 2HB SER 53 2HB SER 53 3.747 -1.691 7.169
394 HG SER 53 HG SER 53 5.166 -2.653 8.556
395 H GLU 54 H GLU 54 5.741 0.999 8.978
396 HA GLU 54 HA GLU 54 3.226 2.139 9.926
397 1HB GLU 54 1HB GLU 54 4.531 2.624 11.986
398 2HB GLU 54 2HB GLU 54 5.946 1.923 11.223
399 1HG GLU 54 1HG GLU 54 4.799 -0.234 11.081
400 2HG GLU 54 2HG GLU 54 3.397 0.478 11.883
401 H GLY 55 H GLY 55 4.862 3.224 7.579
402 1HA GLY 55 1HA GLY 55 5.673 5.121 6.756
403 2HA GLY 55 2HA GLY 55 6.335 5.450 8.348
404 H SER 56 H SER 56 3.695 6.104 6.137
405 HA SER 56 HA SER 56 2.363 7.704 8.103
406 1HB SER 56 1HB SER 56 2.658 9.741 6.813
407 2HB SER 56 2HB SER 56 3.627 8.717 5.762
408 HG SER 56 HG SER 56 4.424 8.506 8.318
409 H TYR 57 H TYR 57 0.506 7.716 7.640
410 HA TYR 57 HA TYR 57 -0.686 7.656 4.934
411 1HB TYR 57 1HB TYR 57 -1.686 6.044 7.309
412 2HB TYR 57 2HB TYR 57 -0.983 5.375 5.842
413 HD1 TYR 57 1HD TYR 57 -3.998 6.797 7.349
414 HD2 TYR 57 2HD TYR 57 -2.262 5.417 3.714
415 HE1 TYR 57 1HE TYR 57 -6.228 6.710 6.331
416 HE2 TYR 57 2HE TYR 57 -4.504 5.329 2.681
417 HH TYR 57 HH TYR 57 -7.139 6.852 4.021
418 H GLU 58 H GLU 58 -1.729 9.402 4.642
419 HA GLU 58 HA GLU 58 -3.158 10.507 6.935
420 1HB GLU 58 1HB GLU 58 -3.204 12.648 5.606
421 2HB GLU 58 2HB GLU 58 -2.171 11.846 4.422
422 1HG GLU 58 1HG GLU 58 -0.452 11.540 6.127
423 2HG GLU 58 2HG GLU 58 -1.470 12.364 7.304
424 H GLY 59 H GLY 59 -5.250 11.659 6.109
425 1HA GLY 59 1HA GLY 59 -7.327 11.448 5.099
426 2HA GLY 59 2HA GLY 59 -7.126 9.796 5.638
427 H GLY 60 H GLY 60 -5.954 11.765 2.930
428 1HA GLY 60 1HA GLY 60 -6.959 11.059 0.719
429 2HA GLY 60 2HA GLY 60 -6.507 9.432 1.207
430 H VAL 61 H VAL 61 -3.991 10.463 2.464
431 HA VAL 61 HA VAL 61 -2.554 10.972 -0.022
432 HB VAL 61 HB VAL 61 -1.915 12.252 2.657
433 1HG1 VAL 61 1HG1 VAL 61 0.114 11.730 1.441
434 2HG1 VAL 61 2HG1 VAL 61 -0.170 13.473 1.463
435 3HG1 VAL 61 3HG1 VAL 61 -0.522 12.540 0.008
436 1HG2 VAL 61 1HG2 VAL 61 -2.415 14.352 1.541
437 2HG2 VAL 61 2HG2 VAL 61 -3.830 13.294 1.592
438 3HG2 VAL 61 3HG2 VAL 61 -2.915 13.478 0.093
439 H ILE 62 H ILE 62 -1.155 9.529 -0.434
440 HA ILE 62 HA ILE 62 -0.246 7.673 1.666
441 HB ILE 62 HB ILE 62 0.083 7.538 -1.361
442 1HG1 ILE 62 1HG1 ILE 62 -1.531 5.688 -1.313
443 2HG1 ILE 62 2HG1 ILE 62 -2.235 7.175 -0.691
444 1HG2 ILE 62 1HG2 ILE 62 0.886 5.243 -1.040
445 2HG2 ILE 62 2HG2 ILE 62 0.829 5.480 0.706
446 3HG2 ILE 62 3HG2 ILE 62 1.938 6.436 -0.276
447 1HD1 ILE 62 1HD1 ILE 62 -1.230 4.899 0.999
448 2HD1 ILE 62 2HD1 ILE 62 -2.916 5.239 0.616
449 3HD1 ILE 62 3HD1 ILE 62 -1.990 6.379 1.589
450 H THR 63 H THR 63 1.952 7.667 2.242
451 HA THR 63 HA THR 63 3.503 9.641 0.740
452 HB THR 63 HB THR 63 3.730 9.293 3.742
453 HG1 THR 63 1HG THR 63 1.649 10.154 2.604
454 1HG2 THR 63 1HG2 THR 63 4.520 11.529 1.863
455 2HG2 THR 63 2HG2 THR 63 5.628 10.334 2.517
456 3HG2 THR 63 3HG2 THR 63 4.822 11.472 3.600
457 H CYS 64 H CYS 64 5.126 8.608 -0.268
458 HA CYS 64 HA CYS 64 6.305 6.095 0.400
459 1HB CYS 64 1HB CYS 64 7.742 8.296 -1.149
460 2HB CYS 64 2HB CYS 64 6.308 7.593 -1.853
461 H ARG 65 H ARG 65 6.650 9.271 1.353
462 HA ARG 65 HA ARG 65 7.814 10.566 2.635
463 1HB ARG 65 1HB ARG 65 7.591 8.323 4.613
464 2HB ARG 65 2HB ARG 65 6.343 9.503 4.241
465 1HG ARG 65 1HG ARG 65 7.922 11.290 4.971
466 2HG ARG 65 2HG ARG 65 9.045 10.028 5.465
467 1HD ARG 65 1HD ARG 65 7.408 9.150 7.022
468 2HD ARG 65 2HD ARG 65 6.267 10.403 6.530
469 HE ARG 65 HE ARG 65 8.762 11.464 7.389
470 1HH1 ARG 65 1HH1 ARG 65 5.599 10.322 8.520
471 2HH1 ARG 65 2HH1 ARG 65 5.694 11.079 10.031
472 1HH2 ARG 65 1HH2 ARG 65 8.892 12.557 9.497
473 2HH2 ARG 65 2HH2 ARG 65 7.600 12.364 10.589
474 H ALA 66 H ALA 66 9.502 10.867 1.492
475 HA ALA 66 HA ALA 66 11.754 11.220 2.943
476 1HB ALA 66 1HB ALA 66 12.192 8.810 2.741
477 2HB ALA 66 2HB ALA 66 13.403 9.766 1.885
478 3HB ALA 66 3HB ALA 66 12.123 8.953 0.986
479 H HIS 67 H HIS 67 10.595 10.500 -0.349
480 HA HIS 67 HA HIS 67 11.971 13.040 -1.040
481 1HB HIS 67 1HB HIS 67 12.976 10.900 -1.953
482 2HB HIS 67 2HB HIS 67 12.871 12.265 -3.044
483 HD2 HIS 67 2HD HIS 67 10.792 12.011 -5.029
484 HE1 HIS 67 1HE HIS 67 10.972 7.805 -5.012
485 HE2 HIS 67 2HE HIS 67 10.579 9.852 -6.376
486 H LEU 68 H LEU 68 8.907 12.291 -0.634
487 HA LEU 68 HA LEU 68 8.175 13.792 -3.052
488 1HB LEU 68 1HB LEU 68 7.379 11.465 -3.281
489 2HB LEU 68 2HB LEU 68 6.095 12.633 -3.360
490 HG LEU 68 HG LEU 68 5.625 10.455 -2.199
491 1HD1 LEU 68 1HD1 LEU 68 7.160 11.678 0.015
492 2HD1 LEU 68 2HD1 LEU 68 7.586 10.242 -0.910
493 3HD1 LEU 68 3HD1 LEU 68 6.133 10.248 0.109
494 1HD2 LEU 68 1HD2 LEU 68 5.008 12.997 -0.708
495 2HD2 LEU 68 2HD2 LEU 68 4.166 11.460 -0.505
496 3HD2 LEU 68 3HD2 LEU 68 4.086 12.312 -2.046
497 H TRP 69 H TRP 69 6.153 14.981 -2.978
498 HA TRP 69 HA TRP 69 5.955 16.361 -0.411
499 1HB TRP 69 1HB TRP 69 4.921 17.151 -3.145
500 2HB TRP 69 2HB TRP 69 6.401 17.753 -2.412
501 HD1 TRP 69 HD TRP 69 2.739 18.440 -2.631
502 HE1 TRP 69 1HE TRP 69 2.132 20.451 -1.145
503 HE3 TRP 69 3HE TRP 69 7.106 18.893 -0.025
504 HZ2 TRP 69 2HZ TRP 69 3.325 22.020 0.848
505 HZ3 TRP 69 3HZ TRP 69 7.295 20.681 1.654
506 HH2 TRP 69 HH TRP 69 5.443 22.213 2.081
507 H THR 70 H THR 70 3.561 15.585 -2.993
508 HA THR 70 HA THR 70 1.934 14.342 -0.934
509 HB THR 70 HB THR 70 -0.075 15.291 -2.058
510 HG1 THR 70 1HG THR 70 0.591 17.529 -3.014
511 1HG2 THR 70 1HG2 THR 70 0.618 16.080 0.123
512 2HG2 THR 70 2HG2 THR 70 0.020 17.448 -0.821
513 3HG2 THR 70 3HG2 THR 70 1.756 17.211 -0.608
514 H PHE 71 H PHE 71 0.726 12.670 -1.546
515 HA PHE 71 HA PHE 71 0.738 11.852 -4.339
516 1HB PHE 71 1HB PHE 71 1.325 10.135 -1.921
517 2HB PHE 71 2HB PHE 71 2.557 10.754 -3.000
518 HD1 PHE 71 1HD PHE 71 -0.451 8.605 -2.970
519 HD2 PHE 71 2HD PHE 71 3.236 9.592 -4.802
520 HE1 PHE 71 1HE PHE 71 -0.611 6.600 -4.363
521 HE2 PHE 71 2HE PHE 71 3.082 7.608 -6.198
522 HZ PHE 71 HZ PHE 71 1.171 6.108 -5.992
523 H ASN 72 H ASN 72 -1.299 10.927 -4.869
524 HA ASN 72 HA ASN 72 -3.306 11.189 -2.741
525 1HB ASN 72 1HB ASN 72 -3.647 11.102 -5.743
526 2HB ASN 72 2HB ASN 72 -3.737 12.532 -4.723
527 1HD2 ASN 72 1HD2 ASN 72 -5.527 12.797 -3.342
528 2HD2 ASN 72 2HD2 ASN 72 -6.989 11.935 -3.618
529 H ASP 73 H ASP 73 -4.279 9.584 -1.886
530 HA ASP 73 HA ASP 73 -3.597 6.886 -2.316
531 1HB ASP 73 1HB ASP 73 -5.747 8.246 -0.726
532 2HB ASP 73 2HB ASP 73 -4.312 7.415 -0.147
533 H GLY 74 H GLY 74 -6.658 8.533 -3.020
534 1HA GLY 74 1HA GLY 74 -8.423 7.985 -4.354
535 2HA GLY 74 2HA GLY 74 -8.076 6.318 -3.937
536 H THR 75 H THR 75 -6.376 8.713 -5.882
537 HA THR 75 HA THR 75 -6.933 7.220 -8.262
538 HB THR 75 HB THR 75 -5.102 9.603 -7.855
539 HG1 THR 75 1HG THR 75 -7.746 9.622 -8.890
540 1HG2 THR 75 1HG2 THR 75 -4.693 8.404 -9.961
541 2HG2 THR 75 2HG2 THR 75 -5.468 9.959 -10.277
542 3HG2 THR 75 3HG2 THR 75 -6.412 8.468 -10.330
543 H GLY 76 H GLY 76 -4.266 7.543 -5.977
544 1HA GLY 76 1HA GLY 76 -2.891 5.318 -7.188
545 2HA GLY 76 2HA GLY 76 -2.418 6.195 -5.736
546 H HIS 77 H HIS 77 -2.846 8.672 -7.405
547 HA HIS 77 HA HIS 77 -0.551 8.631 -9.214
548 1HB HIS 77 1HB HIS 77 -2.919 10.490 -8.876
549 2HB HIS 77 2HB HIS 77 -2.687 9.333 -10.167
550 HD1 HIS 77 1HD HIS 77 -2.744 12.739 -9.874
551 HD2 HIS 77 2HD HIS 77 0.046 10.119 -11.414
552 HE1 HIS 77 1HE HIS 77 -1.414 14.098 -11.481
553 HE2 HIS 77 2HE HIS 77 0.453 12.610 -12.170
554 H GLY 78 H GLY 78 1.183 9.930 -8.792
555 1HA GLY 78 1HA GLY 78 2.630 10.968 -7.293
556 2HA GLY 78 2HA GLY 78 1.269 11.249 -6.213
557 H ILE 79 H ILE 79 1.461 13.434 -5.919
558 HA ILE 79 HA ILE 79 0.875 15.044 -8.241
559 HB ILE 79 HB ILE 79 1.111 15.835 -5.306
560 1HG1 ILE 79 1HG1 ILE 79 -1.317 15.663 -7.124
561 2HG1 ILE 79 2HG1 ILE 79 -1.347 16.391 -5.529
562 1HG2 ILE 79 1HG2 ILE 79 0.401 17.605 -7.642
563 2HG2 ILE 79 2HG2 ILE 79 1.857 17.700 -6.656
564 3HG2 ILE 79 3HG2 ILE 79 0.286 18.064 -5.943
565 1HD1 ILE 79 1HD1 ILE 79 -0.805 14.260 -4.506
566 2HD1 ILE 79 2HD1 ILE 79 -0.766 13.503 -6.099
567 3HD1 ILE 79 3HD1 ILE 79 -2.276 14.168 -5.476
568 H ASN 80 H ASN 80 3.330 14.748 -5.750
569 HA ASN 80 HA ASN 80 5.301 15.475 -7.715
570 1HB ASN 80 1HB ASN 80 5.139 16.881 -5.079
571 2HB ASN 80 2HB ASN 80 4.757 17.658 -6.618
572 1HD2 ASN 80 1HD2 ASN 80 6.781 18.413 -4.641
573 2HD2 ASN 80 2HD2 ASN 80 8.293 18.313 -5.444
574 HA PRO 81 HA PRO 81 6.873 14.711 -8.389
575 1HB PRO 81 1HB PRO 81 8.659 13.438 -8.995
576 2HB PRO 81 2HB PRO 81 7.692 11.966 -8.885
577 1HG PRO 81 1HG PRO 81 9.358 13.298 -6.808
578 2HG PRO 81 2HG PRO 81 9.040 11.572 -7.049
579 1HD PRO 81 1HD PRO 81 7.865 12.922 -5.074
580 2HD PRO 81 2HD PRO 81 6.972 11.683 -5.982
581 H ASP 82 H ASP 82 5.955 13.950 -10.447
582 HA ASP 82 HA ASP 82 3.271 13.040 -10.117
583 1HB ASP 82 1HB ASP 82 4.851 13.624 -12.624
584 2HB ASP 82 2HB ASP 82 3.797 14.745 -11.772
585 H ASP 83 H ASP 83 6.180 11.640 -11.428
586 HA ASP 83 HA ASP 83 4.796 9.244 -12.359
587 1HB ASP 83 1HB ASP 83 7.020 8.581 -13.209
588 2HB ASP 83 2HB ASP 83 7.668 10.027 -12.442
589 H CYS 84 H CYS 84 5.045 9.859 -9.500
590 HA CYS 84 HA CYS 84 6.805 7.712 -8.513
591 1HB CYS 84 1HB CYS 84 5.238 9.776 -7.027
592 2HB CYS 84 2HB CYS 84 6.789 10.022 -7.759
593 HG CYS 84 HG CYS 84 6.417 7.403 -5.623
594 H CYS 85 H CYS 85 4.074 8.008 -9.618
595 HA CYS 85 HA CYS 85 2.000 7.194 -7.888
596 1HB CYS 85 1HB CYS 85 0.689 6.445 -9.692
597 2HB CYS 85 2HB CYS 85 2.044 6.223 -10.740
598 HG CYS 85 HG CYS 85 2.393 8.820 -11.359
599 H LEU 86 H LEU 86 0.875 5.227 -7.677
600 HA LEU 86 HA LEU 86 2.800 3.081 -7.170
601 1HB LEU 86 1HB LEU 86 1.896 3.862 -5.106
602 2HB LEU 86 2HB LEU 86 1.267 2.266 -5.401
603 HG LEU 86 HG LEU 86 -0.360 4.790 -5.838
604 1HD1 LEU 86 1HD1 LEU 86 -1.190 2.936 -7.137
605 2HD1 LEU 86 2HD1 LEU 86 -2.299 3.337 -5.824
606 3HD1 LEU 86 3HD1 LEU 86 -1.245 1.926 -5.693
607 1HD2 LEU 86 1HD2 LEU 86 0.232 4.590 -3.490
608 2HD2 LEU 86 2HD2 LEU 86 -0.344 2.924 -3.474
609 3HD2 LEU 86 3HD2 LEU 86 -1.481 4.249 -3.737
610 H ALA 87 H ALA 87 1.488 0.895 -6.810
611 HA ALA 87 HA ALA 87 -0.267 0.500 -9.091
612 1HB ALA 87 1HB ALA 87 1.910 -0.458 -9.657
613 2HB ALA 87 2HB ALA 87 0.769 -1.762 -9.334
614 3HB ALA 87 3HB ALA 87 1.961 -1.314 -8.117
615 H GLU 88 H GLU 88 -2.189 -0.004 -8.187
616 HA GLU 88 HA GLU 88 -2.190 -1.176 -5.544
617 1HB GLU 88 1HB GLU 88 -3.612 0.753 -5.706
618 2HB GLU 88 2HB GLU 88 -4.638 -0.653 -5.516
619 1HG GLU 88 1HG GLU 88 -5.083 -0.628 -7.944
620 2HG GLU 88 2HG GLU 88 -4.134 0.852 -8.068
621 H TYR 89 H TYR 89 -2.451 -3.160 -5.207
622 HA TYR 89 HA TYR 89 -3.141 -4.949 -7.389
623 1HB TYR 89 1HB TYR 89 -2.283 -6.702 -5.913
624 2HB TYR 89 2HB TYR 89 -2.142 -5.547 -4.590
625 HD1 TYR 89 1HD TYR 89 -0.304 -4.001 -4.473
626 HD2 TYR 89 2HD TYR 89 -0.722 -6.593 -7.809
627 HE1 TYR 89 1HE TYR 89 1.979 -3.439 -5.183
628 HE2 TYR 89 2HE TYR 89 1.562 -6.035 -8.526
629 HH TYR 89 HH TYR 89 3.159 -4.295 -8.261
630 HA PRO 90 HA PRO 90 -7.444 -5.301 -6.042
631 1HB PRO 90 1HB PRO 90 -8.349 -6.919 -7.490
632 2HB PRO 90 2HB PRO 90 -7.038 -8.040 -7.156
633 1HG PRO 90 1HG PRO 90 -7.018 -5.588 -8.891
634 2HG PRO 90 2HG PRO 90 -6.452 -7.221 -9.283
635 1HD PRO 90 1HD PRO 90 -4.781 -5.276 -8.531
636 2HD PRO 90 2HD PRO 90 -4.502 -6.967 -8.053
637 H VAL 91 H VAL 91 -7.978 -5.686 -3.975
638 HA VAL 91 HA VAL 91 -6.727 -7.951 -2.604
639 HB VAL 91 HB VAL 91 -8.028 -5.505 -1.410
640 1HG1 VAL 91 1HG1 VAL 91 -7.004 -6.245 0.693
641 2HG1 VAL 91 2HG1 VAL 91 -6.428 -7.700 -0.121
642 3HG1 VAL 91 3HG1 VAL 91 -8.158 -7.423 0.063
643 1HG2 VAL 91 1HG2 VAL 91 -5.108 -6.176 -1.689
644 2HG2 VAL 91 2HG2 VAL 91 -5.756 -4.792 -0.811
645 3HG2 VAL 91 3HG2 VAL 91 -5.969 -4.910 -2.559
646 H GLU 92 H GLU 92 -7.917 -9.521 -1.907
647 HA GLU 92 HA GLU 92 -10.828 -9.281 -1.865
648 1HB GLU 92 1HB GLU 92 -10.513 -11.937 -1.784
649 2HB GLU 92 2HB GLU 92 -8.922 -11.427 -2.161
650 1HG GLU 92 1HG GLU 92 -10.232 -12.105 -4.182
651 2HG GLU 92 2HG GLU 92 -9.548 -10.481 -4.268
652 H VAL 93 H VAL 93 -11.439 -8.938 -0.023
653 HA VAL 93 HA VAL 93 -9.990 -9.956 2.295
654 HB VAL 93 HB VAL 93 -9.785 -7.582 2.170
655 1HG1 VAL 93 1HG1 VAL 93 -11.698 -6.992 0.833
656 2HG1 VAL 93 2HG1 VAL 93 -11.699 -6.035 2.313
657 3HG1 VAL 93 3HG1 VAL 93 -12.792 -7.410 2.152
658 1HG2 VAL 93 1HG2 VAL 93 -9.971 -8.500 4.436
659 2HG2 VAL 93 2HG2 VAL 93 -11.722 -8.316 4.375
660 3HG2 VAL 93 3HG2 VAL 93 -10.689 -6.891 4.366
661 H LYS 94 H LYS 94 -10.979 -11.528 3.304
662 HA LYS 94 HA LYS 94 -13.801 -11.222 3.832
663 1HB LYS 94 1HB LYS 94 -13.618 -13.069 2.205
664 2HB LYS 94 2HB LYS 94 -14.210 -13.620 3.754
665 1HG LYS 94 1HG LYS 94 -12.803 -15.293 3.011
666 2HG LYS 94 2HG LYS 94 -11.904 -14.440 4.259
667 1HD LYS 94 1HD LYS 94 -10.621 -13.265 2.614
668 2HD LYS 94 2HD LYS 94 -11.533 -14.005 1.305
669 1HE LYS 94 1HE LYS 94 -9.815 -15.401 3.350
670 2HE LYS 94 2HE LYS 94 -9.405 -15.175 1.664
671 1HZ LYS 94 1HZ LYS 94 -11.658 -16.800 2.689
672 2HZ LYS 94 2HZ LYS 94 -10.211 -17.393 2.108
673 3HZ LYS 94 3HZ LYS 94 -11.273 -16.607 1.057
674 H GLY 95 H GLY 95 -14.488 -11.937 5.843
675 1HA GLY 95 1HA GLY 95 -14.246 -12.466 8.078
676 2HA GLY 95 2HA GLY 95 -13.068 -11.170 8.009
677 H ASP 96 H ASP 96 -11.347 -11.686 8.988
678 HA ASP 96 HA ASP 96 -9.657 -12.677 9.936
679 1HB ASP 96 1HB ASP 96 -9.353 -14.990 10.180
680 2HB ASP 96 2HB ASP 96 -10.624 -15.411 9.099
681 H ASP 97 H ASP 97 -10.127 -13.060 6.496
682 HA ASP 97 HA ASP 97 -7.241 -13.458 6.332
683 1HB ASP 97 1HB ASP 97 -9.151 -15.423 5.082
684 2HB ASP 97 2HB ASP 97 -8.077 -15.715 6.423
685 H ILE 98 H ILE 98 -6.192 -12.822 4.408
686 HA ILE 98 HA ILE 98 -7.923 -11.434 2.503
687 HB ILE 98 HB ILE 98 -5.458 -10.381 3.862
688 1HG1 ILE 98 1HG1 ILE 98 -7.534 -9.988 5.086
689 2HG1 ILE 98 2HG1 ILE 98 -8.260 -9.273 3.650
690 1HG2 ILE 98 1HG2 ILE 98 -5.229 -9.872 1.495
691 2HG2 ILE 98 2HG2 ILE 98 -5.592 -8.395 2.385
692 3HG2 ILE 98 3HG2 ILE 98 -6.858 -9.199 1.458
693 1HD1 ILE 98 1HD1 ILE 98 -5.943 -8.109 5.131
694 2HD1 ILE 98 2HD1 ILE 98 -7.618 -7.556 5.208
695 3HD1 ILE 98 3HD1 ILE 98 -6.719 -7.433 3.703
696 H TYR 99 H TYR 99 -7.523 -11.967 0.452
697 HA TYR 99 HA TYR 99 -4.788 -12.715 -0.162
698 1HB TYR 99 1HB TYR 99 -6.056 -14.750 -0.372
699 2HB TYR 99 2HB TYR 99 -5.574 -14.198 -1.977
700 HD1 TYR 99 1HD TYR 99 -7.021 -13.872 -3.666
701 HD2 TYR 99 2HD TYR 99 -8.442 -14.508 0.229
702 HE1 TYR 99 1HE TYR 99 -9.280 -14.276 -4.595
703 HE2 TYR 99 2HE TYR 99 -10.729 -14.902 -0.639
704 HH TYR 99 HH TYR 99 -12.047 -14.370 -2.641
705 H VAL 100 H VAL 100 -3.998 -12.194 -2.351
706 HA VAL 100 HA VAL 100 -5.384 -9.841 -3.348
707 HB VAL 100 HB VAL 100 -3.892 -9.044 -1.672
708 1HG1 VAL 100 1HG1 VAL 100 -1.419 -9.276 -1.848
709 2HG1 VAL 100 2HG1 VAL 100 -1.655 -10.377 -3.206
710 3HG1 VAL 100 3HG1 VAL 100 -2.239 -10.822 -1.605
711 1HG2 VAL 100 1HG2 VAL 100 -2.860 -8.401 -4.423
712 2HG2 VAL 100 2HG2 VAL 100 -2.530 -7.444 -2.979
713 3HG2 VAL 100 3HG2 VAL 100 -4.183 -7.599 -3.578
714 H SER 101 H SER 101 -4.965 -9.338 -5.371
715 HA SER 101 HA SER 101 -3.788 -11.477 -6.986
716 1HB SER 101 1HB SER 101 -5.477 -9.133 -7.860
717 2HB SER 101 2HB SER 101 -6.077 -10.767 -7.565
718 HG SER 101 HG SER 101 -5.640 -10.260 -9.778
719 H THR 102 H THR 102 -1.887 -11.261 -7.777
720 HA THR 102 HA THR 102 -0.766 -8.563 -8.177
721 HB THR 102 HB THR 102 0.758 -11.194 -8.029
722 HG1 THR 102 1HG THR 102 -0.521 -9.773 -6.116
723 1HG2 THR 102 1HG2 THR 102 1.966 -9.241 -8.973
724 2HG2 THR 102 2HG2 THR 102 2.644 -9.743 -7.424
725 3HG2 THR 102 3HG2 THR 102 1.598 -8.326 -7.510
726 H LYS 103 H LYS 103 -2.592 -10.397 -9.796
727 HA LYS 103 HA LYS 103 -1.176 -11.505 -11.962
728 1HB LYS 103 1HB LYS 103 -4.087 -10.779 -11.724
729 2HB LYS 103 2HB LYS 103 -3.376 -12.324 -11.307
730 1HG LYS 103 1HG LYS 103 -2.713 -12.615 -13.653
731 2HG LYS 103 2HG LYS 103 -3.526 -11.100 -14.045
732 1HD LYS 103 1HD LYS 103 -5.641 -12.034 -13.241
733 2HD LYS 103 2HD LYS 103 -4.824 -13.556 -12.883
734 1HE LYS 103 1HE LYS 103 -5.109 -12.265 -15.593
735 2HE LYS 103 2HE LYS 103 -5.970 -13.691 -15.018
736 1HZ LYS 103 1HZ LYS 103 -4.122 -14.314 -16.425
737 2HZ LYS 103 2HZ LYS 103 -3.833 -14.853 -14.852
738 3HZ LYS 103 3HZ LYS 103 -3.045 -13.488 -15.437
739 H GLY 104 H GLY 104 -0.042 -10.344 -13.317
740 1HA GLY 104 1HA GLY 104 -1.385 -8.577 -15.112
741 2HA GLY 104 2HA GLY 104 0.310 -9.028 -15.171
742 H ILE 105 H ILE 105 0.052 -8.044 -12.160
743 HA ILE 105 HA ILE 105 0.490 -5.230 -12.867
744 HB ILE 105 HB ILE 105 -0.567 -6.256 -10.211
745 1HG1 ILE 105 1HG1 ILE 105 -2.213 -6.528 -12.044
746 2HG1 ILE 105 2HG1 ILE 105 -2.035 -4.822 -12.441
747 1HG2 ILE 105 1HG2 ILE 105 0.725 -4.170 -10.047
748 2HG2 ILE 105 2HG2 ILE 105 -0.986 -3.866 -9.751
749 3HG2 ILE 105 3HG2 ILE 105 -0.273 -3.445 -11.309
750 1HD1 ILE 105 1HD1 ILE 105 -3.100 -5.921 -9.861
751 2HD1 ILE 105 2HD1 ILE 105 -4.054 -5.216 -11.167
752 3HD1 ILE 105 3HD1 ILE 105 -2.919 -4.213 -10.256
753 H LEU 106 H LEU 106 2.615 -4.936 -12.858
754 HA LEU 106 HA LEU 106 4.281 -6.277 -10.952
755 1HB LEU 106 1HB LEU 106 6.039 -5.117 -12.312
756 2HB LEU 106 2HB LEU 106 4.782 -4.531 -13.358
757 HG LEU 106 HG LEU 106 5.402 -7.467 -13.019
758 1HD1 LEU 106 1HD1 LEU 106 3.127 -7.062 -13.771
759 2HD1 LEU 106 2HD1 LEU 106 4.104 -7.764 -15.063
760 3HD1 LEU 106 3HD1 LEU 106 3.729 -6.041 -15.079
761 1HD2 LEU 106 1HD2 LEU 106 6.489 -7.318 -15.207
762 2HD2 LEU 106 2HD2 LEU 106 7.314 -6.347 -13.989
763 3HD2 LEU 106 3HD2 LEU 106 6.280 -5.567 -15.186
764 HA PRO 107 HA PRO 107 4.681 -2.631 -8.331
765 1HB PRO 107 1HB PRO 107 6.758 -2.724 -7.304
766 2HB PRO 107 2HB PRO 107 7.609 -2.871 -8.842
767 1HG PRO 107 1HG PRO 107 6.209 -4.959 -7.225
768 2HG PRO 107 2HG PRO 107 7.758 -5.064 -8.083
769 1HD PRO 107 1HD PRO 107 5.424 -6.082 -9.068
770 2HD PRO 107 2HD PRO 107 6.739 -5.500 -10.108
771 H ASN 108 H ASN 108 4.767 -0.485 -8.793
772 HA ASN 108 HA ASN 108 5.063 0.170 -11.603
773 1HB ASN 108 1HB ASN 108 4.470 2.173 -9.414
774 2HB ASN 108 2HB ASN 108 3.237 1.030 -9.909
775 1HD2 ASN 108 1HD2 ASN 108 1.857 2.667 -10.602
776 2HD2 ASN 108 2HD2 ASN 108 2.134 3.528 -12.049
777 H LYS 109 H LYS 109 6.189 2.383 -12.022
778 HA LYS 109 HA LYS 109 8.920 1.856 -11.966
779 1HB LYS 109 1HB LYS 109 7.566 4.502 -12.439
780 2HB LYS 109 2HB LYS 109 7.778 3.242 -13.631
781 1HG LYS 109 1HG LYS 109 10.228 3.522 -13.467
782 2HG LYS 109 2HG LYS 109 9.967 4.829 -12.307
783 1HD LYS 109 1HD LYS 109 8.717 6.078 -13.977
784 2HD LYS 109 2HD LYS 109 8.955 4.777 -15.143
785 1HE LYS 109 1HE LYS 109 11.385 5.109 -14.993
786 2HE LYS 109 2HE LYS 109 11.116 6.449 -13.882
787 1HZ LYS 109 1HZ LYS 109 10.196 6.296 -16.691
788 2HZ LYS 109 2HZ LYS 109 11.440 7.275 -16.116
789 3HZ LYS 109 3HZ LYS 109 9.854 7.571 -15.642
790 H ALA 110 H ALA 110 7.123 3.458 -9.704
791 HA ALA 110 HA ALA 110 9.106 4.964 -8.376
792 1HB ALA 110 1HB ALA 110 6.715 5.336 -8.002
793 2HB ALA 110 2HB ALA 110 7.591 5.121 -6.490
794 3HB ALA 110 3HB ALA 110 6.620 3.801 -7.139
795 H HIS 111 H HIS 111 8.633 1.589 -8.414
796 HA HIS 111 HA HIS 111 9.677 0.983 -5.866
797 1HB HIS 111 1HB HIS 111 8.451 -0.736 -7.220
798 2HB HIS 111 2HB HIS 111 9.945 -1.343 -6.548
799 HD1 HIS 111 1HD HIS 111 8.430 -0.476 -9.917
800 HD2 HIS 111 2HD HIS 111 11.797 -2.326 -8.348
801 HE1 HIS 111 1HE HIS 111 9.525 -1.627 -11.846
802 HE2 HIS 111 2HE HIS 111 11.456 -2.877 -10.852
803 H SER 112 H SER 112 11.451 2.020 -5.268
804 HA SER 112 HA SER 112 13.603 2.493 -4.958
805 1HB SER 112 1HB SER 112 14.079 -0.042 -6.556
806 2HB SER 112 2HB SER 112 13.781 0.015 -4.824
807 HG SER 112 HG SER 112 15.757 1.667 -5.323
Start of MODEL 5
1 1H MET 1 1HT MET 1 -2.788 -19.270 -7.888
2 2H MET 1 2HT MET 1 -2.218 -18.517 -6.524
3 3H MET 1 3HT MET 1 -1.238 -19.653 -7.318
4 HA MET 1 HA MET 1 -0.534 -17.385 -7.737
5 1HB MET 1 1HB MET 1 -0.084 -18.981 -9.503
6 2HB MET 1 2HB MET 1 -0.559 -17.465 -10.235
7 1HG MET 1 1HG MET 1 -2.807 -18.346 -10.606
8 2HG MET 1 2HG MET 1 -2.316 -19.884 -9.901
9 1HE MET 1 1HE MET 1 -2.999 -21.324 -11.963
10 2HE MET 1 2HE MET 1 -2.569 -20.938 -13.626
11 3HE MET 1 3HE MET 1 -3.658 -19.879 -12.730
12 H SER 2 H SER 2 -1.123 -15.546 -9.500
13 HA SER 2 HA SER 2 -2.208 -13.636 -9.718
14 1HB SER 2 1HB SER 2 -4.612 -13.704 -10.225
15 2HB SER 2 2HB SER 2 -4.717 -15.338 -9.569
16 HG SER 2 HG SER 2 -2.959 -14.639 -11.669
17 H PHE 3 H PHE 3 -4.843 -14.894 -7.670
18 HA PHE 3 HA PHE 3 -4.317 -12.768 -5.739
19 1HB PHE 3 1HB PHE 3 -6.545 -13.541 -4.776
20 2HB PHE 3 2HB PHE 3 -6.700 -14.576 -6.180
21 HD1 PHE 3 1HD PHE 3 -7.031 -11.236 -4.902
22 HD2 PHE 3 2HD PHE 3 -6.977 -13.593 -8.437
23 HE1 PHE 3 1HE PHE 3 -8.127 -9.409 -6.123
24 HE2 PHE 3 2HE PHE 3 -8.078 -11.765 -9.669
25 HZ PHE 3 HZ PHE 3 -8.652 -9.673 -8.512
26 H GLU 4 H GLU 4 -2.936 -13.372 -4.251
27 HA GLU 4 HA GLU 4 -3.238 -16.078 -3.191
28 1HB GLU 4 1HB GLU 4 -0.855 -15.956 -2.493
29 2HB GLU 4 2HB GLU 4 -0.722 -14.424 -3.342
30 1HG GLU 4 1HG GLU 4 -1.242 -15.512 -5.442
31 2HG GLU 4 2HG GLU 4 -1.465 -17.048 -4.614
32 H LYS 5 H LYS 5 -3.008 -16.431 -1.041
33 HA LYS 5 HA LYS 5 -4.188 -14.501 0.667
34 1HB LYS 5 1HB LYS 5 -2.722 -17.070 1.297
35 2HB LYS 5 2HB LYS 5 -4.422 -16.930 0.863
36 1HG LYS 5 1HG LYS 5 -4.284 -17.349 3.217
37 2HG LYS 5 2HG LYS 5 -4.896 -15.725 2.943
38 1HD LYS 5 1HD LYS 5 -2.825 -14.739 3.517
39 2HD LYS 5 2HD LYS 5 -2.024 -16.307 3.583
40 1HE LYS 5 1HE LYS 5 -2.507 -15.465 5.817
41 2HE LYS 5 2HE LYS 5 -3.381 -16.950 5.477
42 1HZ LYS 5 1HZ LYS 5 -5.399 -15.719 5.144
43 2HZ LYS 5 2HZ LYS 5 -4.569 -14.252 5.273
44 3HZ LYS 5 3HZ LYS 5 -4.707 -15.234 6.611
45 H ILE 6 H ILE 6 -3.185 -12.897 1.456
46 HA ILE 6 HA ILE 6 -0.256 -13.018 1.679
47 HB ILE 6 HB ILE 6 -1.085 -11.404 0.056
48 1HG1 ILE 6 1HG1 ILE 6 0.213 -10.102 2.452
49 2HG1 ILE 6 2HG1 ILE 6 0.138 -9.406 0.837
50 1HG2 ILE 6 1HG2 ILE 6 -2.416 -10.055 2.364
51 2HG2 ILE 6 2HG2 ILE 6 -3.195 -10.827 0.986
52 3HG2 ILE 6 3HG2 ILE 6 -2.240 -9.349 0.753
53 1HD1 ILE 6 1HD1 ILE 6 2.310 -10.412 1.240
54 2HD1 ILE 6 2HD1 ILE 6 1.453 -11.281 -0.034
55 3HD1 ILE 6 3HD1 ILE 6 1.544 -11.959 1.592
56 H CYS 7 H CYS 7 -3.147 -11.923 3.244
57 HA CYS 7 HA CYS 7 -1.752 -12.026 5.838
58 1HB CYS 7 1HB CYS 7 -2.515 -9.889 6.524
59 2HB CYS 7 2HB CYS 7 -3.449 -9.668 5.070
60 HG CYS 7 HG CYS 7 -0.230 -10.195 4.505
61 H SER 8 H SER 8 -3.294 -11.732 7.606
62 HA SER 8 HA SER 8 -6.047 -12.401 6.962
63 1HB SER 8 1HB SER 8 -6.220 -13.501 9.071
64 2HB SER 8 2HB SER 8 -4.632 -13.079 9.605
65 HG SER 8 HG SER 8 -4.739 -15.197 8.869
66 H LEU 9 H LEU 9 -7.510 -11.301 8.317
67 HA LEU 9 HA LEU 9 -7.039 -8.542 8.442
68 1HB LEU 9 1HB LEU 9 -9.068 -10.091 9.979
69 2HB LEU 9 2HB LEU 9 -9.189 -9.763 8.281
70 HG LEU 9 HG LEU 9 -9.187 -7.722 10.526
71 1HD1 LEU 9 1HD1 LEU 9 -8.179 -6.780 8.508
72 2HD1 LEU 9 2HD1 LEU 9 -9.767 -6.071 8.795
73 3HD1 LEU 9 3HD1 LEU 9 -9.567 -7.310 7.557
74 1HD2 LEU 9 1HD2 LEU 9 -11.229 -9.022 10.425
75 2HD2 LEU 9 2HD2 LEU 9 -11.404 -8.632 8.713
76 3HD2 LEU 9 3HD2 LEU 9 -11.515 -7.357 9.928
77 H ASP 10 H ASP 10 -6.305 -10.909 10.702
78 HA ASP 10 HA ASP 10 -6.020 -9.235 13.053
79 1HB ASP 10 1HB ASP 10 -4.736 -11.921 12.506
80 2HB ASP 10 2HB ASP 10 -6.339 -11.702 13.197
81 H ASP 11 H ASP 11 -4.025 -9.923 10.309
82 HA ASP 11 HA ASP 11 -1.514 -9.027 11.493
83 1HB ASP 11 1HB ASP 11 -0.656 -9.124 9.145
84 2HB ASP 11 2HB ASP 11 -2.271 -9.505 8.592
85 H ILE 12 H ILE 12 -4.107 -7.843 9.555
86 HA ILE 12 HA ILE 12 -2.885 -5.208 9.458
87 HB ILE 12 HB ILE 12 -2.551 -5.974 7.402
88 1HG1 ILE 12 1HG1 ILE 12 -5.152 -4.484 7.161
89 2HG1 ILE 12 2HG1 ILE 12 -4.050 -4.775 5.836
90 1HG2 ILE 12 1HG2 ILE 12 -5.332 -7.118 7.286
91 2HG2 ILE 12 2HG2 ILE 12 -3.813 -8.009 7.386
92 3HG2 ILE 12 3HG2 ILE 12 -4.213 -7.109 5.922
93 1HD1 ILE 12 1HD1 ILE 12 -3.741 -2.532 6.747
94 2HD1 ILE 12 2HD1 ILE 12 -2.294 -3.520 6.959
95 3HD1 ILE 12 3HD1 ILE 12 -3.370 -3.227 8.324
96 H TRP 13 H TRP 13 -3.951 -3.838 10.448
97 HA TRP 13 HA TRP 13 -6.785 -4.242 11.055
98 1HB TRP 13 1HB TRP 13 -6.321 -2.684 12.963
99 2HB TRP 13 2HB TRP 13 -4.635 -2.706 12.472
100 HD1 TRP 13 HD TRP 13 -3.501 -5.292 12.403
101 HE1 TRP 13 1HE TRP 13 -3.775 -7.149 14.146
102 HE3 TRP 13 3HE TRP 13 -7.768 -3.641 14.681
103 HZ2 TRP 13 2HZ TRP 13 -5.551 -7.826 16.226
104 HZ3 TRP 13 3HZ TRP 13 -8.685 -4.957 16.547
105 HH2 TRP 13 HH TRP 13 -7.596 -7.004 17.300
106 H VAL 14 H VAL 14 -7.977 -2.204 11.484
107 HA VAL 14 HA VAL 14 -8.047 -0.630 9.123
108 HB VAL 14 HB VAL 14 -9.470 -0.127 11.752
109 1HG1 VAL 14 1HG1 VAL 14 -11.102 1.098 10.383
110 2HG1 VAL 14 2HG1 VAL 14 -10.096 0.831 8.960
111 3HG1 VAL 14 3HG1 VAL 14 -9.492 1.813 10.294
112 1HG2 VAL 14 1HG2 VAL 14 -9.965 -2.367 10.917
113 2HG2 VAL 14 2HG2 VAL 14 -10.395 -1.696 9.344
114 3HG2 VAL 14 3HG2 VAL 14 -11.372 -1.316 10.764
115 H GLY 15 H GLY 15 -6.892 1.111 8.670
116 1HA GLY 15 1HA GLY 15 -6.067 2.915 10.827
117 2HA GLY 15 2HA GLY 15 -6.118 3.299 9.108
118 H GLU 16 H GLU 16 -4.887 0.257 9.583
119 HA GLU 16 HA GLU 16 -2.157 1.220 9.828
120 1HB GLU 16 1HB GLU 16 -1.685 -1.285 10.249
121 2HB GLU 16 2HB GLU 16 -3.419 -1.424 10.376
122 1HG GLU 16 1HG GLU 16 -3.508 0.060 12.228
123 2HG GLU 16 2HG GLU 16 -1.787 0.426 12.077
124 H MET 17 H MET 17 -0.536 0.194 8.610
125 HA MET 17 HA MET 17 -1.254 -1.233 6.230
126 1HB MET 17 1HB MET 17 -1.475 1.052 5.464
127 2HB MET 17 2HB MET 17 -0.062 0.287 4.751
128 1HG MET 17 1HG MET 17 1.402 1.471 6.271
129 2HG MET 17 2HG MET 17 0.003 2.221 7.043
130 1HE MET 17 1HE MET 17 1.700 5.181 5.080
131 2HE MET 17 2HE MET 17 2.529 3.828 5.838
132 3HE MET 17 3HE MET 17 1.174 4.607 6.663
133 H GLU 18 H GLU 18 0.423 -2.522 5.563
134 HA GLU 18 HA GLU 18 3.050 -1.942 6.511
135 1HB GLU 18 1HB GLU 18 1.609 -4.371 7.560
136 2HB GLU 18 2HB GLU 18 2.249 -2.996 8.478
137 1HG GLU 18 1HG GLU 18 4.512 -3.623 7.905
138 2HG GLU 18 2HG GLU 18 3.918 -5.019 7.019
139 H THR 19 H THR 19 4.709 -3.368 5.584
140 HA THR 19 HA THR 19 3.839 -4.237 2.985
141 HB THR 19 HB THR 19 6.623 -3.872 4.113
142 HG1 THR 19 1HG THR 19 5.063 -2.324 2.312
143 1HG2 THR 19 1HG2 THR 19 5.688 -4.372 1.277
144 2HG2 THR 19 2HG2 THR 19 6.582 -5.515 2.278
145 3HG2 THR 19 3HG2 THR 19 7.346 -4.013 1.750
146 H PHE 20 H PHE 20 3.753 -6.209 2.380
147 HA PHE 20 HA PHE 20 4.977 -8.332 3.991
148 1HB PHE 20 1HB PHE 20 3.010 -9.759 3.379
149 2HB PHE 20 2HB PHE 20 2.273 -8.372 2.623
150 HD1 PHE 20 1HD PHE 20 1.616 -6.379 4.095
151 HD2 PHE 20 2HD PHE 20 2.728 -10.166 5.688
152 HE1 PHE 20 1HE PHE 20 0.505 -5.808 6.197
153 HE2 PHE 20 2HE PHE 20 1.612 -9.581 7.812
154 HZ PHE 20 HZ PHE 20 0.502 -7.403 8.059
155 H GLU 21 H GLU 21 5.599 -10.136 2.648
156 HA GLU 21 HA GLU 21 5.963 -9.259 -0.128
157 1HB GLU 21 1HB GLU 21 7.649 -11.293 1.355
158 2HB GLU 21 2HB GLU 21 8.072 -9.597 1.155
159 1HG GLU 21 1HG GLU 21 8.077 -9.904 -1.283
160 2HG GLU 21 2HG GLU 21 7.696 -11.606 -1.061
161 H THR 22 H THR 22 5.370 -10.505 -1.757
162 HA THR 22 HA THR 22 3.417 -12.515 -1.132
163 HB THR 22 HB THR 22 2.863 -12.410 -3.482
164 HG1 THR 22 1HG THR 22 4.131 -11.029 -4.815
165 1HG2 THR 22 1HG2 THR 22 2.060 -10.562 -2.050
166 2HG2 THR 22 2HG2 THR 22 2.404 -10.010 -3.701
167 3HG2 THR 22 3HG2 THR 22 3.549 -9.676 -2.413
168 H SER 23 H SER 23 3.485 -14.392 -2.994
169 HA SER 23 HA SER 23 5.602 -16.069 -2.211
170 1HB SER 23 1HB SER 23 4.532 -17.656 -3.659
171 2HB SER 23 2HB SER 23 3.601 -16.352 -4.398
172 HG SER 23 HG SER 23 2.233 -16.980 -2.952
173 H ASP 24 H ASP 24 5.017 -14.041 -4.990
174 HA ASP 24 HA ASP 24 7.104 -15.278 -6.569
175 1HB ASP 24 1HB ASP 24 5.598 -12.707 -7.052
176 2HB ASP 24 2HB ASP 24 5.054 -14.289 -7.596
177 H GLY 25 H GLY 25 6.942 -13.015 -4.115
178 1HA GLY 25 1HA GLY 25 9.700 -12.177 -4.676
179 2HA GLY 25 2HA GLY 25 8.929 -12.161 -3.097
180 H THR 26 H THR 26 6.482 -10.942 -4.497
181 HA THR 26 HA THR 26 7.451 -8.306 -5.185
182 HB THR 26 HB THR 26 4.581 -9.228 -4.873
183 HG1 THR 26 1HG THR 26 6.481 -9.700 -6.861
184 1HG2 THR 26 1HG2 THR 26 4.955 -6.800 -5.071
185 2HG2 THR 26 2HG2 THR 26 4.142 -7.435 -6.500
186 3HG2 THR 26 3HG2 THR 26 5.865 -7.062 -6.560
187 H GLU 27 H GLU 27 7.707 -6.782 -3.663
188 HA GLU 27 HA GLU 27 6.606 -7.241 -1.012
189 1HB GLU 27 1HB GLU 27 8.043 -5.364 -0.352
190 2HB GLU 27 2HB GLU 27 8.398 -5.025 -2.041
191 1HG GLU 27 1HG GLU 27 9.485 -7.216 -2.236
192 2HG GLU 27 2HG GLU 27 9.151 -7.529 -0.539
193 H VAL 28 H VAL 28 4.746 -6.309 -0.398
194 HA VAL 28 HA VAL 28 3.760 -4.015 -1.955
195 HB VAL 28 HB VAL 28 2.106 -6.433 -1.154
196 1HG1 VAL 28 1HG1 VAL 28 0.311 -5.468 -2.506
197 2HG1 VAL 28 2HG1 VAL 28 1.301 -4.033 -2.770
198 3HG1 VAL 28 3HG1 VAL 28 0.758 -4.442 -1.143
199 1HG2 VAL 28 1HG2 VAL 28 3.036 -5.615 -3.906
200 2HG2 VAL 28 2HG2 VAL 28 1.914 -6.929 -3.560
201 3HG2 VAL 28 3HG2 VAL 28 3.581 -7.019 -2.990
202 H LEU 29 H LEU 29 2.470 -2.605 -0.808
203 HA LEU 29 HA LEU 29 2.542 -2.771 2.121
204 1HB LEU 29 1HB LEU 29 1.828 -0.552 0.195
205 2HB LEU 29 2HB LEU 29 3.353 -0.729 1.038
206 HG LEU 29 HG LEU 29 0.695 -0.212 2.360
207 1HD1 LEU 29 1HD1 LEU 29 2.192 -1.454 3.780
208 2HD1 LEU 29 2HD1 LEU 29 2.038 0.210 4.342
209 3HD1 LEU 29 3HD1 LEU 29 3.479 -0.296 3.454
210 1HD2 LEU 29 1HD2 LEU 29 3.024 1.597 1.833
211 2HD2 LEU 29 2HD2 LEU 29 1.610 2.002 2.809
212 3HD2 LEU 29 3HD2 LEU 29 1.434 1.700 1.077
213 H ILE 30 H ILE 30 0.753 -3.713 2.950
214 HA ILE 30 HA ILE 30 -1.767 -3.418 1.531
215 HB ILE 30 HB ILE 30 -1.033 -5.258 3.853
216 1HG1 ILE 30 1HG1 ILE 30 -1.787 -5.818 0.991
217 2HG1 ILE 30 2HG1 ILE 30 -1.653 -7.078 2.218
218 1HG2 ILE 30 1HG2 ILE 30 -3.693 -5.007 2.455
219 2HG2 ILE 30 2HG2 ILE 30 -3.322 -4.427 4.066
220 3HG2 ILE 30 3HG2 ILE 30 -3.295 -6.165 3.732
221 1HD1 ILE 30 1HD1 ILE 30 0.713 -6.662 2.439
222 2HD1 ILE 30 2HD1 ILE 30 0.614 -5.365 1.252
223 3HD1 ILE 30 3HD1 ILE 30 0.297 -7.030 0.766
224 H VAL 31 H VAL 31 -3.052 -1.853 2.073
225 HA VAL 31 HA VAL 31 -2.818 -0.584 4.722
226 HB VAL 31 HB VAL 31 -3.942 0.541 2.155
227 1HG1 VAL 31 1HG1 VAL 31 -3.756 2.715 3.260
228 2HG1 VAL 31 2HG1 VAL 31 -3.232 1.910 4.739
229 3HG1 VAL 31 3HG1 VAL 31 -4.847 1.615 4.099
230 1HG2 VAL 31 1HG2 VAL 31 -1.901 1.860 1.935
231 2HG2 VAL 31 2HG2 VAL 31 -1.562 0.131 1.849
232 3HG2 VAL 31 3HG2 VAL 31 -1.207 1.032 3.323
233 H ASN 32 H ASN 32 -4.641 -0.814 5.972
234 HA ASN 32 HA ASN 32 -7.136 -1.396 4.519
235 1HB ASN 32 1HB ASN 32 -6.435 -2.078 7.395
236 2HB ASN 32 2HB ASN 32 -6.531 -3.217 6.056
237 1HD2 ASN 32 1HD2 ASN 32 -7.982 -3.359 8.482
238 2HD2 ASN 32 2HD2 ASN 32 -9.663 -3.285 8.091
239 H SER 33 H SER 33 -8.174 0.349 4.200
240 HA SER 33 HA SER 33 -7.942 2.576 6.038
241 1HB SER 33 1HB SER 33 -8.921 3.834 4.182
242 2HB SER 33 2HB SER 33 -9.087 2.344 3.258
243 HG SER 33 HG SER 33 -6.723 3.530 4.205
244 H GLU 34 H GLU 34 -9.756 3.613 6.838
245 HA GLU 34 HA GLU 34 -11.911 1.931 7.600
246 1HB GLU 34 1HB GLU 34 -11.597 4.938 7.826
247 2HB GLU 34 2HB GLU 34 -10.924 3.799 8.964
248 1HG GLU 34 1HG GLU 34 -12.807 4.710 9.999
249 2HG GLU 34 2HG GLU 34 -13.247 3.079 9.528
250 H GLU 35 H GLU 35 -11.639 4.729 5.439
251 HA GLU 35 HA GLU 35 -14.375 4.387 4.549
252 1HB GLU 35 1HB GLU 35 -12.266 6.417 3.821
253 2HB GLU 35 2HB GLU 35 -13.546 6.632 4.996
254 1HG GLU 35 1HG GLU 35 -15.212 6.559 3.265
255 2HG GLU 35 2HG GLU 35 -13.976 6.215 2.056
256 H HIS 36 H HIS 36 -11.108 3.931 3.296
257 HA HIS 36 HA HIS 36 -12.205 3.485 0.611
258 1HB HIS 36 1HB HIS 36 -9.914 3.572 -0.231
259 2HB HIS 36 2HB HIS 36 -9.286 3.641 1.412
260 HD1 HIS 36 1HD HIS 36 -8.165 5.951 0.798
261 HD2 HIS 36 2HD HIS 36 -12.309 5.918 0.609
262 HE1 HIS 36 1HE HIS 36 -8.874 8.356 0.899
263 HE2 HIS 36 2HE HIS 36 -11.394 8.217 1.131
264 H GLY 37 H GLY 37 -11.757 1.536 3.166
265 1HA GLY 37 1HA GLY 37 -11.852 -0.825 1.551
266 2HA GLY 37 2HA GLY 37 -11.833 -0.763 3.309
267 H VAL 38 H VAL 38 -10.384 -2.667 1.838
268 HA VAL 38 HA VAL 38 -7.712 -2.014 2.760
269 HB VAL 38 HB VAL 38 -8.647 -4.628 1.552
270 1HG1 VAL 38 1HG1 VAL 38 -6.294 -3.983 3.321
271 2HG1 VAL 38 2HG1 VAL 38 -6.234 -4.319 1.598
272 3HG1 VAL 38 3HG1 VAL 38 -6.719 -5.588 2.726
273 1HG2 VAL 38 1HG2 VAL 38 -8.591 -3.851 4.468
274 2HG2 VAL 38 2HG2 VAL 38 -8.915 -5.472 3.849
275 3HG2 VAL 38 3HG2 VAL 38 -10.034 -4.152 3.498
276 H LYS 39 H LYS 39 -6.232 -1.300 1.462
277 HA LYS 39 HA LYS 39 -6.450 -1.791 -1.434
278 1HB LYS 39 1HB LYS 39 -5.373 0.377 -1.777
279 2HB LYS 39 2HB LYS 39 -5.332 0.649 -0.048
280 1HG LYS 39 1HG LYS 39 -7.815 0.646 -0.026
281 2HG LYS 39 2HG LYS 39 -7.804 0.482 -1.780
282 1HD LYS 39 1HD LYS 39 -6.614 2.771 -0.207
283 2HD LYS 39 2HD LYS 39 -8.137 2.810 -1.090
284 1HE LYS 39 1HE LYS 39 -5.417 2.372 -2.357
285 2HE LYS 39 2HE LYS 39 -6.299 3.891 -2.346
286 1HZ LYS 39 1HZ LYS 39 -7.331 1.402 -3.586
287 2HZ LYS 39 2HZ LYS 39 -6.549 2.596 -4.428
288 3HZ LYS 39 3HZ LYS 39 -8.025 2.932 -3.677
289 H ALA 40 H ALA 40 -4.600 -2.553 -2.349
290 HA ALA 40 HA ALA 40 -2.193 -2.573 -0.672
291 1HB ALA 40 1HB ALA 40 -1.607 -4.767 -1.572
292 2HB ALA 40 2HB ALA 40 -3.094 -4.786 -2.515
293 3HB ALA 40 3HB ALA 40 -3.168 -4.828 -0.754
294 H TYR 41 H TYR 41 -0.490 -1.710 -1.587
295 HA TYR 41 HA TYR 41 -0.282 -1.709 -4.450
296 1HB TYR 41 1HB TYR 41 -1.448 0.357 -4.213
297 2HB TYR 41 2HB TYR 41 0.228 0.766 -4.517
298 HD1 TYR 41 1HD TYR 41 -2.489 0.913 -2.119
299 HD2 TYR 41 2HD TYR 41 1.625 1.741 -2.771
300 HE1 TYR 41 1HE TYR 41 -2.483 2.378 -0.154
301 HE2 TYR 41 2HE TYR 41 1.647 3.206 -0.802
302 HH TYR 41 HH TYR 41 -0.831 3.250 1.480
303 H GLN 42 H GLN 42 1.824 -0.925 -5.233
304 HA GLN 42 HA GLN 42 4.019 -2.200 -4.228
305 1HB GLN 42 1HB GLN 42 3.861 0.438 -5.757
306 2HB GLN 42 2HB GLN 42 4.001 -1.175 -6.385
307 1HG GLN 42 1HG GLN 42 6.155 0.132 -4.786
308 2HG GLN 42 2HG GLN 42 6.072 0.101 -6.545
309 1HE2 GLN 42 1HE2 GLN 42 6.359 -1.785 -7.624
310 2HE2 GLN 42 2HE2 GLN 42 7.074 -3.176 -6.924
311 H ALA 43 H ALA 43 5.594 -1.801 -2.691
312 HA ALA 43 HA ALA 43 4.809 0.237 -0.711
313 1HB ALA 43 1HB ALA 43 4.691 -2.081 -0.002
314 2HB ALA 43 2HB ALA 43 5.842 -1.142 0.950
315 3HB ALA 43 3HB ALA 43 6.420 -2.248 -0.295
316 H MET 44 H MET 44 7.566 -0.994 -2.407
317 HA MET 44 HA MET 44 9.276 0.806 -0.918
318 1HB MET 44 1HB MET 44 11.118 -0.132 -2.453
319 2HB MET 44 2HB MET 44 9.924 -1.330 -2.933
320 1HG MET 44 1HG MET 44 11.016 -0.862 -0.165
321 2HG MET 44 2HG MET 44 11.338 -2.237 -1.210
322 1HE MET 44 1HE MET 44 10.417 -2.381 1.853
323 2HE MET 44 2HE MET 44 10.830 -3.781 0.872
324 3HE MET 44 3HE MET 44 9.318 -3.757 1.775
325 H CYS 45 H CYS 45 9.756 2.795 -1.425
326 HA CYS 45 HA CYS 45 9.098 3.680 -4.109
327 1HB CYS 45 1HB CYS 45 9.808 5.386 -1.685
328 2HB CYS 45 2HB CYS 45 8.160 4.919 -2.095
329 HA PRO 46 HA PRO 46 13.620 3.741 -4.750
330 1HB PRO 46 1HB PRO 46 12.974 2.300 -6.497
331 2HB PRO 46 2HB PRO 46 13.605 3.710 -7.365
332 1HG PRO 46 1HG PRO 46 11.172 2.774 -7.847
333 2HG PRO 46 2HG PRO 46 11.478 4.525 -7.823
334 1HD PRO 46 1HD PRO 46 9.988 2.847 -5.890
335 2HD PRO 46 2HD PRO 46 9.890 4.600 -6.161
336 H HIS 47 H HIS 47 11.505 6.085 -4.821
337 HA HIS 47 HA HIS 47 12.772 7.966 -6.529
338 1HB HIS 47 1HB HIS 47 10.872 8.481 -4.229
339 2HB HIS 47 2HB HIS 47 10.342 8.022 -5.839
340 HD2 HIS 47 2HD HIS 47 12.313 10.096 -7.480
341 HE1 HIS 47 1HE HIS 47 10.056 12.990 -5.420
342 HE2 HIS 47 2HE HIS 47 11.451 12.496 -7.452
343 H GLN 48 H GLN 48 12.506 7.810 -2.922
344 HA GLN 48 HA GLN 48 15.377 8.092 -2.954
345 1HB GLN 48 1HB GLN 48 13.563 9.748 -1.206
346 2HB GLN 48 2HB GLN 48 14.587 10.328 -2.517
347 1HG GLN 48 1HG GLN 48 16.567 9.565 -1.257
348 2HG GLN 48 2HG GLN 48 15.505 9.115 0.077
349 1HE2 GLN 48 1HE2 GLN 48 16.899 11.709 -1.688
350 2HE2 GLN 48 2HE2 GLN 48 16.500 12.959 -0.572
351 H GLU 49 H GLU 49 12.690 7.577 -0.613
352 HA GLU 49 HA GLU 49 14.445 5.521 0.571
353 1HB GLU 49 1HB GLU 49 12.750 7.510 2.087
354 2HB GLU 49 2HB GLU 49 14.484 7.615 1.886
355 1HG GLU 49 1HG GLU 49 12.998 5.480 3.383
356 2HG GLU 49 2HG GLU 49 13.923 6.810 4.082
357 H ILE 50 H ILE 50 13.426 3.907 1.850
358 HA ILE 50 HA ILE 50 10.703 3.237 0.989
359 HB ILE 50 HB ILE 50 11.314 0.868 1.455
360 1HG1 ILE 50 1HG1 ILE 50 13.095 1.348 3.127
361 2HG1 ILE 50 2HG1 ILE 50 14.114 1.944 1.828
362 1HG2 ILE 50 1HG2 ILE 50 13.144 2.295 -0.459
363 2HG2 ILE 50 2HG2 ILE 50 11.508 1.726 -0.796
364 3HG2 ILE 50 3HG2 ILE 50 12.798 0.567 -0.472
365 1HD1 ILE 50 1HD1 ILE 50 14.726 -0.324 2.456
366 2HD1 ILE 50 2HD1 ILE 50 14.118 -0.260 0.799
367 3HD1 ILE 50 3HD1 ILE 50 13.090 -0.872 2.093
368 H LEU 51 H LEU 51 10.354 1.147 3.002
369 HA LEU 51 HA LEU 51 9.535 0.851 5.062
370 1HB LEU 51 1HB LEU 51 10.207 2.590 6.938
371 2HB LEU 51 2HB LEU 51 11.383 3.129 5.766
372 HG LEU 51 HG LEU 51 12.369 1.629 7.417
373 1HD1 LEU 51 1HD1 LEU 51 10.439 0.287 7.951
374 2HD1 LEU 51 2HD1 LEU 51 11.805 -0.724 7.499
375 3HD1 LEU 51 3HD1 LEU 51 10.491 -0.467 6.355
376 1HD2 LEU 51 1HD2 LEU 51 13.478 0.065 5.911
377 2HD2 LEU 51 2HD2 LEU 51 13.333 1.660 5.166
378 3HD2 LEU 51 3HD2 LEU 51 12.238 0.356 4.694
379 H LEU 52 H LEU 52 8.334 2.303 3.073
380 HA LEU 52 HA LEU 52 6.721 4.453 3.874
381 1HB LEU 52 1HB LEU 52 6.266 2.193 1.943
382 2HB LEU 52 2HB LEU 52 6.904 3.782 1.584
383 HG LEU 52 HG LEU 52 4.069 3.205 2.425
384 1HD1 LEU 52 1HD1 LEU 52 4.809 5.380 3.140
385 2HD1 LEU 52 2HD1 LEU 52 3.635 5.490 1.822
386 3HD1 LEU 52 3HD1 LEU 52 5.364 5.723 1.496
387 1HD2 LEU 52 1HD2 LEU 52 4.556 2.353 0.210
388 2HD2 LEU 52 2HD2 LEU 52 5.237 3.912 -0.250
389 3HD2 LEU 52 3HD2 LEU 52 3.519 3.776 0.123
390 H SER 53 H SER 53 6.544 1.064 4.483
391 HA SER 53 HA SER 53 3.882 0.769 5.236
392 1HB SER 53 1HB SER 53 5.337 -0.952 4.515
393 2HB SER 53 2HB SER 53 4.781 -1.408 6.076
394 HG SER 53 HG SER 53 6.963 -1.620 6.230
395 H GLU 54 H GLU 54 6.700 1.883 6.890
396 HA GLU 54 HA GLU 54 5.186 2.170 9.376
397 1HB GLU 54 1HB GLU 54 8.206 2.264 9.024
398 2HB GLU 54 2HB GLU 54 7.322 0.801 9.433
399 1HG GLU 54 1HG GLU 54 6.509 1.903 11.486
400 2HG GLU 54 2HG GLU 54 7.488 3.310 11.091
401 H GLY 55 H GLY 55 5.199 3.857 6.876
402 1HA GLY 55 1HA GLY 55 5.429 6.067 6.245
403 2HA GLY 55 2HA GLY 55 6.404 6.353 7.686
404 H SER 56 H SER 56 3.664 7.416 6.329
405 HA SER 56 HA SER 56 2.151 7.229 8.786
406 1HB SER 56 1HB SER 56 2.866 9.851 7.511
407 2HB SER 56 2HB SER 56 3.450 9.178 9.057
408 HG SER 56 HG SER 56 1.387 10.703 8.703
409 H TYR 57 H TYR 57 0.138 7.864 8.668
410 HA TYR 57 HA TYR 57 -1.263 7.633 6.040
411 1HB TYR 57 1HB TYR 57 -1.731 5.990 8.538
412 2HB TYR 57 2HB TYR 57 -1.162 5.388 6.991
413 HD1 TYR 57 1HD TYR 57 -2.716 5.294 5.048
414 HD2 TYR 57 2HD TYR 57 -4.065 6.255 8.961
415 HE1 TYR 57 1HE TYR 57 -5.024 4.776 4.377
416 HE2 TYR 57 2HE TYR 57 -6.374 5.744 8.303
417 HH TYR 57 HH TYR 57 -7.690 5.619 6.326
418 H GLU 58 H GLU 58 -2.677 9.112 5.751
419 HA GLU 58 HA GLU 58 -4.090 10.093 8.088
420 1HB GLU 58 1HB GLU 58 -4.618 12.118 6.693
421 2HB GLU 58 2HB GLU 58 -3.523 11.501 5.462
422 1HG GLU 58 1HG GLU 58 -1.660 11.652 7.018
423 2HG GLU 58 2HG GLU 58 -2.749 12.213 8.285
424 H GLY 59 H GLY 59 -6.387 10.829 7.353
425 1HA GLY 59 1HA GLY 59 -8.448 10.259 6.471
426 2HA GLY 59 2HA GLY 59 -7.933 8.642 6.909
427 H GLY 60 H GLY 60 -6.875 10.806 4.293
428 1HA GLY 60 1HA GLY 60 -7.983 10.093 2.078
429 2HA GLY 60 2HA GLY 60 -7.288 8.529 2.483
430 H VAL 61 H VAL 61 -4.896 10.199 3.674
431 HA VAL 61 HA VAL 61 -3.628 10.567 1.070
432 HB VAL 61 HB VAL 61 -3.072 12.335 3.483
433 1HG1 VAL 61 1HG1 VAL 61 -2.215 12.580 0.606
434 2HG1 VAL 61 2HG1 VAL 61 -1.198 12.062 1.942
435 3HG1 VAL 61 3HG1 VAL 61 -1.825 13.714 1.898
436 1HG2 VAL 61 1HG2 VAL 61 -4.671 13.012 1.015
437 2HG2 VAL 61 2HG2 VAL 61 -4.215 14.148 2.285
438 3HG2 VAL 61 3HG2 VAL 61 -5.315 12.815 2.643
439 H ILE 62 H ILE 62 -1.523 9.771 0.971
440 HA ILE 62 HA ILE 62 -0.679 8.355 3.436
441 HB ILE 62 HB ILE 62 0.160 7.541 0.612
442 1HG1 ILE 62 1HG1 ILE 62 -1.472 5.737 0.735
443 2HG1 ILE 62 2HG1 ILE 62 -2.282 7.285 0.863
444 1HG2 ILE 62 1HG2 ILE 62 0.378 6.087 3.226
445 2HG2 ILE 62 2HG2 ILE 62 1.695 6.851 2.341
446 3HG2 ILE 62 3HG2 ILE 62 0.851 5.464 1.644
447 1HD1 ILE 62 1HD1 ILE 62 -2.494 6.999 3.274
448 2HD1 ILE 62 2HD1 ILE 62 -1.655 5.450 3.160
449 3HD1 ILE 62 3HD1 ILE 62 -3.233 5.658 2.397
450 H THR 63 H THR 63 1.439 8.600 4.162
451 HA THR 63 HA THR 63 2.923 10.820 2.941
452 HB THR 63 HB THR 63 3.229 9.418 5.587
453 HG1 THR 63 1HG THR 63 1.351 10.991 4.797
454 1HG2 THR 63 1HG2 THR 63 4.547 11.407 6.240
455 2HG2 THR 63 2HG2 THR 63 4.403 12.029 4.595
456 3HG2 THR 63 3HG2 THR 63 5.290 10.538 4.897
457 H CYS 64 H CYS 64 4.610 10.133 1.480
458 HA CYS 64 HA CYS 64 5.766 7.553 1.759
459 1HB CYS 64 1HB CYS 64 7.045 9.943 0.277
460 2HB CYS 64 2HB CYS 64 5.961 8.761 -0.477
461 H ARG 65 H ARG 65 7.559 6.889 2.837
462 HA ARG 65 HA ARG 65 8.031 7.972 5.330
463 1HB ARG 65 1HB ARG 65 9.851 6.195 3.704
464 2HB ARG 65 2HB ARG 65 8.581 5.670 4.792
465 1HG ARG 65 1HG ARG 65 11.075 7.138 5.643
466 2HG ARG 65 2HG ARG 65 10.843 5.399 5.747
467 1HD ARG 65 1HD ARG 65 8.989 5.709 7.305
468 2HD ARG 65 2HD ARG 65 9.180 7.462 7.191
469 HE ARG 65 HE ARG 65 11.624 6.653 7.920
470 1HH1 ARG 65 1HH1 ARG 65 8.433 5.925 9.365
471 2HH1 ARG 65 2HH1 ARG 65 9.049 5.810 10.942
472 1HH2 ARG 65 1HH2 ARG 65 12.429 6.437 10.135
473 2HH2 ARG 65 2HH2 ARG 65 11.333 6.065 11.382
474 H ALA 66 H ALA 66 8.675 9.925 5.708
475 HA ALA 66 HA ALA 66 9.920 11.749 5.948
476 1HB ALA 66 1HB ALA 66 12.345 11.614 5.757
477 2HB ALA 66 2HB ALA 66 12.208 10.090 4.869
478 3HB ALA 66 3HB ALA 66 11.699 10.181 6.550
479 H HIS 67 H HIS 67 8.721 10.986 3.151
480 HA HIS 67 HA HIS 67 9.952 13.332 1.955
481 1HB HIS 67 1HB HIS 67 9.142 10.973 0.183
482 2HB HIS 67 2HB HIS 67 10.801 11.264 0.735
483 HD2 HIS 67 2HD HIS 67 11.058 14.368 0.312
484 HE1 HIS 67 1HE HIS 67 9.736 13.873 -3.634
485 HE2 HIS 67 2HE HIS 67 10.961 15.335 -2.031
486 H LEU 68 H LEU 68 8.447 14.764 2.359
487 HA LEU 68 HA LEU 68 6.577 15.950 2.276
488 1HB LEU 68 1HB LEU 68 4.858 15.299 0.360
489 2HB LEU 68 2HB LEU 68 6.175 14.288 -0.171
490 HG LEU 68 HG LEU 68 6.110 16.411 -1.382
491 1HD1 LEU 68 1HD1 LEU 68 6.586 17.730 1.277
492 2HD1 LEU 68 2HD1 LEU 68 5.117 17.812 0.309
493 3HD1 LEU 68 3HD1 LEU 68 6.612 18.520 -0.298
494 1HD2 LEU 68 1HD2 LEU 68 8.495 16.232 0.448
495 2HD2 LEU 68 2HD2 LEU 68 8.423 17.092 -1.098
496 3HD2 LEU 68 3HD2 LEU 68 8.279 15.338 -1.056
497 H TRP 69 H TRP 69 3.925 15.482 1.779
498 HA TRP 69 HA TRP 69 3.177 13.609 3.925
499 1HB TRP 69 1HB TRP 69 3.182 15.881 4.815
500 2HB TRP 69 2HB TRP 69 1.522 15.337 4.614
501 HD1 TRP 69 HD TRP 69 4.083 17.709 2.987
502 HE1 TRP 69 1HE TRP 69 2.835 19.507 1.637
503 HE3 TRP 69 3HE TRP 69 -0.676 15.917 3.476
504 HZ2 TRP 69 2HZ TRP 69 0.189 20.089 0.889
505 HZ3 TRP 69 3HZ TRP 69 -2.516 17.168 2.405
506 HH2 TRP 69 HH TRP 69 -2.090 19.203 1.145
507 H THR 70 H THR 70 3.098 13.853 0.809
508 HA THR 70 HA THR 70 0.205 13.676 0.440
509 HB THR 70 HB THR 70 1.184 14.315 -1.938
510 HG1 THR 70 1HG THR 70 3.202 14.811 -1.578
511 1HG2 THR 70 1HG2 THR 70 -0.682 15.437 -0.787
512 2HG2 THR 70 2HG2 THR 70 0.439 16.636 -1.436
513 3HG2 THR 70 3HG2 THR 70 0.458 16.249 0.285
514 H PHE 71 H PHE 71 -0.483 11.813 -0.340
515 HA PHE 71 HA PHE 71 0.815 10.552 -2.683
516 1HB PHE 71 1HB PHE 71 -0.317 9.125 -0.244
517 2HB PHE 71 2HB PHE 71 1.379 9.037 -0.686
518 HD1 PHE 71 1HD PHE 71 2.115 7.598 -2.463
519 HD2 PHE 71 2HD PHE 71 -1.981 7.762 -1.434
520 HE1 PHE 71 1HE PHE 71 1.711 5.537 -3.759
521 HE2 PHE 71 2HE PHE 71 -2.402 5.702 -2.714
522 HZ PHE 71 HZ PHE 71 -0.553 4.588 -3.878
523 H ASN 72 H ASN 72 -0.698 9.441 -3.881
524 HA ASN 72 HA ASN 72 -3.133 10.765 -3.309
525 1HB ASN 72 1HB ASN 72 -1.912 10.214 -5.968
526 2HB ASN 72 2HB ASN 72 -1.956 11.752 -5.156
527 1HD2 ASN 72 1HD2 ASN 72 -2.812 11.207 -7.723
528 2HD2 ASN 72 2HD2 ASN 72 -4.518 11.472 -7.837
529 H ASP 73 H ASP 73 -4.396 9.408 -2.513
530 HA ASP 73 HA ASP 73 -4.301 6.666 -2.413
531 1HB ASP 73 1HB ASP 73 -6.616 8.533 -1.958
532 2HB ASP 73 2HB ASP 73 -5.453 7.979 -0.768
533 H GLY 74 H GLY 74 -6.697 8.527 -4.235
534 1HA GLY 74 1HA GLY 74 -8.420 7.591 -5.533
535 2HA GLY 74 2HA GLY 74 -7.645 6.026 -5.400
536 H THR 75 H THR 75 -5.074 6.992 -6.271
537 HA THR 75 HA THR 75 -5.652 6.898 -9.107
538 HB THR 75 HB THR 75 -3.993 9.216 -8.058
539 HG1 THR 75 1HG THR 75 -6.692 8.913 -8.712
540 1HG2 THR 75 1HG2 THR 75 -3.383 8.428 -10.305
541 2HG2 THR 75 2HG2 THR 75 -4.144 10.018 -10.359
542 3HG2 THR 75 3HG2 THR 75 -5.065 8.586 -10.813
543 H GLY 76 H GLY 76 -3.133 7.035 -6.554
544 1HA GLY 76 1HA GLY 76 -1.598 5.163 -8.224
545 2HA GLY 76 2HA GLY 76 -1.554 5.236 -6.468
546 H HIS 77 H HIS 77 -1.129 7.544 -9.113
547 HA HIS 77 HA HIS 77 1.546 8.157 -8.107
548 1HB HIS 77 1HB HIS 77 1.140 8.072 -10.627
549 2HB HIS 77 2HB HIS 77 1.889 9.558 -10.091
550 HD1 HIS 77 1HD HIS 77 0.724 11.697 -10.575
551 HD2 HIS 77 2HD HIS 77 -1.527 8.366 -11.503
552 HE1 HIS 77 1HE HIS 77 -1.231 12.562 -11.907
553 HE2 HIS 77 2HE HIS 77 -2.581 10.559 -12.455
554 H GLY 78 H GLY 78 2.124 9.936 -6.957
555 1HA GLY 78 1HA GLY 78 -0.190 11.260 -5.805
556 2HA GLY 78 2HA GLY 78 0.733 12.460 -6.618
557 H ILE 79 H ILE 79 3.312 11.429 -5.678
558 HA ILE 79 HA ILE 79 2.704 12.172 -2.906
559 HB ILE 79 HB ILE 79 5.142 10.861 -3.985
560 1HG1 ILE 79 1HG1 ILE 79 2.831 9.718 -2.406
561 2HG1 ILE 79 2HG1 ILE 79 4.326 8.839 -2.540
562 1HG2 ILE 79 1HG2 ILE 79 5.819 10.526 -1.604
563 2HG2 ILE 79 2HG2 ILE 79 4.431 11.494 -1.111
564 3HG2 ILE 79 3HG2 ILE 79 5.720 12.226 -2.064
565 1HD1 ILE 79 1HD1 ILE 79 2.812 7.920 -4.161
566 2HD1 ILE 79 2HD1 ILE 79 3.978 8.879 -5.080
567 3HD1 ILE 79 3HD1 ILE 79 2.383 9.524 -4.702
568 H ASN 80 H ASN 80 5.307 12.641 -5.247
569 HA ASN 80 HA ASN 80 5.305 15.276 -5.657
570 1HB ASN 80 1HB ASN 80 7.166 14.773 -3.348
571 2HB ASN 80 2HB ASN 80 5.629 15.635 -3.162
572 1HD2 ASN 80 1HD2 ASN 80 5.484 17.745 -3.955
573 2HD2 ASN 80 2HD2 ASN 80 6.841 18.652 -4.461
574 HA PRO 81 HA PRO 81 5.799 15.978 -7.266
575 1HB PRO 81 1HB PRO 81 6.642 16.553 -9.299
576 2HB PRO 81 2HB PRO 81 6.218 14.969 -9.943
577 1HG PRO 81 1HG PRO 81 8.783 15.917 -8.793
578 2HG PRO 81 2HG PRO 81 8.492 14.674 -10.021
579 1HD PRO 81 1HD PRO 81 9.190 14.032 -7.518
580 2HD PRO 81 2HD PRO 81 8.034 13.044 -8.440
581 H ASP 82 H ASP 82 4.054 15.507 -9.137
582 HA ASP 82 HA ASP 82 2.316 13.419 -8.331
583 1HB ASP 82 1HB ASP 82 1.037 13.846 -10.406
584 2HB ASP 82 2HB ASP 82 2.351 14.828 -11.024
585 H ASP 83 H ASP 83 5.002 13.509 -10.327
586 HA ASP 83 HA ASP 83 4.704 11.404 -12.095
587 1HB ASP 83 1HB ASP 83 7.135 12.449 -10.742
588 2HB ASP 83 2HB ASP 83 6.486 13.008 -12.281
589 H CYS 84 H CYS 84 5.522 11.282 -8.628
590 HA CYS 84 HA CYS 84 6.320 8.571 -9.007
591 1HB CYS 84 1HB CYS 84 7.715 9.601 -7.437
592 2HB CYS 84 2HB CYS 84 6.716 8.484 -6.529
593 HG CYS 84 HG CYS 84 6.733 10.338 -4.733
594 H CYS 85 H CYS 85 5.449 6.929 -8.483
595 HA CYS 85 HA CYS 85 2.696 6.794 -7.490
596 1HB CYS 85 1HB CYS 85 2.386 7.035 -9.793
597 2HB CYS 85 2HB CYS 85 2.109 5.348 -9.378
598 HG CYS 85 HG CYS 85 3.486 5.873 -11.917
599 H LEU 86 H LEU 86 1.925 4.637 -7.404
600 HA LEU 86 HA LEU 86 3.841 2.490 -7.006
601 1HB LEU 86 1HB LEU 86 2.884 1.980 -4.757
602 2HB LEU 86 2HB LEU 86 1.921 3.434 -4.850
603 HG LEU 86 HG LEU 86 4.018 4.791 -4.823
604 1HD1 LEU 86 1HD1 LEU 86 4.535 4.447 -2.487
605 2HD1 LEU 86 2HD1 LEU 86 3.780 2.862 -2.535
606 3HD1 LEU 86 3HD1 LEU 86 2.794 4.305 -2.730
607 1HD2 LEU 86 1HD2 LEU 86 5.548 3.126 -5.748
608 2HD2 LEU 86 2HD2 LEU 86 5.350 2.133 -4.304
609 3HD2 LEU 86 3HD2 LEU 86 6.119 3.716 -4.188
610 H ALA 87 H ALA 87 2.985 0.708 -7.879
611 HA ALA 87 HA ALA 87 0.557 0.664 -9.244
612 1HB ALA 87 1HB ALA 87 1.029 -1.660 -9.677
613 2HB ALA 87 2HB ALA 87 2.178 -1.683 -8.333
614 3HB ALA 87 3HB ALA 87 2.491 -0.667 -9.746
615 H GLU 88 H GLU 88 -1.454 0.153 -8.713
616 HA GLU 88 HA GLU 88 -2.029 -0.693 -5.969
617 1HB GLU 88 1HB GLU 88 -3.844 0.393 -8.135
618 2HB GLU 88 2HB GLU 88 -3.114 1.352 -6.857
619 1HG GLU 88 1HG GLU 88 -4.383 0.135 -5.181
620 2HG GLU 88 2HG GLU 88 -5.092 -0.879 -6.438
621 H TYR 89 H TYR 89 -2.871 -2.665 -5.538
622 HA TYR 89 HA TYR 89 -3.443 -4.425 -7.825
623 1HB TYR 89 1HB TYR 89 -2.616 -6.250 -6.484
624 2HB TYR 89 2HB TYR 89 -2.475 -5.216 -5.073
625 HD1 TYR 89 1HD TYR 89 -0.512 -4.094 -4.602
626 HD2 TYR 89 2HD TYR 89 -1.047 -5.739 -8.485
627 HE1 TYR 89 1HE TYR 89 1.826 -3.583 -5.128
628 HE2 TYR 89 2HE TYR 89 1.308 -5.231 -9.021
629 HH TYR 89 HH TYR 89 3.552 -4.386 -6.640
630 HA PRO 90 HA PRO 90 -7.636 -4.799 -6.094
631 1HB PRO 90 1HB PRO 90 -8.692 -6.278 -7.519
632 2HB PRO 90 2HB PRO 90 -7.483 -7.536 -7.256
633 1HG PRO 90 1HG PRO 90 -7.374 -5.148 -9.063
634 2HG PRO 90 2HG PRO 90 -6.908 -6.824 -9.404
635 1HD PRO 90 1HD PRO 90 -5.096 -4.948 -8.834
636 2HD PRO 90 2HD PRO 90 -4.887 -6.615 -8.260
637 H VAL 91 H VAL 91 -8.372 -5.498 -4.154
638 HA VAL 91 HA VAL 91 -6.945 -7.694 -2.802
639 HB VAL 91 HB VAL 91 -8.101 -5.219 -1.538
640 1HG1 VAL 91 1HG1 VAL 91 -8.183 -7.107 -0.057
641 2HG1 VAL 91 2HG1 VAL 91 -6.945 -5.977 0.489
642 3HG1 VAL 91 3HG1 VAL 91 -6.480 -7.455 -0.352
643 1HG2 VAL 91 1HG2 VAL 91 -5.214 -5.925 -2.027
644 2HG2 VAL 91 2HG2 VAL 91 -5.786 -4.538 -1.102
645 3HG2 VAL 91 3HG2 VAL 91 -6.131 -4.656 -2.827
646 H GLU 92 H GLU 92 -8.191 -9.232 -2.039
647 HA GLU 92 HA GLU 92 -11.112 -8.841 -1.859
648 1HB GLU 92 1HB GLU 92 -11.275 -11.248 -1.998
649 2HB GLU 92 2HB GLU 92 -9.542 -11.357 -1.938
650 1HG GLU 92 1HG GLU 92 -10.340 -11.746 -4.229
651 2HG GLU 92 2HG GLU 92 -9.430 -10.239 -4.169
652 H VAL 93 H VAL 93 -11.627 -8.483 0.116
653 HA VAL 93 HA VAL 93 -10.212 -9.859 2.272
654 HB VAL 93 HB VAL 93 -9.833 -7.499 2.431
655 1HG1 VAL 93 1HG1 VAL 93 -12.807 -7.122 2.456
656 2HG1 VAL 93 2HG1 VAL 93 -11.698 -6.635 1.174
657 3HG1 VAL 93 3HG1 VAL 93 -11.627 -5.847 2.751
658 1HG2 VAL 93 1HG2 VAL 93 -10.697 -7.010 4.689
659 2HG2 VAL 93 2HG2 VAL 93 -10.119 -8.677 4.565
660 3HG2 VAL 93 3HG2 VAL 93 -11.843 -8.334 4.514
661 H LYS 94 H LYS 94 -11.286 -11.515 2.887
662 HA LYS 94 HA LYS 94 -14.101 -11.223 3.441
663 1HB LYS 94 1HB LYS 94 -14.058 -12.393 1.325
664 2HB LYS 94 2HB LYS 94 -14.615 -13.472 2.580
665 1HG LYS 94 1HG LYS 94 -13.203 -14.678 1.063
666 2HG LYS 94 2HG LYS 94 -12.427 -14.565 2.640
667 1HD LYS 94 1HD LYS 94 -10.931 -12.849 1.874
668 2HD LYS 94 2HD LYS 94 -11.741 -12.737 0.327
669 1HE LYS 94 1HE LYS 94 -10.268 -15.133 1.417
670 2HE LYS 94 2HE LYS 94 -9.704 -14.037 0.159
671 1HZ LYS 94 1HZ LYS 94 -10.625 -16.062 -0.780
672 2HZ LYS 94 2HZ LYS 94 -11.502 -14.714 -1.237
673 3HZ LYS 94 3HZ LYS 94 -12.118 -15.747 -0.061
674 H GLY 95 H GLY 95 -14.503 -11.587 5.462
675 1HA GLY 95 1HA GLY 95 -13.670 -13.901 6.853
676 2HA GLY 95 2HA GLY 95 -14.358 -12.471 7.602
677 H ASP 96 H ASP 96 -11.757 -14.380 7.479
678 HA ASP 96 HA ASP 96 -10.063 -12.363 8.797
679 1HB ASP 96 1HB ASP 96 -8.622 -14.228 9.421
680 2HB ASP 96 2HB ASP 96 -9.638 -15.372 8.636
681 H ASP 97 H ASP 97 -10.456 -13.621 5.725
682 HA ASP 97 HA ASP 97 -7.578 -13.595 5.367
683 1HB ASP 97 1HB ASP 97 -8.087 -14.798 3.183
684 2HB ASP 97 2HB ASP 97 -9.654 -15.133 3.894
685 H ILE 98 H ILE 98 -6.552 -12.523 3.968
686 HA ILE 98 HA ILE 98 -8.030 -10.771 2.188
687 HB ILE 98 HB ILE 98 -5.573 -10.117 3.840
688 1HG1 ILE 98 1HG1 ILE 98 -7.731 -9.881 5.017
689 2HG1 ILE 98 2HG1 ILE 98 -8.308 -8.832 3.719
690 1HG2 ILE 98 1HG2 ILE 98 -5.263 -9.238 1.582
691 2HG2 ILE 98 2HG2 ILE 98 -5.551 -7.925 2.725
692 3HG2 ILE 98 3HG2 ILE 98 -6.847 -8.466 1.658
693 1HD1 ILE 98 1HD1 ILE 98 -6.077 -8.197 5.545
694 2HD1 ILE 98 2HD1 ILE 98 -7.743 -7.591 5.612
695 3HD1 ILE 98 3HD1 ILE 98 -6.709 -7.193 4.232
696 H TYR 99 H TYR 99 -7.680 -11.343 0.250
697 HA TYR 99 HA TYR 99 -5.078 -12.444 -0.571
698 1HB TYR 99 1HB TYR 99 -6.383 -13.133 -2.647
699 2HB TYR 99 2HB TYR 99 -7.831 -12.747 -1.750
700 HD1 TYR 99 1HD TYR 99 -6.032 -15.371 -2.837
701 HD2 TYR 99 2HD TYR 99 -7.607 -13.904 0.824
702 HE1 TYR 99 1HE TYR 99 -6.012 -17.638 -1.933
703 HE2 TYR 99 2HE TYR 99 -7.593 -16.190 1.739
704 HH TYR 99 HH TYR 99 -7.625 -18.437 0.944
705 H VAL 100 H VAL 100 -4.109 -11.556 -2.309
706 HA VAL 100 HA VAL 100 -5.302 -9.127 -3.450
707 HB VAL 100 HB VAL 100 -2.406 -9.369 -2.581
708 1HG1 VAL 100 1HG1 VAL 100 -2.637 -7.959 -4.522
709 2HG1 VAL 100 2HG1 VAL 100 -2.233 -6.978 -3.112
710 3HG1 VAL 100 3HG1 VAL 100 -3.887 -7.012 -3.718
711 1HG2 VAL 100 1HG2 VAL 100 -3.816 -9.132 -0.618
712 2HG2 VAL 100 2HG2 VAL 100 -4.613 -7.737 -1.333
713 3HG2 VAL 100 3HG2 VAL 100 -2.907 -7.642 -0.884
714 H SER 101 H SER 101 -4.743 -8.820 -5.565
715 HA SER 101 HA SER 101 -3.575 -11.146 -6.879
716 1HB SER 101 1HB SER 101 -4.691 -8.597 -8.100
717 2HB SER 101 2HB SER 101 -5.630 -10.063 -7.837
718 HG SER 101 HG SER 101 -4.930 -10.066 -9.924
719 H THR 102 H THR 102 -1.526 -11.182 -7.023
720 HA THR 102 HA THR 102 -0.062 -8.646 -7.252
721 HB THR 102 HB THR 102 0.176 -9.418 -4.991
722 HG1 THR 102 1HG THR 102 2.242 -9.206 -6.688
723 1HG2 THR 102 1HG2 THR 102 1.151 -12.031 -6.163
724 2HG2 THR 102 2HG2 THR 102 -0.384 -11.779 -5.335
725 3HG2 THR 102 3HG2 THR 102 1.129 -11.626 -4.445
726 H LYS 103 H LYS 103 -0.665 -11.675 -8.579
727 HA LYS 103 HA LYS 103 1.761 -11.382 -10.148
728 1HB LYS 103 1HB LYS 103 0.450 -14.017 -9.461
729 2HB LYS 103 2HB LYS 103 1.849 -13.368 -8.613
730 1HG LYS 103 1HG LYS 103 3.079 -13.356 -10.752
731 2HG LYS 103 2HG LYS 103 1.699 -14.140 -11.513
732 1HD LYS 103 1HD LYS 103 1.923 -16.042 -10.031
733 2HD LYS 103 2HD LYS 103 3.260 -15.250 -9.192
734 1HE LYS 103 1HE LYS 103 3.220 -16.079 -12.093
735 2HE LYS 103 2HE LYS 103 4.080 -16.888 -10.782
736 1HZ LYS 103 1HZ LYS 103 5.549 -15.487 -12.058
737 2HZ LYS 103 2HZ LYS 103 5.465 -14.908 -10.491
738 3HZ LYS 103 3HZ LYS 103 4.635 -14.119 -11.727
739 H GLY 104 H GLY 104 1.450 -11.188 -12.211
740 1HA GLY 104 1HA GLY 104 -1.303 -11.498 -13.204
741 2HA GLY 104 2HA GLY 104 0.148 -11.731 -14.197
742 H ILE 105 H ILE 105 -0.483 -9.417 -11.687
743 HA ILE 105 HA ILE 105 -0.293 -7.211 -13.591
744 HB ILE 105 HB ILE 105 -1.078 -7.189 -10.649
745 1HG1 ILE 105 1HG1 ILE 105 -2.776 -8.254 -12.054
746 2HG1 ILE 105 2HG1 ILE 105 -2.798 -6.859 -13.125
747 1HG2 ILE 105 1HG2 ILE 105 -1.737 -4.841 -11.042
748 2HG2 ILE 105 2HG2 ILE 105 -1.110 -4.946 -12.686
749 3HG2 ILE 105 3HG2 ILE 105 -0.012 -5.094 -11.315
750 1HD1 ILE 105 1HD1 ILE 105 -4.712 -6.844 -11.635
751 2HD1 ILE 105 2HD1 ILE 105 -3.654 -5.472 -11.309
752 3HD1 ILE 105 3HD1 ILE 105 -3.638 -6.870 -10.236
753 H LEU 106 H LEU 106 1.772 -6.770 -13.904
754 HA LEU 106 HA LEU 106 3.699 -7.269 -11.836
755 1HB LEU 106 1HB LEU 106 4.077 -6.130 -14.626
756 2HB LEU 106 2HB LEU 106 4.007 -7.836 -14.296
757 HG LEU 106 HG LEU 106 6.112 -7.627 -12.944
758 1HD1 LEU 106 1HD1 LEU 106 6.239 -6.756 -15.826
759 2HD1 LEU 106 2HD1 LEU 106 6.127 -8.418 -15.245
760 3HD1 LEU 106 3HD1 LEU 106 7.567 -7.455 -14.903
761 1HD2 LEU 106 1HD2 LEU 106 6.007 -5.210 -12.478
762 2HD2 LEU 106 2HD2 LEU 106 6.243 -4.883 -14.199
763 3HD2 LEU 106 3HD2 LEU 106 7.513 -5.668 -13.267
764 HA PRO 107 HA PRO 107 3.475 -3.152 -9.870
765 1HB PRO 107 1HB PRO 107 5.263 -3.291 -8.515
766 2HB PRO 107 2HB PRO 107 6.367 -3.158 -9.878
767 1HG PRO 107 1HG PRO 107 5.832 -5.447 -8.357
768 2HG PRO 107 2HG PRO 107 6.756 -5.388 -9.865
769 1HD PRO 107 1HD PRO 107 3.973 -6.249 -9.395
770 2HD PRO 107 2HD PRO 107 5.126 -6.712 -10.665
771 H ASN 108 H ASN 108 3.278 -1.276 -10.943
772 HA ASN 108 HA ASN 108 4.869 -0.917 -13.269
773 1HB ASN 108 1HB ASN 108 2.618 -0.628 -13.770
774 2HB ASN 108 2HB ASN 108 3.405 0.949 -13.777
775 1HD2 ASN 108 1HD2 ASN 108 3.245 1.599 -11.023
776 2HD2 ASN 108 2HD2 ASN 108 1.589 1.937 -10.688
777 H LYS 109 H LYS 109 6.495 0.114 -13.282
778 HA LYS 109 HA LYS 109 8.267 1.465 -12.655
779 1HB LYS 109 1HB LYS 109 5.944 3.212 -11.724
780 2HB LYS 109 2HB LYS 109 6.552 3.164 -13.358
781 1HG LYS 109 1HG LYS 109 8.682 4.136 -12.606
782 2HG LYS 109 2HG LYS 109 7.998 4.273 -10.978
783 1HD LYS 109 1HD LYS 109 6.188 5.667 -11.861
784 2HD LYS 109 2HD LYS 109 6.901 5.569 -13.467
785 1HE LYS 109 1HE LYS 109 8.934 6.626 -12.620
786 2HE LYS 109 2HE LYS 109 8.185 6.780 -11.033
787 1HZ LYS 109 1HZ LYS 109 7.186 8.051 -13.527
788 2HZ LYS 109 2HZ LYS 109 7.982 8.856 -12.285
789 3HZ LYS 109 3HZ LYS 109 6.475 8.193 -12.016
790 H ALA 110 H ALA 110 8.864 2.926 -10.411
791 HA ALA 110 HA ALA 110 9.255 3.000 -8.226
792 1HB ALA 110 1HB ALA 110 6.831 3.118 -8.008
793 2HB ALA 110 2HB ALA 110 7.542 2.249 -6.645
794 3HB ALA 110 3HB ALA 110 6.749 1.361 -7.953
795 H HIS 111 H HIS 111 8.964 1.204 -6.161
796 HA HIS 111 HA HIS 111 9.914 -0.404 -5.047
797 1HB HIS 111 1HB HIS 111 10.454 -1.909 -7.626
798 2HB HIS 111 2HB HIS 111 8.954 -2.022 -6.706
799 HD1 HIS 111 1HD HIS 111 12.451 -3.305 -6.782
800 HD2 HIS 111 2HD HIS 111 9.212 -3.326 -4.169
801 HE1 HIS 111 1HE HIS 111 13.006 -4.989 -5.039
802 HE2 HIS 111 2HE HIS 111 11.157 -4.809 -3.336
803 H SER 112 H SER 112 11.674 -0.034 -4.037
804 HA SER 112 HA SER 112 14.085 0.679 -5.506
805 1HB SER 112 1HB SER 112 13.457 0.964 -2.557
806 2HB SER 112 2HB SER 112 13.072 2.226 -3.701
807 HG SER 112 HG SER 112 15.640 1.523 -4.045
Start of MODEL 6
1 1H MET 1 1HT MET 1 -4.893 -18.657 -12.315
2 2H MET 1 2HT MET 1 -4.500 -17.221 -13.148
3 3H MET 1 3HT MET 1 -5.816 -17.276 -12.126
4 HA MET 1 HA MET 1 -4.572 -17.522 -10.218
5 1HB MET 1 1HB MET 1 -2.730 -18.863 -10.950
6 2HB MET 1 2HB MET 1 -2.078 -17.373 -10.289
7 1HG MET 1 1HG MET 1 -1.884 -16.513 -12.625
8 2HG MET 1 2HG MET 1 -2.322 -18.120 -13.185
9 1HE MET 1 1HE MET 1 -0.855 -20.335 -12.561
10 2HE MET 1 2HE MET 1 -0.851 -19.868 -10.862
11 3HE MET 1 3HE MET 1 0.665 -20.254 -11.671
12 H SER 2 H SER 2 -4.699 -15.739 -9.202
13 HA SER 2 HA SER 2 -3.433 -13.324 -10.048
14 1HB SER 2 1HB SER 2 -5.520 -11.979 -10.051
15 2HB SER 2 2HB SER 2 -6.466 -13.455 -9.892
16 HG SER 2 HG SER 2 -4.742 -13.643 -11.926
17 H PHE 3 H PHE 3 -6.090 -14.562 -8.046
18 HA PHE 3 HA PHE 3 -5.285 -12.879 -5.830
19 1HB PHE 3 1HB PHE 3 -7.331 -13.707 -4.777
20 2HB PHE 3 2HB PHE 3 -7.618 -14.740 -6.162
21 HD1 PHE 3 1HD PHE 3 -7.219 -11.171 -5.232
22 HD2 PHE 3 2HD PHE 3 -8.851 -13.998 -7.958
23 HE1 PHE 3 1HE PHE 3 -8.525 -9.389 -6.289
24 HE2 PHE 3 2HE PHE 3 -10.151 -12.211 -9.028
25 HZ PHE 3 HZ PHE 3 -9.993 -9.904 -8.178
26 H GLU 4 H GLU 4 -4.240 -13.523 -4.159
27 HA GLU 4 HA GLU 4 -4.345 -16.297 -3.318
28 1HB GLU 4 1HB GLU 4 -1.805 -14.678 -3.609
29 2HB GLU 4 2HB GLU 4 -2.281 -15.991 -4.675
30 1HG GLU 4 1HG GLU 4 -2.179 -17.545 -2.782
31 2HG GLU 4 2HG GLU 4 -1.657 -16.220 -1.749
32 H LYS 5 H LYS 5 -4.094 -16.448 -1.020
33 HA LYS 5 HA LYS 5 -4.850 -14.097 0.436
34 1HB LYS 5 1HB LYS 5 -3.780 -16.708 1.520
35 2HB LYS 5 2HB LYS 5 -5.481 -16.375 1.208
36 1HG LYS 5 1HG LYS 5 -5.462 -14.597 2.839
37 2HG LYS 5 2HG LYS 5 -3.740 -14.801 3.093
38 1HD LYS 5 1HD LYS 5 -5.775 -16.917 3.728
39 2HD LYS 5 2HD LYS 5 -5.164 -15.757 4.894
40 1HE LYS 5 1HE LYS 5 -3.873 -17.627 5.303
41 2HE LYS 5 2HE LYS 5 -2.844 -16.622 4.304
42 1HZ LYS 5 1HZ LYS 5 -4.403 -18.915 3.249
43 2HZ LYS 5 2HZ LYS 5 -2.813 -18.994 3.688
44 3HZ LYS 5 3HZ LYS 5 -3.235 -18.046 2.381
45 H ILE 6 H ILE 6 -3.704 -12.601 1.197
46 HA ILE 6 HA ILE 6 -0.828 -12.760 1.029
47 HB ILE 6 HB ILE 6 -1.892 -10.702 0.360
48 1HG1 ILE 6 1HG1 ILE 6 -0.301 -10.316 2.896
49 2HG1 ILE 6 2HG1 ILE 6 -0.649 -9.037 1.741
50 1HG2 ILE 6 1HG2 ILE 6 -3.886 -10.718 1.650
51 2HG2 ILE 6 2HG2 ILE 6 -3.054 -9.181 1.946
52 3HG2 ILE 6 3HG2 ILE 6 -2.978 -10.492 3.135
53 1HD1 ILE 6 1HD1 ILE 6 0.569 -10.269 0.012
54 2HD1 ILE 6 2HD1 ILE 6 0.955 -11.525 1.194
55 3HD1 ILE 6 3HD1 ILE 6 1.580 -9.895 1.403
56 H CYS 7 H CYS 7 -3.278 -12.294 3.472
57 HA CYS 7 HA CYS 7 -1.903 -13.703 5.522
58 1HB CYS 7 1HB CYS 7 -1.813 -11.766 7.119
59 2HB CYS 7 2HB CYS 7 -2.164 -10.683 5.783
60 HG CYS 7 HG CYS 7 0.269 -12.120 4.586
61 H SER 8 H SER 8 -3.247 -12.963 7.706
62 HA SER 8 HA SER 8 -6.008 -13.070 6.882
63 1HB SER 8 1HB SER 8 -6.493 -14.399 8.688
64 2HB SER 8 2HB SER 8 -5.055 -14.140 9.564
65 HG SER 8 HG SER 8 -5.720 -15.820 7.419
66 H LEU 9 H LEU 9 -7.468 -12.074 8.334
67 HA LEU 9 HA LEU 9 -7.002 -9.345 8.675
68 1HB LEU 9 1HB LEU 9 -9.022 -11.071 10.016
69 2HB LEU 9 2HB LEU 9 -9.099 -10.630 8.353
70 HG LEU 9 HG LEU 9 -9.285 -8.748 10.736
71 1HD1 LEU 9 1HD1 LEU 9 -8.224 -7.635 8.830
72 2HD1 LEU 9 2HD1 LEU 9 -9.845 -7.006 9.108
73 3HD1 LEU 9 3HD1 LEU 9 -9.558 -8.144 7.792
74 1HD2 LEU 9 1HD2 LEU 9 -11.608 -8.460 10.012
75 2HD2 LEU 9 2HD2 LEU 9 -11.251 -10.127 10.451
76 3HD2 LEU 9 3HD2 LEU 9 -11.354 -9.664 8.752
77 H ASP 10 H ASP 10 -6.294 -11.946 10.812
78 HA ASP 10 HA ASP 10 -6.124 -10.362 13.215
79 1HB ASP 10 1HB ASP 10 -6.553 -12.789 13.336
80 2HB ASP 10 2HB ASP 10 -5.122 -12.314 14.237
81 H ASP 11 H ASP 11 -4.083 -11.001 10.529
82 HA ASP 11 HA ASP 11 -1.594 -10.199 11.825
83 1HB ASP 11 1HB ASP 11 -0.663 -10.182 9.490
84 2HB ASP 11 2HB ASP 11 -2.260 -10.531 8.870
85 H ILE 12 H ILE 12 -3.728 -9.056 9.327
86 HA ILE 12 HA ILE 12 -2.806 -6.331 9.770
87 HB ILE 12 HB ILE 12 -2.300 -6.899 7.649
88 1HG1 ILE 12 1HG1 ILE 12 -4.868 -5.352 7.537
89 2HG1 ILE 12 2HG1 ILE 12 -3.836 -5.533 6.136
90 1HG2 ILE 12 1HG2 ILE 12 -5.028 -8.075 7.283
91 2HG2 ILE 12 2HG2 ILE 12 -3.482 -8.933 7.291
92 3HG2 ILE 12 3HG2 ILE 12 -3.896 -7.861 5.947
93 1HD1 ILE 12 1HD1 ILE 12 -1.999 -4.450 7.376
94 2HD1 ILE 12 2HD1 ILE 12 -3.067 -4.266 8.769
95 3HD1 ILE 12 3HD1 ILE 12 -3.423 -3.416 7.266
96 H TRP 13 H TRP 13 -4.027 -5.254 10.879
97 HA TRP 13 HA TRP 13 -6.754 -6.049 11.452
98 1HB TRP 13 1HB TRP 13 -6.650 -4.299 13.186
99 2HB TRP 13 2HB TRP 13 -5.058 -3.853 12.605
100 HD1 TRP 13 HD TRP 13 -3.339 -6.288 12.592
101 HE1 TRP 13 1HE TRP 13 -2.923 -7.739 14.667
102 HE3 TRP 13 3HE TRP 13 -7.439 -4.962 15.322
103 HZ2 TRP 13 2HZ TRP 13 -4.166 -8.237 17.150
104 HZ3 TRP 13 3HZ TRP 13 -7.748 -5.963 17.537
105 HH2 TRP 13 HH TRP 13 -6.151 -7.564 18.430
106 H VAL 14 H VAL 14 -8.447 -4.441 11.557
107 HA VAL 14 HA VAL 14 -8.514 -2.853 9.199
108 HB VAL 14 HB VAL 14 -10.551 -3.990 9.925
109 1HG1 VAL 14 1HG1 VAL 14 -11.833 -3.269 11.881
110 2HG1 VAL 14 2HG1 VAL 14 -10.508 -2.199 12.341
111 3HG1 VAL 14 3HG1 VAL 14 -10.263 -3.945 12.321
112 1HG2 VAL 14 1HG2 VAL 14 -12.151 -2.127 9.738
113 2HG2 VAL 14 2HG2 VAL 14 -10.828 -1.985 8.582
114 3HG2 VAL 14 3HG2 VAL 14 -10.838 -0.988 10.036
115 H GLY 15 H GLY 15 -7.899 -0.859 8.930
116 1HA GLY 15 1HA GLY 15 -7.756 0.960 11.211
117 2HA GLY 15 2HA GLY 15 -7.693 1.407 9.508
118 H GLU 16 H GLU 16 -5.862 -1.289 9.820
119 HA GLU 16 HA GLU 16 -3.464 0.184 10.560
120 1HB GLU 16 1HB GLU 16 -2.459 -2.067 10.932
121 2HB GLU 16 2HB GLU 16 -4.036 -2.774 10.611
122 1HG GLU 16 1HG GLU 16 -3.608 -2.612 12.995
123 2HG GLU 16 2HG GLU 16 -4.968 -1.581 12.537
124 H MET 17 H MET 17 -1.500 -0.445 9.410
125 HA MET 17 HA MET 17 -1.883 -1.509 6.731
126 1HB MET 17 1HB MET 17 -2.123 0.883 6.430
127 2HB MET 17 2HB MET 17 -0.604 0.317 5.745
128 1HG MET 17 1HG MET 17 0.597 1.121 7.720
129 2HG MET 17 2HG MET 17 -0.907 1.734 8.384
130 1HE MET 17 1HE MET 17 1.722 3.471 8.066
131 2HE MET 17 2HE MET 17 0.216 4.081 8.750
132 3HE MET 17 3HE MET 17 1.034 4.983 7.475
133 H GLU 18 H GLU 18 -0.196 -2.714 6.160
134 HA GLU 18 HA GLU 18 2.320 -2.021 7.035
135 1HB GLU 18 1HB GLU 18 2.022 -3.030 9.087
136 2HB GLU 18 2HB GLU 18 2.999 -4.164 8.184
137 1HG GLU 18 1HG GLU 18 1.057 -5.560 7.772
138 2HG GLU 18 2HG GLU 18 0.050 -4.421 8.674
139 H THR 19 H THR 19 4.102 -3.325 6.309
140 HA THR 19 HA THR 19 3.538 -3.939 3.578
141 HB THR 19 HB THR 19 6.125 -3.869 5.104
142 HG1 THR 19 1HG THR 19 6.316 -1.828 3.939
143 1HG2 THR 19 1HG2 THR 19 7.179 -3.660 2.878
144 2HG2 THR 19 2HG2 THR 19 5.596 -3.863 2.126
145 3HG2 THR 19 3HG2 THR 19 6.309 -5.183 3.053
146 H PHE 20 H PHE 20 3.324 -5.845 2.816
147 HA PHE 20 HA PHE 20 4.488 -8.137 4.207
148 1HB PHE 20 1HB PHE 20 2.589 -9.523 3.379
149 2HB PHE 20 2HB PHE 20 1.830 -8.077 2.773
150 HD1 PHE 20 1HD PHE 20 3.161 -9.464 5.967
151 HD2 PHE 20 2HD PHE 20 0.235 -7.048 4.052
152 HE1 PHE 20 1HE PHE 20 1.982 -9.189 8.111
153 HE2 PHE 20 2HE PHE 20 -0.936 -6.761 6.172
154 HZ PHE 20 HZ PHE 20 -0.065 -7.837 8.219
155 H GLU 21 H GLU 21 5.193 -9.752 2.832
156 HA GLU 21 HA GLU 21 5.821 -8.723 0.216
157 1HB GLU 21 1HB GLU 21 7.798 -9.272 1.431
158 2HB GLU 21 2HB GLU 21 7.589 -10.471 0.171
159 1HG GLU 21 1HG GLU 21 8.384 -11.533 2.120
160 2HG GLU 21 2HG GLU 21 6.728 -12.062 1.807
161 H THR 22 H THR 22 5.540 -9.808 -1.600
162 HA THR 22 HA THR 22 3.265 -11.540 -1.671
163 HB THR 22 HB THR 22 3.461 -11.266 -4.091
164 HG1 THR 22 1HG THR 22 5.167 -10.081 -4.920
165 1HG2 THR 22 1HG2 THR 22 2.454 -9.407 -2.787
166 2HG2 THR 22 2HG2 THR 22 3.290 -8.840 -4.240
167 3HG2 THR 22 3HG2 THR 22 4.064 -8.680 -2.670
168 H SER 23 H SER 23 3.539 -13.453 -3.411
169 HA SER 23 HA SER 23 5.585 -15.145 -2.429
170 1HB SER 23 1HB SER 23 4.657 -16.778 -4.082
171 2HB SER 23 2HB SER 23 3.564 -15.487 -4.599
172 HG SER 23 HG SER 23 2.322 -16.073 -2.947
173 H ASP 24 H ASP 24 5.541 -12.791 -4.740
174 HA ASP 24 HA ASP 24 7.685 -13.966 -6.327
175 1HB ASP 24 1HB ASP 24 7.675 -11.798 -7.566
176 2HB ASP 24 2HB ASP 24 6.375 -11.261 -6.516
177 H GLY 25 H GLY 25 7.406 -12.406 -3.445
178 1HA GLY 25 1HA GLY 25 10.251 -11.808 -3.420
179 2HA GLY 25 2HA GLY 25 9.182 -11.834 -2.026
180 H THR 26 H THR 26 7.316 -10.100 -3.784
181 HA THR 26 HA THR 26 8.775 -7.594 -3.741
182 HB THR 26 HB THR 26 5.968 -8.221 -4.692
183 HG1 THR 26 1HG THR 26 8.505 -8.253 -5.934
184 1HG2 THR 26 1HG2 THR 26 7.778 -5.849 -5.227
185 2HG2 THR 26 2HG2 THR 26 6.372 -5.842 -4.166
186 3HG2 THR 26 3HG2 THR 26 6.164 -6.094 -5.898
187 H GLU 27 H GLU 27 8.545 -6.207 -2.083
188 HA GLU 27 HA GLU 27 6.573 -6.825 -0.058
189 1HB GLU 27 1HB GLU 27 7.720 -5.079 1.282
190 2HB GLU 27 2HB GLU 27 8.802 -4.794 -0.074
191 1HG GLU 27 1HG GLU 27 9.642 -7.065 0.092
192 2HG GLU 27 2HG GLU 27 8.502 -7.402 1.395
193 H VAL 28 H VAL 28 4.751 -5.866 0.185
194 HA VAL 28 HA VAL 28 4.182 -3.387 -1.302
195 HB VAL 28 HB VAL 28 2.362 -5.767 -0.852
196 1HG1 VAL 28 1HG1 VAL 28 1.947 -3.327 -2.530
197 2HG1 VAL 28 2HG1 VAL 28 1.110 -3.737 -1.033
198 3HG1 VAL 28 3HG1 VAL 28 0.879 -4.727 -2.481
199 1HG2 VAL 28 1HG2 VAL 28 2.572 -6.231 -3.256
200 2HG2 VAL 28 2HG2 VAL 28 4.118 -6.378 -2.414
201 3HG2 VAL 28 3HG2 VAL 28 3.773 -4.947 -3.382
202 H LEU 29 H LEU 29 2.765 -1.961 -0.193
203 HA LEU 29 HA LEU 29 2.532 -2.319 2.713
204 1HB LEU 29 1HB LEU 29 1.847 -0.015 0.865
205 2HB LEU 29 2HB LEU 29 3.321 -0.158 1.797
206 HG LEU 29 HG LEU 29 0.563 0.141 2.969
207 1HD1 LEU 29 1HD1 LEU 29 3.274 0.158 4.272
208 2HD1 LEU 29 2HD1 LEU 29 2.037 -1.090 4.443
209 3HD1 LEU 29 3HD1 LEU 29 1.748 0.533 5.072
210 1HD2 LEU 29 1HD2 LEU 29 2.802 2.145 2.693
211 2HD2 LEU 29 2HD2 LEU 29 1.293 2.404 3.563
212 3HD2 LEU 29 3HD2 LEU 29 1.274 2.165 1.815
213 H ILE 30 H ILE 30 0.784 -3.485 3.287
214 HA ILE 30 HA ILE 30 -1.646 -3.256 1.705
215 HB ILE 30 HB ILE 30 -0.861 -5.212 3.896
216 1HG1 ILE 30 1HG1 ILE 30 -1.567 -5.603 1.006
217 2HG1 ILE 30 2HG1 ILE 30 -1.315 -6.948 2.109
218 1HG2 ILE 30 1HG2 ILE 30 -3.042 -6.310 3.615
219 2HG2 ILE 30 2HG2 ILE 30 -3.542 -5.005 2.537
220 3HG2 ILE 30 3HG2 ILE 30 -3.193 -4.662 4.231
221 1HD1 ILE 30 1HD1 ILE 30 0.626 -6.658 0.739
222 2HD1 ILE 30 2HD1 ILE 30 1.034 -6.202 2.401
223 3HD1 ILE 30 3HD1 ILE 30 0.736 -4.963 1.192
224 H VAL 31 H VAL 31 -2.994 -1.746 2.269
225 HA VAL 31 HA VAL 31 -3.095 -0.914 5.086
226 HB VAL 31 HB VAL 31 -4.209 0.477 2.636
227 1HG1 VAL 31 1HG1 VAL 31 -5.374 1.076 4.661
228 2HG1 VAL 31 2HG1 VAL 31 -4.413 2.436 4.087
229 3HG1 VAL 31 3HG1 VAL 31 -3.852 1.478 5.455
230 1HG2 VAL 31 1HG2 VAL 31 -1.647 1.091 4.114
231 2HG2 VAL 31 2HG2 VAL 31 -2.343 2.071 2.825
232 3HG2 VAL 31 3HG2 VAL 31 -1.776 0.437 2.482
233 H ASN 32 H ASN 32 -4.863 -1.674 6.164
234 HA ASN 32 HA ASN 32 -7.140 -2.475 4.492
235 1HB ASN 32 1HB ASN 32 -6.456 -3.278 7.339
236 2HB ASN 32 2HB ASN 32 -6.216 -4.283 5.915
237 1HD2 ASN 32 1HD2 ASN 32 -7.760 -4.850 8.255
238 2HD2 ASN 32 2HD2 ASN 32 -9.382 -5.148 7.737
239 H SER 33 H SER 33 -8.388 -0.788 4.305
240 HA SER 33 HA SER 33 -8.687 0.965 6.583
241 1HB SER 33 1HB SER 33 -9.537 2.560 5.021
242 2HB SER 33 2HB SER 33 -9.520 1.358 3.726
243 HG SER 33 HG SER 33 -7.190 2.002 5.168
244 H GLU 34 H GLU 34 -10.785 1.741 7.093
245 HA GLU 34 HA GLU 34 -12.710 -0.351 7.255
246 1HB GLU 34 1HB GLU 34 -12.814 2.556 8.030
247 2HB GLU 34 2HB GLU 34 -12.267 1.244 9.054
248 1HG GLU 34 1HG GLU 34 -14.490 0.285 9.051
249 2HG GLU 34 2HG GLU 34 -15.055 1.599 8.017
250 H GLU 35 H GLU 35 -12.702 2.897 5.718
251 HA GLU 35 HA GLU 35 -14.917 1.967 4.028
252 1HB GLU 35 1HB GLU 35 -15.334 4.394 3.563
253 2HB GLU 35 2HB GLU 35 -14.124 4.771 4.778
254 1HG GLU 35 1HG GLU 35 -16.353 4.945 5.700
255 2HG GLU 35 2HG GLU 35 -15.466 3.625 6.468
256 H HIS 36 H HIS 36 -11.700 3.141 3.951
257 HA HIS 36 HA HIS 36 -11.657 3.563 1.092
258 1HB HIS 36 1HB HIS 36 -9.460 3.406 3.193
259 2HB HIS 36 2HB HIS 36 -10.123 4.852 2.475
260 HD1 HIS 36 1HD HIS 36 -7.470 2.381 2.057
261 HD2 HIS 36 2HD HIS 36 -9.189 5.424 -0.182
262 HE1 HIS 36 1HE HIS 36 -5.822 2.879 0.218
263 HE2 HIS 36 2HE HIS 36 -6.708 4.964 -0.816
264 H GLY 37 H GLY 37 -11.785 0.901 3.044
265 1HA GLY 37 1HA GLY 37 -11.496 -0.936 0.903
266 2HA GLY 37 2HA GLY 37 -11.809 -1.320 2.591
267 H VAL 38 H VAL 38 -10.327 -3.119 1.818
268 HA VAL 38 HA VAL 38 -7.685 -2.356 2.666
269 HB VAL 38 HB VAL 38 -8.623 -4.428 3.600
270 1HG1 VAL 38 1HG1 VAL 38 -8.922 -6.452 2.249
271 2HG1 VAL 38 2HG1 VAL 38 -8.651 -5.494 0.791
272 3HG1 VAL 38 3HG1 VAL 38 -10.044 -5.163 1.816
273 1HG2 VAL 38 1HG2 VAL 38 -6.218 -4.302 3.461
274 2HG2 VAL 38 2HG2 VAL 38 -6.250 -4.906 1.812
275 3HG2 VAL 38 3HG2 VAL 38 -6.728 -5.963 3.145
276 H LYS 39 H LYS 39 -6.195 -1.753 1.395
277 HA LYS 39 HA LYS 39 -6.215 -2.611 -1.410
278 1HB LYS 39 1HB LYS 39 -5.445 -0.331 -2.039
279 2HB LYS 39 2HB LYS 39 -5.718 0.196 -0.395
280 1HG LYS 39 1HG LYS 39 -7.501 0.956 -1.847
281 2HG LYS 39 2HG LYS 39 -8.114 -0.164 -0.631
282 1HD LYS 39 1HD LYS 39 -8.244 -1.945 -2.219
283 2HD LYS 39 2HD LYS 39 -7.405 -0.988 -3.438
284 1HE LYS 39 1HE LYS 39 -9.837 -1.100 -3.832
285 2HE LYS 39 2HE LYS 39 -9.264 0.542 -3.602
286 1HZ LYS 39 1HZ LYS 39 -10.112 0.498 -1.324
287 2HZ LYS 39 2HZ LYS 39 -10.646 -1.100 -1.542
288 3HZ LYS 39 3HZ LYS 39 -11.330 0.122 -2.422
289 H ALA 40 H ALA 40 -4.145 -2.766 -2.329
290 HA ALA 40 HA ALA 40 -1.946 -2.440 -0.433
291 1HB ALA 40 1HB ALA 40 -2.266 -4.650 -2.467
292 2HB ALA 40 2HB ALA 40 -2.489 -4.815 -0.734
293 3HB ALA 40 3HB ALA 40 -0.895 -4.427 -1.381
294 H TYR 41 H TYR 41 -0.274 -1.354 -1.131
295 HA TYR 41 HA TYR 41 -0.067 -0.651 -3.994
296 1HB TYR 41 1HB TYR 41 0.486 1.628 -3.352
297 2HB TYR 41 2HB TYR 41 0.275 1.238 -1.653
298 HD1 TYR 41 1HD TYR 41 -1.523 1.782 -4.818
299 HD2 TYR 41 2HD TYR 41 -1.868 1.222 -0.622
300 HE1 TYR 41 1HE TYR 41 -3.863 2.499 -4.921
301 HE2 TYR 41 2HE TYR 41 -4.218 1.932 -0.716
302 HH TYR 41 HH TYR 41 -5.874 2.235 -3.697
303 H GLN 42 H GLN 42 2.175 -0.176 -4.574
304 HA GLN 42 HA GLN 42 4.161 -1.629 -3.280
305 1HB GLN 42 1HB GLN 42 5.780 -0.001 -4.433
306 2HB GLN 42 2HB GLN 42 4.343 0.756 -5.097
307 1HG GLN 42 1HG GLN 42 5.253 -0.764 -6.699
308 2HG GLN 42 2HG GLN 42 3.710 -1.386 -6.107
309 1HE2 GLN 42 1HE2 GLN 42 3.694 -3.258 -4.868
310 2HE2 GLN 42 2HE2 GLN 42 5.091 -4.237 -4.697
311 H ALA 43 H ALA 43 5.552 -1.295 -1.666
312 HA ALA 43 HA ALA 43 5.142 1.091 -0.045
313 1HB ALA 43 1HB ALA 43 4.866 -1.105 1.032
314 2HB ALA 43 2HB ALA 43 6.192 -0.192 1.749
315 3HB ALA 43 3HB ALA 43 6.533 -1.504 0.625
316 H MET 44 H MET 44 7.191 -0.174 -2.299
317 HA MET 44 HA MET 44 9.682 0.878 -1.166
318 1HB MET 44 1HB MET 44 10.751 -0.210 -3.044
319 2HB MET 44 2HB MET 44 9.205 -0.621 -3.738
320 1HG MET 44 1HG MET 44 10.133 -2.598 -2.830
321 2HG MET 44 2HG MET 44 8.767 -2.138 -1.832
322 1HE MET 44 1HE MET 44 10.332 -1.216 1.586
323 2HE MET 44 2HE MET 44 8.867 -1.708 0.749
324 3HE MET 44 3HE MET 44 9.604 -0.154 0.389
325 H CYS 45 H CYS 45 9.819 3.039 -1.445
326 HA CYS 45 HA CYS 45 9.354 3.941 -4.168
327 1HB CYS 45 1HB CYS 45 8.053 5.189 -2.430
328 2HB CYS 45 2HB CYS 45 9.136 6.244 -3.289
329 HA PRO 46 HA PRO 46 13.736 4.413 -4.705
330 1HB PRO 46 1HB PRO 46 13.360 5.594 -6.667
331 2HB PRO 46 2HB PRO 46 14.263 6.831 -5.785
332 1HG PRO 46 1HG PRO 46 11.843 7.335 -6.760
333 2HG PRO 46 2HG PRO 46 12.353 7.974 -5.187
334 1HD PRO 46 1HD PRO 46 10.406 5.810 -5.783
335 2HD PRO 46 2HD PRO 46 10.529 6.923 -4.421
336 H HIS 47 H HIS 47 12.510 5.534 -2.211
337 HA HIS 47 HA HIS 47 14.891 6.650 -1.037
338 1HB HIS 47 1HB HIS 47 13.408 8.267 0.221
339 2HB HIS 47 2HB HIS 47 12.149 7.918 -0.956
340 HD2 HIS 47 2HD HIS 47 15.909 9.026 -1.464
341 HE1 HIS 47 1HE HIS 47 13.460 11.454 -3.884
342 HE2 HIS 47 2HE HIS 47 15.795 10.817 -3.302
343 H GLN 48 H GLN 48 15.146 5.779 0.991
344 HA GLN 48 HA GLN 48 14.849 4.389 2.749
345 1HB GLN 48 1HB GLN 48 12.509 4.301 3.768
346 2HB GLN 48 2HB GLN 48 11.996 5.345 2.456
347 1HG GLN 48 1HG GLN 48 12.399 6.667 4.404
348 2HG GLN 48 2HG GLN 48 13.627 7.038 3.194
349 1HE2 GLN 48 1HE2 GLN 48 15.043 7.801 4.748
350 2HE2 GLN 48 2HE2 GLN 48 15.881 6.748 5.829
351 H GLU 49 H GLU 49 13.074 2.585 3.548
352 HA GLU 49 HA GLU 49 12.073 0.897 1.489
353 1HB GLU 49 1HB GLU 49 14.461 -0.020 3.116
354 2HB GLU 49 2HB GLU 49 14.515 0.377 1.409
355 1HG GLU 49 1HG GLU 49 12.908 -1.455 0.982
356 2HG GLU 49 2HG GLU 49 13.034 -1.895 2.688
357 H ILE 50 H ILE 50 13.295 1.053 4.792
358 HA ILE 50 HA ILE 50 10.839 -0.204 5.714
359 HB ILE 50 HB ILE 50 11.883 -0.158 7.975
360 1HG1 ILE 50 1HG1 ILE 50 13.328 1.836 7.646
361 2HG1 ILE 50 2HG1 ILE 50 14.320 0.906 6.526
362 1HG2 ILE 50 1HG2 ILE 50 13.551 -1.449 5.834
363 2HG2 ILE 50 2HG2 ILE 50 12.121 -2.133 6.616
364 3HG2 ILE 50 3HG2 ILE 50 13.595 -1.862 7.546
365 1HD1 ILE 50 1HD1 ILE 50 15.382 1.084 8.695
366 2HD1 ILE 50 2HD1 ILE 50 14.994 -0.588 8.297
367 3HD1 ILE 50 3HD1 ILE 50 13.992 0.299 9.447
368 H LEU 51 H LEU 51 10.133 0.961 7.955
369 HA LEU 51 HA LEU 51 9.227 2.709 9.000
370 1HB LEU 51 1HB LEU 51 10.755 4.478 7.073
371 2HB LEU 51 2HB LEU 51 11.302 3.998 8.658
372 HG LEU 51 HG LEU 51 8.913 5.766 8.138
373 1HD1 LEU 51 1HD1 LEU 51 9.014 6.226 10.536
374 2HD1 LEU 51 2HD1 LEU 51 10.314 5.049 10.705
375 3HD1 LEU 51 3HD1 LEU 51 8.702 4.521 10.209
376 1HD2 LEU 51 1HD2 LEU 51 10.990 6.870 7.500
377 2HD2 LEU 51 2HD2 LEU 51 11.695 6.472 9.067
378 3HD2 LEU 51 3HD2 LEU 51 10.331 7.581 8.972
379 H LEU 52 H LEU 52 8.903 2.411 5.589
380 HA LEU 52 HA LEU 52 6.762 4.137 5.065
381 1HB LEU 52 1HB LEU 52 6.089 2.381 3.286
382 2HB LEU 52 2HB LEU 52 7.513 1.516 3.797
383 HG LEU 52 HG LEU 52 7.880 2.773 1.750
384 1HD1 LEU 52 1HD1 LEU 52 6.344 4.560 2.078
385 2HD1 LEU 52 2HD1 LEU 52 7.955 5.203 1.747
386 3HD1 LEU 52 3HD1 LEU 52 7.319 5.210 3.392
387 1HD2 LEU 52 1HD2 LEU 52 9.805 2.385 3.193
388 2HD2 LEU 52 2HD2 LEU 52 9.454 3.871 4.078
389 3HD2 LEU 52 3HD2 LEU 52 9.944 3.948 2.385
390 H SER 53 H SER 53 6.669 0.882 6.382
391 HA SER 53 HA SER 53 3.809 0.845 6.273
392 1HB SER 53 1HB SER 53 5.191 -1.108 5.919
393 2HB SER 53 2HB SER 53 4.040 -1.445 7.139
394 HG SER 53 HG SER 53 5.670 -1.430 8.613
395 H GLU 54 H GLU 54 6.127 2.059 8.389
396 HA GLU 54 HA GLU 54 4.412 2.014 10.738
397 1HB GLU 54 1HB GLU 54 6.366 3.256 11.767
398 2HB GLU 54 2HB GLU 54 7.224 2.970 10.261
399 1HG GLU 54 1HG GLU 54 7.867 1.332 11.888
400 2HG GLU 54 2HG GLU 54 6.949 0.554 10.592
401 H GLY 55 H GLY 55 4.888 3.929 8.033
402 1HA GLY 55 1HA GLY 55 4.570 6.483 9.171
403 2HA GLY 55 2HA GLY 55 3.011 5.804 8.731
404 H SER 56 H SER 56 2.375 6.699 6.919
405 HA SER 56 HA SER 56 3.854 7.851 4.965
406 1HB SER 56 1HB SER 56 3.033 5.044 4.191
407 2HB SER 56 2HB SER 56 4.705 5.479 4.531
408 HG SER 56 HG SER 56 4.269 7.178 2.845
409 H TYR 57 H TYR 57 1.309 5.615 5.370
410 HA TYR 57 HA TYR 57 -0.505 7.378 3.886
411 1HB TYR 57 1HB TYR 57 -0.951 4.633 5.098
412 2HB TYR 57 2HB TYR 57 -0.592 4.964 3.418
413 HD1 TYR 57 1HD TYR 57 -3.220 5.008 5.969
414 HD2 TYR 57 2HD TYR 57 -2.292 5.785 1.896
415 HE1 TYR 57 1HE TYR 57 -5.621 5.055 5.426
416 HE2 TYR 57 2HE TYR 57 -4.674 5.837 1.349
417 HH TYR 57 HH TYR 57 -7.046 6.077 3.678
418 H GLU 58 H GLU 58 -1.283 8.984 5.008
419 HA GLU 58 HA GLU 58 -2.307 8.474 7.721
420 1HB GLU 58 1HB GLU 58 -2.255 11.032 7.960
421 2HB GLU 58 2HB GLU 58 -1.247 11.045 6.532
422 1HG GLU 58 1HG GLU 58 -0.525 9.699 9.119
423 2HG GLU 58 2HG GLU 58 0.025 11.286 8.618
424 H GLY 59 H GLY 59 -4.397 8.011 7.478
425 1HA GLY 59 1HA GLY 59 -6.200 10.054 6.594
426 2HA GLY 59 2HA GLY 59 -6.636 8.461 7.194
427 H GLY 60 H GLY 60 -5.206 10.031 4.436
428 1HA GLY 60 1HA GLY 60 -6.903 9.223 2.447
429 2HA GLY 60 2HA GLY 60 -5.750 7.901 2.613
430 H VAL 61 H VAL 61 -3.662 9.798 3.506
431 HA VAL 61 HA VAL 61 -2.995 10.980 0.912
432 HB VAL 61 HB VAL 61 -2.291 12.042 3.672
433 1HG1 VAL 61 1HG1 VAL 61 -1.327 13.964 2.491
434 2HG1 VAL 61 2HG1 VAL 61 -1.661 13.179 0.948
435 3HG1 VAL 61 3HG1 VAL 61 -0.505 12.462 2.068
436 1HG2 VAL 61 1HG2 VAL 61 -4.626 12.464 3.120
437 2HG2 VAL 61 2HG2 VAL 61 -4.154 13.164 1.574
438 3HG2 VAL 61 3HG2 VAL 61 -3.708 13.970 3.073
439 H ILE 62 H ILE 62 -0.950 10.329 0.125
440 HA ILE 62 HA ILE 62 0.518 8.513 1.884
441 HB ILE 62 HB ILE 62 0.940 9.038 -1.064
442 1HG1 ILE 62 1HG1 ILE 62 -0.050 6.841 -1.488
443 2HG1 ILE 62 2HG1 ILE 62 -1.198 7.846 -0.615
444 1HG2 ILE 62 1HG2 ILE 62 2.405 7.016 -0.991
445 2HG2 ILE 62 2HG2 ILE 62 2.173 6.963 0.753
446 3HG2 ILE 62 3HG2 ILE 62 2.996 8.337 0.021
447 1HD1 ILE 62 1HD1 ILE 62 -1.214 5.589 0.219
448 2HD1 ILE 62 2HD1 ILE 62 -0.624 6.716 1.459
449 3HD1 ILE 62 3HD1 ILE 62 0.508 5.691 0.582
450 H THR 63 H THR 63 2.036 9.277 2.942
451 HA THR 63 HA THR 63 3.455 11.682 2.131
452 HB THR 63 HB THR 63 3.510 10.149 4.734
453 HG1 THR 63 1HG THR 63 1.722 11.049 5.168
454 1HG2 THR 63 1HG2 THR 63 5.434 11.626 4.353
455 2HG2 THR 63 2HG2 THR 63 4.403 12.253 5.639
456 3HG2 THR 63 3HG2 THR 63 4.341 12.970 4.035
457 H CYS 64 H CYS 64 5.357 11.287 1.128
458 HA CYS 64 HA CYS 64 6.581 8.754 1.420
459 1HB CYS 64 1HB CYS 64 8.488 10.229 0.134
460 2HB CYS 64 2HB CYS 64 7.001 11.060 -0.315
461 H ARG 65 H ARG 65 9.371 9.291 1.628
462 HA ARG 65 HA ARG 65 9.225 9.948 4.496
463 1HB ARG 65 1HB ARG 65 10.767 8.077 4.954
464 2HB ARG 65 2HB ARG 65 10.619 7.578 3.281
465 1HG ARG 65 1HG ARG 65 9.201 6.157 4.537
466 2HG ARG 65 2HG ARG 65 8.162 7.272 3.660
467 1HD ARG 65 1HD ARG 65 8.899 7.529 6.577
468 2HD ARG 65 2HD ARG 65 7.377 6.899 5.968
469 HE ARG 65 HE ARG 65 7.685 9.456 4.913
470 1HH1 ARG 65 1HH1 ARG 65 7.032 7.914 8.052
471 2HH1 ARG 65 2HH1 ARG 65 6.379 9.298 8.737
472 1HH2 ARG 65 1HH2 ARG 65 6.787 11.344 5.854
473 2HH2 ARG 65 2HH2 ARG 65 6.180 11.305 7.443
474 H ALA 66 H ALA 66 11.339 9.747 1.667
475 HA ALA 66 HA ALA 66 13.279 11.144 3.346
476 1HB ALA 66 1HB ALA 66 14.994 10.594 1.794
477 2HB ALA 66 2HB ALA 66 13.824 10.049 0.624
478 3HB ALA 66 3HB ALA 66 14.081 9.111 2.114
479 H HIS 67 H HIS 67 11.088 11.562 0.787
480 HA HIS 67 HA HIS 67 12.216 14.237 0.679
481 1HB HIS 67 1HB HIS 67 12.294 12.851 -1.519
482 2HB HIS 67 2HB HIS 67 11.812 14.525 -1.606
483 HD2 HIS 67 2HD HIS 67 9.045 14.963 -1.964
484 HE1 HIS 67 1HE HIS 67 8.525 11.343 -4.017
485 HE2 HIS 67 2HE HIS 67 7.884 13.697 -3.896
486 H LEU 68 H LEU 68 10.921 15.976 0.878
487 HA LEU 68 HA LEU 68 8.928 15.615 2.811
488 1HB LEU 68 1HB LEU 68 9.671 18.111 1.278
489 2HB LEU 68 2HB LEU 68 10.536 17.506 2.663
490 HG LEU 68 HG LEU 68 9.266 19.403 3.357
491 1HD1 LEU 68 1HD1 LEU 68 6.841 19.555 3.282
492 2HD1 LEU 68 2HD1 LEU 68 6.778 18.059 2.351
493 3HD1 LEU 68 3HD1 LEU 68 7.545 19.489 1.665
494 1HD2 LEU 68 1HD2 LEU 68 7.978 16.877 4.369
495 2HD2 LEU 68 2HD2 LEU 68 7.895 18.453 5.148
496 3HD2 LEU 68 3HD2 LEU 68 9.450 17.635 4.981
497 H TRP 69 H TRP 69 8.645 16.270 -0.619
498 HA TRP 69 HA TRP 69 5.999 17.157 -0.539
499 1HB TRP 69 1HB TRP 69 5.940 16.785 -2.962
500 2HB TRP 69 2HB TRP 69 7.516 15.997 -2.863
501 HD1 TRP 69 HD TRP 69 5.865 19.426 -2.206
502 HE1 TRP 69 1HE TRP 69 7.637 21.254 -2.490
503 HE3 TRP 69 3HE TRP 69 9.980 16.471 -2.966
504 HZ2 TRP 69 2HZ TRP 69 10.407 21.436 -2.981
505 HZ3 TRP 69 3HZ TRP 69 12.146 17.562 -3.343
506 HH2 TRP 69 HH TRP 69 12.358 19.985 -3.351
507 H THR 70 H THR 70 4.282 15.956 -2.138
508 HA THR 70 HA THR 70 3.592 13.665 -0.431
509 HB THR 70 HB THR 70 1.694 15.320 -2.091
510 HG1 THR 70 1HG THR 70 2.702 16.726 -0.798
511 1HG2 THR 70 1HG2 THR 70 1.331 13.710 0.450
512 2HG2 THR 70 2HG2 THR 70 0.812 13.218 -1.161
513 3HG2 THR 70 3HG2 THR 70 0.069 14.614 -0.385
514 H PHE 71 H PHE 71 2.256 11.958 -1.360
515 HA PHE 71 HA PHE 71 2.600 11.461 -4.201
516 1HB PHE 71 1HB PHE 71 2.933 9.500 -1.902
517 2HB PHE 71 2HB PHE 71 4.283 10.301 -2.672
518 HD1 PHE 71 1HD PHE 71 1.974 7.569 -2.885
519 HD2 PHE 71 2HD PHE 71 4.873 9.827 -4.988
520 HE1 PHE 71 1HE PHE 71 2.235 5.747 -4.493
521 HE2 PHE 71 2HE PHE 71 5.122 8.017 -6.608
522 HZ PHE 71 HZ PHE 71 3.804 5.962 -6.364
523 H ASN 72 H ASN 72 0.508 10.386 -5.021
524 HA ASN 72 HA ASN 72 -1.468 10.341 -2.869
525 1HB ASN 72 1HB ASN 72 -1.933 11.513 -5.608
526 2HB ASN 72 2HB ASN 72 -1.760 12.402 -4.100
527 1HD2 ASN 72 1HD2 ASN 72 -4.013 12.433 -5.957
528 2HD2 ASN 72 2HD2 ASN 72 -5.361 11.942 -5.015
529 H ASP 73 H ASP 73 -2.491 8.524 -2.571
530 HA ASP 73 HA ASP 73 -2.409 6.352 -4.444
531 1HB ASP 73 1HB ASP 73 -2.422 5.992 -1.951
532 2HB ASP 73 2HB ASP 73 -3.639 5.052 -2.795
533 H GLY 74 H GLY 74 -4.575 8.930 -3.835
534 1HA GLY 74 1HA GLY 74 -6.646 9.475 -4.687
535 2HA GLY 74 2HA GLY 74 -6.948 7.754 -4.888
536 H THR 75 H THR 75 -4.685 10.098 -6.311
537 HA THR 75 HA THR 75 -5.848 9.899 -8.906
538 HB THR 75 HB THR 75 -3.166 11.046 -8.065
539 HG1 THR 75 1HG THR 75 -5.801 12.048 -8.160
540 1HG2 THR 75 1HG2 THR 75 -4.844 11.588 -10.530
541 2HG2 THR 75 2HG2 THR 75 -3.339 10.670 -10.507
542 3HG2 THR 75 3HG2 THR 75 -3.328 12.392 -10.117
543 H GLY 76 H GLY 76 -3.114 8.338 -7.278
544 1HA GLY 76 1HA GLY 76 -2.892 6.552 -9.596
545 2HA GLY 76 2HA GLY 76 -2.402 6.179 -7.949
546 H HIS 77 H HIS 77 -1.489 9.253 -8.589
547 HA HIS 77 HA HIS 77 1.218 8.415 -9.338
548 1HB HIS 77 1HB HIS 77 1.411 10.790 -10.347
549 2HB HIS 77 2HB HIS 77 -0.345 10.770 -10.347
550 HD1 HIS 77 1HD HIS 77 2.455 9.954 -12.405
551 HD2 HIS 77 2HD HIS 77 -1.418 8.528 -11.959
552 HE1 HIS 77 1HE HIS 77 1.959 8.680 -14.516
553 HE2 HIS 77 2HE HIS 77 -0.486 8.102 -14.316
554 H GLY 78 H GLY 78 2.869 9.857 -8.618
555 1HA GLY 78 1HA GLY 78 3.882 10.900 -6.830
556 2HA GLY 78 2HA GLY 78 2.333 10.798 -5.983
557 H ILE 79 H ILE 79 2.318 12.952 -5.299
558 HA ILE 79 HA ILE 79 1.358 14.753 -7.287
559 HB ILE 79 HB ILE 79 1.972 15.246 -4.342
560 1HG1 ILE 79 1HG1 ILE 79 0.254 13.541 -4.704
561 2HG1 ILE 79 2HG1 ILE 79 -0.626 14.626 -5.770
562 1HG2 ILE 79 1HG2 ILE 79 0.367 16.906 -6.297
563 2HG2 ILE 79 2HG2 ILE 79 1.948 17.332 -5.653
564 3HG2 ILE 79 3HG2 ILE 79 0.553 17.241 -4.575
565 1HD1 ILE 79 1HD1 ILE 79 -0.189 15.034 -2.822
566 2HD1 ILE 79 2HD1 ILE 79 -1.686 14.536 -3.609
567 3HD1 ILE 79 3HD1 ILE 79 -1.024 16.142 -3.907
568 H ASN 80 H ASN 80 4.330 14.204 -5.574
569 HA ASN 80 HA ASN 80 5.661 15.779 -7.633
570 1HB ASN 80 1HB ASN 80 6.304 15.984 -4.716
571 2HB ASN 80 2HB ASN 80 5.461 17.252 -5.576
572 1HD2 ASN 80 1HD2 ASN 80 6.671 18.452 -7.122
573 2HD2 ASN 80 2HD2 ASN 80 8.389 18.505 -7.095
574 HA PRO 81 HA PRO 81 7.434 15.904 -8.798
575 1HB PRO 81 1HB PRO 81 8.960 15.187 -10.323
576 2HB PRO 81 2HB PRO 81 8.015 13.736 -10.674
577 1HG PRO 81 1HG PRO 81 10.031 14.212 -8.506
578 2HG PRO 81 2HG PRO 81 9.813 12.784 -9.536
579 1HD PRO 81 1HD PRO 81 8.928 12.774 -7.033
580 2HD PRO 81 2HD PRO 81 7.947 12.058 -8.334
581 H ASP 82 H ASP 82 6.399 12.959 -9.939
582 HA ASP 82 HA ASP 82 3.634 13.146 -10.249
583 1HB ASP 82 1HB ASP 82 4.966 14.393 -12.676
584 2HB ASP 82 2HB ASP 82 3.880 15.216 -11.562
585 H ASP 83 H ASP 83 6.579 12.391 -11.839
586 HA ASP 83 HA ASP 83 5.591 10.537 -13.735
587 1HB ASP 83 1HB ASP 83 7.837 11.555 -13.903
588 2HB ASP 83 2HB ASP 83 7.861 9.799 -14.050
589 H CYS 84 H CYS 84 6.321 10.187 -10.382
590 HA CYS 84 HA CYS 84 6.480 7.391 -10.450
591 1HB CYS 84 1HB CYS 84 7.710 8.458 -8.832
592 2HB CYS 84 2HB CYS 84 6.391 7.697 -7.983
593 HG CYS 84 HG CYS 84 7.181 10.400 -7.074
594 H CYS 85 H CYS 85 5.074 6.072 -9.810
595 HA CYS 85 HA CYS 85 2.400 6.799 -9.063
596 1HB CYS 85 1HB CYS 85 1.789 7.024 -11.232
597 2HB CYS 85 2HB CYS 85 1.531 5.301 -10.991
598 HG CYS 85 HG CYS 85 3.600 4.357 -12.369
599 H LEU 86 H LEU 86 1.049 5.120 -8.484
600 HA LEU 86 HA LEU 86 2.641 2.826 -7.571
601 1HB LEU 86 1HB LEU 86 2.203 4.229 -5.657
602 2HB LEU 86 2HB LEU 86 1.405 2.692 -5.481
603 HG LEU 86 HG LEU 86 -0.785 3.741 -5.988
604 1HD1 LEU 86 1HD1 LEU 86 0.715 5.028 -3.693
605 2HD1 LEU 86 2HD1 LEU 86 -0.099 3.471 -3.685
606 3HD1 LEU 86 3HD1 LEU 86 -1.030 4.940 -3.888
607 1HD2 LEU 86 1HD2 LEU 86 0.764 6.333 -5.912
608 2HD2 LEU 86 2HD2 LEU 86 -0.991 6.183 -5.914
609 3HD2 LEU 86 3HD2 LEU 86 -0.069 5.657 -7.313
610 H ALA 87 H ALA 87 1.841 0.831 -7.560
611 HA ALA 87 HA ALA 87 -0.450 0.370 -9.272
612 1HB ALA 87 1HB ALA 87 1.610 -0.945 -9.645
613 2HB ALA 87 2HB ALA 87 0.258 -1.975 -9.200
614 3HB ALA 87 3HB ALA 87 1.484 -1.571 -8.004
615 H GLU 88 H GLU 88 -2.389 0.006 -8.472
616 HA GLU 88 HA GLU 88 -2.649 -0.642 -5.652
617 1HB GLU 88 1HB GLU 88 -4.784 0.096 -7.660
618 2HB GLU 88 2HB GLU 88 -3.992 1.241 -6.590
619 1HG GLU 88 1HG GLU 88 -4.887 0.062 -4.655
620 2HG GLU 88 2HG GLU 88 -5.626 -1.136 -5.708
621 H TYR 89 H TYR 89 -2.636 -2.690 -5.271
622 HA TYR 89 HA TYR 89 -3.324 -4.653 -7.236
623 1HB TYR 89 1HB TYR 89 -2.851 -6.264 -5.394
624 2HB TYR 89 2HB TYR 89 -2.619 -4.902 -4.312
625 HD1 TYR 89 1HD TYR 89 -1.019 -7.129 -6.556
626 HD2 TYR 89 2HD TYR 89 -0.738 -3.209 -4.935
627 HE1 TYR 89 1HE TYR 89 1.362 -7.055 -7.161
628 HE2 TYR 89 2HE TYR 89 1.639 -3.124 -5.539
629 HH TYR 89 HH TYR 89 3.077 -5.420 -7.596
630 HA PRO 90 HA PRO 90 -7.660 -5.068 -5.959
631 1HB PRO 90 1HB PRO 90 -8.480 -6.634 -7.472
632 2HB PRO 90 2HB PRO 90 -7.297 -7.839 -6.960
633 1HG PRO 90 1HG PRO 90 -6.999 -5.632 -8.953
634 2HG PRO 90 2HG PRO 90 -6.433 -7.306 -9.045
635 1HD PRO 90 1HD PRO 90 -4.802 -5.278 -8.429
636 2HD PRO 90 2HD PRO 90 -4.584 -6.873 -7.680
637 H VAL 91 H VAL 91 -8.105 -5.480 -3.831
638 HA VAL 91 HA VAL 91 -6.950 -7.890 -2.609
639 HB VAL 91 HB VAL 91 -7.139 -5.230 -1.175
640 1HG1 VAL 91 1HG1 VAL 91 -7.215 -7.125 0.286
641 2HG1 VAL 91 2HG1 VAL 91 -5.652 -6.317 0.462
642 3HG1 VAL 91 3HG1 VAL 91 -5.777 -7.804 -0.466
643 1HG2 VAL 91 1HG2 VAL 91 -4.727 -5.011 -1.343
644 2HG2 VAL 91 2HG2 VAL 91 -5.449 -5.049 -2.957
645 3HG2 VAL 91 3HG2 VAL 91 -4.652 -6.483 -2.298
646 H GLU 92 H GLU 92 -8.311 -8.892 -1.213
647 HA GLU 92 HA GLU 92 -10.905 -7.591 -0.653
648 1HB GLU 92 1HB GLU 92 -10.708 -10.408 -1.115
649 2HB GLU 92 2HB GLU 92 -10.700 -9.614 -2.548
650 1HG GLU 92 1HG GLU 92 -12.789 -10.002 -0.374
651 2HG GLU 92 2HG GLU 92 -12.990 -10.089 -2.134
652 H VAL 93 H VAL 93 -11.879 -8.280 1.134
653 HA VAL 93 HA VAL 93 -10.326 -9.976 2.951
654 HB VAL 93 HB VAL 93 -10.316 -7.689 3.724
655 1HG1 VAL 93 1HG1 VAL 93 -12.290 -6.811 2.698
656 2HG1 VAL 93 2HG1 VAL 93 -12.355 -6.502 4.435
657 3HG1 VAL 93 3HG1 VAL 93 -13.314 -7.806 3.733
658 1HG2 VAL 93 1HG2 VAL 93 -10.344 -9.402 5.466
659 2HG2 VAL 93 2HG2 VAL 93 -12.103 -9.409 5.444
660 3HG2 VAL 93 3HG2 VAL 93 -11.239 -7.982 6.009
661 H LYS 94 H LYS 94 -11.239 -11.867 3.380
662 HA LYS 94 HA LYS 94 -14.129 -11.938 3.463
663 1HB LYS 94 1HB LYS 94 -13.365 -12.899 1.272
664 2HB LYS 94 2HB LYS 94 -14.315 -13.997 2.229
665 1HG LYS 94 1HG LYS 94 -12.480 -15.095 1.004
666 2HG LYS 94 2HG LYS 94 -12.438 -15.380 2.737
667 1HD LYS 94 1HD LYS 94 -10.646 -13.903 3.058
668 2HD LYS 94 2HD LYS 94 -10.764 -13.265 1.432
669 1HE LYS 94 1HE LYS 94 -8.869 -14.883 1.780
670 2HE LYS 94 2HE LYS 94 -9.962 -15.371 0.501
671 1HZ LYS 94 1HZ LYS 94 -9.313 -17.210 1.920
672 2HZ LYS 94 2HZ LYS 94 -10.957 -16.972 1.898
673 3HZ LYS 94 3HZ LYS 94 -10.081 -16.511 3.255
674 H GLY 95 H GLY 95 -14.496 -12.062 5.499
675 1HA GLY 95 1HA GLY 95 -13.923 -14.477 6.895
676 2HA GLY 95 2HA GLY 95 -14.719 -13.058 7.553
677 H ASP 96 H ASP 96 -12.059 -14.905 7.630
678 HA ASP 96 HA ASP 96 -10.550 -12.883 9.251
679 1HB ASP 96 1HB ASP 96 -9.401 -14.758 10.202
680 2HB ASP 96 2HB ASP 96 -10.294 -15.881 9.202
681 H ASP 97 H ASP 97 -10.555 -14.006 6.181
682 HA ASP 97 HA ASP 97 -7.645 -13.743 6.178
683 1HB ASP 97 1HB ASP 97 -7.611 -15.265 4.261
684 2HB ASP 97 2HB ASP 97 -9.329 -15.549 4.477
685 H ILE 98 H ILE 98 -6.687 -12.901 4.257
686 HA ILE 98 HA ILE 98 -8.504 -11.190 2.716
687 HB ILE 98 HB ILE 98 -5.864 -10.473 3.995
688 1HG1 ILE 98 1HG1 ILE 98 -7.849 -10.379 5.436
689 2HG1 ILE 98 2HG1 ILE 98 -8.611 -9.284 4.280
690 1HG2 ILE 98 1HG2 ILE 98 -5.913 -9.513 1.744
691 2HG2 ILE 98 2HG2 ILE 98 -6.089 -8.247 2.958
692 3HG2 ILE 98 3HG2 ILE 98 -7.500 -8.814 2.065
693 1HD1 ILE 98 1HD1 ILE 98 -7.746 -8.072 6.198
694 2HD1 ILE 98 2HD1 ILE 98 -6.972 -7.595 4.686
695 3HD1 ILE 98 3HD1 ILE 98 -6.130 -8.663 5.807
696 H TYR 99 H TYR 99 -8.230 -11.284 0.535
697 HA TYR 99 HA TYR 99 -5.805 -12.590 -0.373
698 1HB TYR 99 1HB TYR 99 -7.713 -14.015 -0.724
699 2HB TYR 99 2HB TYR 99 -7.017 -13.574 -2.274
700 HD1 TYR 99 1HD TYR 99 -8.276 -12.079 -3.781
701 HD2 TYR 99 2HD TYR 99 -9.908 -13.626 -0.226
702 HE1 TYR 99 1HE TYR 99 -10.539 -11.703 -4.675
703 HE2 TYR 99 2HE TYR 99 -12.186 -13.252 -1.072
704 HH TYR 99 HH TYR 99 -13.338 -11.888 -2.731
705 H VAL 100 H VAL 100 -4.758 -11.914 -2.139
706 HA VAL 100 HA VAL 100 -5.588 -9.335 -3.210
707 HB VAL 100 HB VAL 100 -3.992 -8.806 -1.509
708 1HG1 VAL 100 1HG1 VAL 100 -2.123 -10.761 -2.868
709 2HG1 VAL 100 2HG1 VAL 100 -2.903 -11.000 -1.315
710 3HG1 VAL 100 3HG1 VAL 100 -1.682 -9.725 -1.506
711 1HG2 VAL 100 1HG2 VAL 100 -2.240 -7.665 -2.794
712 2HG2 VAL 100 2HG2 VAL 100 -3.794 -7.550 -3.646
713 3HG2 VAL 100 3HG2 VAL 100 -2.586 -8.702 -4.170
714 H SER 101 H SER 101 -5.085 -9.034 -5.202
715 HA SER 101 HA SER 101 -4.129 -11.361 -6.701
716 1HB SER 101 1HB SER 101 -5.224 -8.734 -7.756
717 2HB SER 101 2HB SER 101 -6.167 -10.195 -7.508
718 HG SER 101 HG SER 101 -4.576 -9.528 -9.603
719 H THR 102 H THR 102 -2.058 -11.535 -6.950
720 HA THR 102 HA THR 102 -0.439 -9.108 -7.202
721 HB THR 102 HB THR 102 1.486 -10.593 -6.531
722 HG1 THR 102 1HG THR 102 0.323 -12.513 -5.245
723 1HG2 THR 102 1HG2 THR 102 0.891 -10.648 -4.142
724 2HG2 THR 102 2HG2 THR 102 -0.805 -10.393 -4.569
725 3HG2 THR 102 3HG2 THR 102 0.385 -9.134 -4.897
726 H LYS 103 H LYS 103 -1.002 -12.309 -8.472
727 HA LYS 103 HA LYS 103 0.917 -12.140 -10.545
728 1HB LYS 103 1HB LYS 103 -1.539 -13.900 -10.392
729 2HB LYS 103 2HB LYS 103 -0.014 -14.273 -9.615
730 1HG LYS 103 1HG LYS 103 -0.383 -13.949 -12.586
731 2HG LYS 103 2HG LYS 103 -0.351 -15.491 -11.721
732 1HD LYS 103 1HD LYS 103 1.904 -15.021 -10.938
733 2HD LYS 103 2HD LYS 103 1.905 -13.488 -11.808
734 1HE LYS 103 1HE LYS 103 1.664 -14.660 -13.916
735 2HE LYS 103 2HE LYS 103 1.600 -16.204 -13.063
736 1HZ LYS 103 1HZ LYS 103 3.823 -15.837 -12.270
737 2HZ LYS 103 2HZ LYS 103 3.910 -14.349 -13.022
738 3HZ LYS 103 3HZ LYS 103 3.807 -15.760 -13.954
739 H GLY 104 H GLY 104 0.771 -10.734 -12.128
740 1HA GLY 104 1HA GLY 104 -1.876 -10.075 -13.232
741 2HA GLY 104 2HA GLY 104 -0.421 -10.229 -14.217
742 H ILE 105 H ILE 105 -0.320 -8.817 -11.061
743 HA ILE 105 HA ILE 105 -0.235 -6.136 -12.219
744 HB ILE 105 HB ILE 105 -0.359 -6.961 -9.295
745 1HG1 ILE 105 1HG1 ILE 105 -2.660 -6.136 -9.312
746 2HG1 ILE 105 2HG1 ILE 105 -2.473 -7.424 -10.494
747 1HG2 ILE 105 1HG2 ILE 105 -0.544 -4.213 -10.548
748 2HG2 ILE 105 2HG2 ILE 105 0.796 -4.830 -9.585
749 3HG2 ILE 105 3HG2 ILE 105 -0.782 -4.575 -8.838
750 1HD1 ILE 105 1HD1 ILE 105 -3.859 -5.623 -11.359
751 2HD1 ILE 105 2HD1 ILE 105 -2.374 -5.779 -12.295
752 3HD1 ILE 105 3HD1 ILE 105 -2.542 -4.481 -11.107
753 H LEU 106 H LEU 106 1.651 -5.365 -12.663
754 HA LEU 106 HA LEU 106 4.030 -6.486 -11.408
755 1HB LEU 106 1HB LEU 106 3.676 -4.774 -13.903
756 2HB LEU 106 2HB LEU 106 3.791 -6.511 -13.909
757 HG LEU 106 HG LEU 106 6.178 -6.265 -13.043
758 1HD1 LEU 106 1HD1 LEU 106 5.460 -5.116 -15.742
759 2HD1 LEU 106 2HD1 LEU 106 5.624 -6.830 -15.357
760 3HD1 LEU 106 3HD1 LEU 106 7.030 -5.770 -15.284
761 1HD2 LEU 106 1HD2 LEU 106 5.723 -3.428 -13.969
762 2HD2 LEU 106 2HD2 LEU 106 7.268 -4.140 -13.519
763 3HD2 LEU 106 3HD2 LEU 106 6.009 -3.921 -12.301
764 HA PRO 107 HA PRO 107 4.226 -2.871 -8.751
765 1HB PRO 107 1HB PRO 107 6.233 -3.026 -7.658
766 2HB PRO 107 2HB PRO 107 7.163 -3.060 -9.152
767 1HG PRO 107 1HG PRO 107 5.701 -5.273 -7.757
768 2HG PRO 107 2HG PRO 107 7.311 -5.281 -8.501
769 1HD PRO 107 1HD PRO 107 5.157 -6.318 -9.731
770 2HD PRO 107 2HD PRO 107 6.462 -5.518 -10.636
771 H ASN 108 H ASN 108 3.991 -0.905 -9.264
772 HA ASN 108 HA ASN 108 4.762 0.074 -11.887
773 1HB ASN 108 1HB ASN 108 3.215 1.579 -9.748
774 2HB ASN 108 2HB ASN 108 2.461 0.362 -10.766
775 1HD2 ASN 108 1HD2 ASN 108 1.004 1.830 -11.540
776 2HD2 ASN 108 2HD2 ASN 108 1.417 2.979 -12.739
777 H LYS 109 H LYS 109 5.375 2.549 -11.775
778 HA LYS 109 HA LYS 109 7.958 2.672 -10.591
779 1HB LYS 109 1HB LYS 109 7.940 4.947 -11.533
780 2HB LYS 109 2HB LYS 109 6.336 4.538 -12.151
781 1HG LYS 109 1HG LYS 109 7.968 4.181 -13.950
782 2HG LYS 109 2HG LYS 109 7.387 2.612 -13.382
783 1HD LYS 109 1HD LYS 109 9.379 2.401 -11.955
784 2HD LYS 109 2HD LYS 109 9.949 3.962 -12.534
785 1HE LYS 109 1HE LYS 109 10.043 3.067 -14.819
786 2HE LYS 109 2HE LYS 109 9.546 1.489 -14.204
787 1HZ LYS 109 1HZ LYS 109 11.926 1.540 -14.420
788 2HZ LYS 109 2HZ LYS 109 11.595 1.551 -12.761
789 3HZ LYS 109 3HZ LYS 109 12.021 2.965 -13.555
790 H ALA 110 H ALA 110 6.621 2.443 -8.652
791 HA ALA 110 HA ALA 110 6.174 4.959 -7.193
792 1HB ALA 110 1HB ALA 110 4.877 2.984 -6.480
793 2HB ALA 110 2HB ALA 110 5.924 3.526 -5.168
794 3HB ALA 110 3HB ALA 110 6.374 2.119 -6.132
795 H HIS 111 H HIS 111 8.515 2.777 -8.039
796 HA HIS 111 HA HIS 111 10.689 4.330 -6.940
797 1HB HIS 111 1HB HIS 111 10.431 2.345 -5.394
798 2HB HIS 111 2HB HIS 111 11.931 2.314 -6.302
799 HD1 HIS 111 1HD HIS 111 12.279 0.387 -8.000
800 HD2 HIS 111 2HD HIS 111 8.623 0.240 -6.035
801 HE1 HIS 111 1HE HIS 111 11.354 -1.855 -8.503
802 HE2 HIS 111 2HE HIS 111 9.464 -2.043 -6.903
803 H SER 112 H SER 112 12.554 4.040 -8.360
804 HA SER 112 HA SER 112 11.734 3.637 -11.020
805 1HB SER 112 1HB SER 112 14.067 4.198 -11.541
806 2HB SER 112 2HB SER 112 14.483 4.028 -9.831
807 HG SER 112 HG SER 112 12.625 5.864 -10.942
Start of MODEL 7
1 1H MET 1 1HT MET 1 -3.624 -18.863 -6.276
2 2H MET 1 2HT MET 1 -3.050 -17.456 -5.626
3 3H MET 1 3HT MET 1 -2.065 -18.804 -5.623
4 HA MET 1 HA MET 1 -1.416 -17.248 -7.400
5 1HB MET 1 1HB MET 1 -1.675 -18.704 -9.380
6 2HB MET 1 2HB MET 1 -2.930 -19.615 -8.561
7 1HG MET 1 1HG MET 1 -1.320 -20.422 -6.940
8 2HG MET 1 2HG MET 1 -0.052 -19.462 -7.695
9 1HE MET 1 1HE MET 1 1.447 -21.664 -7.821
10 2HE MET 1 2HE MET 1 0.934 -23.156 -8.605
11 3HE MET 1 3HE MET 1 0.145 -22.624 -7.117
12 H SER 2 H SER 2 -2.097 -15.537 -8.638
13 HA SER 2 HA SER 2 -3.473 -13.846 -9.147
14 1HB SER 2 1HB SER 2 -5.476 -14.397 -10.552
15 2HB SER 2 2HB SER 2 -5.237 -16.102 -10.166
16 HG SER 2 HG SER 2 -3.491 -16.178 -11.383
17 H PHE 3 H PHE 3 -3.938 -12.938 -7.306
18 HA PHE 3 HA PHE 3 -4.890 -12.410 -5.363
19 1HB PHE 3 1HB PHE 3 -7.150 -13.358 -4.692
20 2HB PHE 3 2HB PHE 3 -7.179 -14.219 -6.222
21 HD1 PHE 3 1HD PHE 3 -7.347 -10.925 -4.652
22 HD2 PHE 3 2HD PHE 3 -7.704 -13.133 -8.268
23 HE1 PHE 3 1HE PHE 3 -8.404 -8.993 -5.715
24 HE2 PHE 3 2HE PHE 3 -8.767 -11.194 -9.344
25 HZ PHE 3 HZ PHE 3 -9.116 -9.121 -8.069
26 H GLU 4 H GLU 4 -3.430 -13.142 -4.085
27 HA GLU 4 HA GLU 4 -3.699 -15.923 -3.216
28 1HB GLU 4 1HB GLU 4 -1.159 -14.288 -3.401
29 2HB GLU 4 2HB GLU 4 -1.653 -15.512 -4.562
30 1HG GLU 4 1HG GLU 4 -0.987 -15.945 -1.673
31 2HG GLU 4 2HG GLU 4 -0.004 -16.417 -3.064
32 H LYS 5 H LYS 5 -3.305 -16.312 -1.024
33 HA LYS 5 HA LYS 5 -4.307 -14.234 0.664
34 1HB LYS 5 1HB LYS 5 -3.150 -16.922 1.445
35 2HB LYS 5 2HB LYS 5 -4.815 -16.639 0.941
36 1HG LYS 5 1HG LYS 5 -4.865 -16.856 3.303
37 2HG LYS 5 2HG LYS 5 -5.135 -15.163 2.927
38 1HD LYS 5 1HD LYS 5 -3.688 -15.309 4.838
39 2HD LYS 5 2HD LYS 5 -2.786 -14.661 3.470
40 1HE LYS 5 1HE LYS 5 -1.768 -16.832 3.067
41 2HE LYS 5 2HE LYS 5 -2.716 -17.524 4.380
42 1HZ LYS 5 1HZ LYS 5 -0.648 -15.395 4.720
43 2HZ LYS 5 2HZ LYS 5 -0.462 -17.011 5.081
44 3HZ LYS 5 3HZ LYS 5 -1.566 -16.105 5.943
45 H ILE 6 H ILE 6 -3.193 -12.723 1.164
46 HA ILE 6 HA ILE 6 -0.272 -12.858 1.400
47 HB ILE 6 HB ILE 6 -1.210 -11.021 0.097
48 1HG1 ILE 6 1HG1 ILE 6 0.105 -10.059 2.639
49 2HG1 ILE 6 2HG1 ILE 6 -0.084 -9.070 1.196
50 1HG2 ILE 6 1HG2 ILE 6 -2.557 -10.115 2.608
51 2HG2 ILE 6 2HG2 ILE 6 -3.329 -10.721 1.150
52 3HG2 ILE 6 3HG2 ILE 6 -2.468 -9.173 1.118
53 1HD1 ILE 6 1HD1 ILE 6 2.145 -9.983 1.322
54 2HD1 ILE 6 2HD1 ILE 6 1.282 -10.654 -0.062
55 3HD1 ILE 6 3HD1 ILE 6 1.488 -11.616 1.401
56 H CYS 7 H CYS 7 -3.109 -12.089 3.207
57 HA CYS 7 HA CYS 7 -1.787 -12.589 5.733
58 1HB CYS 7 1HB CYS 7 -2.467 -10.465 6.688
59 2HB CYS 7 2HB CYS 7 -3.128 -9.949 5.157
60 HG CYS 7 HG CYS 7 -0.019 -10.825 4.810
61 H SER 8 H SER 8 -3.443 -12.223 7.454
62 HA SER 8 HA SER 8 -6.168 -12.764 6.598
63 1HB SER 8 1HB SER 8 -6.412 -14.152 8.430
64 2HB SER 8 2HB SER 8 -4.982 -13.654 9.254
65 HG SER 8 HG SER 8 -3.855 -15.037 7.989
66 H LEU 9 H LEU 9 -7.662 -11.743 8.075
67 HA LEU 9 HA LEU 9 -7.134 -9.011 8.464
68 1HB LEU 9 1HB LEU 9 -9.141 -10.664 9.938
69 2HB LEU 9 2HB LEU 9 -9.353 -10.132 8.292
70 HG LEU 9 HG LEU 9 -8.980 -8.266 10.629
71 1HD1 LEU 9 1HD1 LEU 9 -9.909 -6.566 9.151
72 2HD1 LEU 9 2HD1 LEU 9 -9.953 -7.744 7.841
73 3HD1 LEU 9 3HD1 LEU 9 -8.408 -7.253 8.533
74 1HD2 LEU 9 1HD2 LEU 9 -11.410 -7.889 10.548
75 2HD2 LEU 9 2HD2 LEU 9 -10.994 -9.539 11.003
76 3HD2 LEU 9 3HD2 LEU 9 -11.549 -9.195 9.366
77 H ASP 10 H ASP 10 -6.627 -11.716 10.573
78 HA ASP 10 HA ASP 10 -6.215 -10.271 13.003
79 1HB ASP 10 1HB ASP 10 -5.147 -12.985 12.195
80 2HB ASP 10 2HB ASP 10 -6.703 -12.693 12.957
81 H ASP 11 H ASP 11 -4.275 -10.774 10.209
82 HA ASP 11 HA ASP 11 -1.747 -10.064 11.489
83 1HB ASP 11 1HB ASP 11 -0.813 -10.091 9.192
84 2HB ASP 11 2HB ASP 11 -2.427 -10.400 8.577
85 H ILE 12 H ILE 12 -4.232 -8.675 9.452
86 HA ILE 12 HA ILE 12 -2.921 -6.107 9.786
87 HB ILE 12 HB ILE 12 -2.311 -6.727 7.679
88 1HG1 ILE 12 1HG1 ILE 12 -4.557 -4.758 7.513
89 2HG1 ILE 12 2HG1 ILE 12 -3.433 -5.027 6.192
90 1HG2 ILE 12 1HG2 ILE 12 -5.206 -7.308 7.000
91 2HG2 ILE 12 2HG2 ILE 12 -3.903 -8.486 7.141
92 3HG2 ILE 12 3HG2 ILE 12 -3.898 -7.321 5.816
93 1HD1 ILE 12 1HD1 ILE 12 -2.707 -4.075 8.963
94 2HD1 ILE 12 2HD1 ILE 12 -2.769 -3.087 7.505
95 3HD1 ILE 12 3HD1 ILE 12 -1.569 -4.371 7.651
96 H TRP 13 H TRP 13 -4.094 -4.762 10.671
97 HA TRP 13 HA TRP 13 -6.985 -5.213 10.828
98 1HB TRP 13 1HB TRP 13 -6.831 -3.866 12.921
99 2HB TRP 13 2HB TRP 13 -5.094 -3.799 12.685
100 HD1 TRP 13 HD TRP 13 -3.871 -6.344 12.550
101 HE1 TRP 13 1HE TRP 13 -4.321 -8.366 14.067
102 HE3 TRP 13 3HE TRP 13 -8.480 -5.011 14.300
103 HZ2 TRP 13 2HZ TRP 13 -6.370 -9.279 15.794
104 HZ3 TRP 13 3HZ TRP 13 -9.617 -6.510 15.880
105 HH2 TRP 13 HH TRP 13 -8.584 -8.598 16.610
106 H VAL 14 H VAL 14 -8.320 -3.147 11.178
107 HA VAL 14 HA VAL 14 -7.815 -1.461 9.060
108 HB VAL 14 HB VAL 14 -9.844 -0.381 9.896
109 1HG1 VAL 14 1HG1 VAL 14 -11.347 -2.295 9.363
110 2HG1 VAL 14 2HG1 VAL 14 -9.978 -3.386 9.580
111 3HG1 VAL 14 3HG1 VAL 14 -9.970 -2.211 8.267
112 1HG2 VAL 14 1HG2 VAL 14 -9.823 -2.554 11.993
113 2HG2 VAL 14 2HG2 VAL 14 -11.171 -1.467 11.673
114 3HG2 VAL 14 3HG2 VAL 14 -9.646 -0.822 12.277
115 H GLY 15 H GLY 15 -6.957 0.452 9.035
116 1HA GLY 15 1HA GLY 15 -6.584 2.022 11.467
117 2HA GLY 15 2HA GLY 15 -6.240 2.539 9.820
118 H GLU 16 H GLU 16 -4.923 -0.313 9.738
119 HA GLU 16 HA GLU 16 -2.382 0.626 10.770
120 1HB GLU 16 1HB GLU 16 -1.923 -1.915 11.267
121 2HB GLU 16 2HB GLU 16 -3.644 -2.060 11.035
122 1HG GLU 16 1HG GLU 16 -4.143 -0.572 12.831
123 2HG GLU 16 2HG GLU 16 -2.452 -0.151 13.030
124 H MET 17 H MET 17 -0.505 0.022 9.649
125 HA MET 17 HA MET 17 -0.947 -0.907 6.886
126 1HB MET 17 1HB MET 17 0.646 0.741 6.202
127 2HB MET 17 2HB MET 17 0.921 1.247 7.855
128 1HG MET 17 1HG MET 17 -1.394 1.906 7.966
129 2HG MET 17 2HG MET 17 -1.573 1.658 6.219
130 1HE MET 17 1HE MET 17 1.565 2.601 5.654
131 2HE MET 17 2HE MET 17 1.271 4.255 5.087
132 3HE MET 17 3HE MET 17 0.236 2.930 4.535
133 H GLU 18 H GLU 18 0.495 -2.507 6.412
134 HA GLU 18 HA GLU 18 3.114 -2.326 7.564
135 1HB GLU 18 1HB GLU 18 3.310 -4.742 8.023
136 2HB GLU 18 2HB GLU 18 1.568 -4.908 7.879
137 1HG GLU 18 1HG GLU 18 1.198 -3.599 9.818
138 2HG GLU 18 2HG GLU 18 2.881 -3.081 9.866
139 H THR 19 H THR 19 4.703 -2.950 6.278
140 HA THR 19 HA THR 19 4.182 -3.639 3.572
141 HB THR 19 HB THR 19 6.782 -3.913 5.111
142 HG1 THR 19 1HG THR 19 7.110 -1.812 4.793
143 1HG2 THR 19 1HG2 THR 19 7.815 -3.496 2.910
144 2HG2 THR 19 2HG2 THR 19 6.212 -3.412 2.181
145 3HG2 THR 19 3HG2 THR 19 6.787 -4.928 2.873
146 H PHE 20 H PHE 20 4.013 -5.655 2.702
147 HA PHE 20 HA PHE 20 4.906 -7.930 4.291
148 1HB PHE 20 1HB PHE 20 2.917 -9.237 3.337
149 2HB PHE 20 2HB PHE 20 2.263 -7.702 2.825
150 HD1 PHE 20 1HD PHE 20 1.160 -6.261 4.338
151 HD2 PHE 20 2HD PHE 20 3.221 -9.682 5.782
152 HE1 PHE 20 1HE PHE 20 0.105 -5.957 6.534
153 HE2 PHE 20 2HE PHE 20 2.170 -9.389 7.987
154 HZ PHE 20 HZ PHE 20 0.609 -7.525 8.368
155 H GLU 21 H GLU 21 5.183 -9.894 2.971
156 HA GLU 21 HA GLU 21 6.453 -9.160 0.437
157 1HB GLU 21 1HB GLU 21 6.939 -11.460 2.337
158 2HB GLU 21 2HB GLU 21 7.958 -10.040 2.122
159 1HG GLU 21 1HG GLU 21 8.444 -10.718 -0.163
160 2HG GLU 21 2HG GLU 21 7.418 -12.135 0.035
161 H THR 22 H THR 22 5.809 -10.145 -1.344
162 HA THR 22 HA THR 22 3.448 -11.828 -1.217
163 HB THR 22 HB THR 22 3.448 -11.747 -3.652
164 HG1 THR 22 1HG THR 22 5.109 -10.770 -4.754
165 1HG2 THR 22 1HG2 THR 22 3.306 -9.328 -3.999
166 2HG2 THR 22 2HG2 THR 22 4.214 -9.063 -2.521
167 3HG2 THR 22 3HG2 THR 22 2.592 -9.763 -2.440
168 H SER 23 H SER 23 3.495 -13.871 -2.757
169 HA SER 23 HA SER 23 5.352 -15.669 -1.645
170 1HB SER 23 1HB SER 23 4.253 -17.313 -3.083
171 2HB SER 23 2HB SER 23 3.495 -15.984 -3.967
172 HG SER 23 HG SER 23 3.211 -16.430 -1.189
173 H ASP 24 H ASP 24 5.502 -13.640 -4.357
174 HA ASP 24 HA ASP 24 7.660 -15.179 -5.579
175 1HB ASP 24 1HB ASP 24 7.556 -13.399 -7.391
176 2HB ASP 24 2HB ASP 24 6.149 -12.759 -6.554
177 H GLY 25 H GLY 25 7.478 -13.156 -3.109
178 1HA GLY 25 1HA GLY 25 10.283 -12.502 -3.330
179 2HA GLY 25 2HA GLY 25 9.265 -12.261 -1.922
180 H THR 26 H THR 26 7.268 -10.735 -3.528
181 HA THR 26 HA THR 26 8.820 -8.330 -4.091
182 HB THR 26 HB THR 26 5.877 -8.873 -4.568
183 HG1 THR 26 1HG THR 26 8.104 -9.762 -5.759
184 1HG2 THR 26 1HG2 THR 26 6.514 -6.477 -4.521
185 2HG2 THR 26 2HG2 THR 26 6.071 -6.992 -6.149
186 3HG2 THR 26 3HG2 THR 26 7.769 -6.796 -5.720
187 H GLU 27 H GLU 27 8.681 -6.530 -2.811
188 HA GLU 27 HA GLU 27 7.263 -6.786 -0.307
189 1HB GLU 27 1HB GLU 27 8.418 -4.648 0.250
190 2HB GLU 27 2HB GLU 27 9.097 -4.610 -1.361
191 1HG GLU 27 1HG GLU 27 10.794 -5.396 0.079
192 2HG GLU 27 2HG GLU 27 10.224 -6.783 -0.843
193 H VAL 28 H VAL 28 5.331 -5.853 0.006
194 HA VAL 28 HA VAL 28 4.422 -3.636 -1.725
195 HB VAL 28 HB VAL 28 2.853 -6.139 -0.957
196 1HG1 VAL 28 1HG1 VAL 28 1.041 -5.322 -2.370
197 2HG1 VAL 28 2HG1 VAL 28 1.917 -3.809 -2.594
198 3HG1 VAL 28 3HG1 VAL 28 1.354 -4.272 -0.987
199 1HG2 VAL 28 1HG2 VAL 28 2.758 -6.641 -3.366
200 2HG2 VAL 28 2HG2 VAL 28 4.404 -6.632 -2.739
201 3HG2 VAL 28 3HG2 VAL 28 3.813 -5.260 -3.675
202 H LEU 29 H LEU 29 2.967 -2.261 -0.695
203 HA LEU 29 HA LEU 29 3.106 -2.284 2.266
204 1HB LEU 29 1HB LEU 29 1.980 -0.068 0.590
205 2HB LEU 29 2HB LEU 29 3.710 -0.247 0.612
206 HG LEU 29 HG LEU 29 2.884 1.487 2.133
207 1HD1 LEU 29 1HD1 LEU 29 1.802 0.940 4.223
208 2HD1 LEU 29 2HD1 LEU 29 1.592 -0.726 3.662
209 3HD1 LEU 29 3HD1 LEU 29 0.796 0.601 2.816
210 1HD2 LEU 29 1HD2 LEU 29 4.232 -0.816 3.520
211 2HD2 LEU 29 2HD2 LEU 29 4.205 0.856 4.079
212 3HD2 LEU 29 3HD2 LEU 29 5.015 0.446 2.569
213 H ILE 30 H ILE 30 1.361 -3.129 3.210
214 HA ILE 30 HA ILE 30 -1.170 -3.178 1.736
215 HB ILE 30 HB ILE 30 -0.358 -4.710 4.229
216 1HG1 ILE 30 1HG1 ILE 30 -0.257 -6.706 2.804
217 2HG1 ILE 30 2HG1 ILE 30 0.873 -5.485 2.232
218 1HG2 ILE 30 1HG2 ILE 30 -2.749 -4.318 4.171
219 2HG2 ILE 30 2HG2 ILE 30 -2.406 -6.023 3.875
220 3HG2 ILE 30 3HG2 ILE 30 -2.840 -4.966 2.533
221 1HD1 ILE 30 1HD1 ILE 30 -0.659 -4.869 0.453
222 2HD1 ILE 30 2HD1 ILE 30 -1.805 -6.080 1.020
223 3HD1 ILE 30 3HD1 ILE 30 -0.235 -6.579 0.387
224 H VAL 31 H VAL 31 -2.557 -1.592 2.219
225 HA VAL 31 HA VAL 31 -2.541 -0.541 4.983
226 HB VAL 31 HB VAL 31 -3.621 0.774 2.469
227 1HG1 VAL 31 1HG1 VAL 31 -4.824 1.480 4.430
228 2HG1 VAL 31 2HG1 VAL 31 -3.814 2.801 3.842
229 3HG1 VAL 31 3HG1 VAL 31 -3.322 1.880 5.259
230 1HG2 VAL 31 1HG2 VAL 31 -1.735 2.356 2.676
231 2HG2 VAL 31 2HG2 VAL 31 -1.224 0.702 2.345
232 3HG2 VAL 31 3HG2 VAL 31 -1.079 1.356 3.977
233 H ASN 32 H ASN 32 -4.278 -1.233 6.122
234 HA ASN 32 HA ASN 32 -6.698 -1.812 4.566
235 1HB ASN 32 1HB ASN 32 -5.870 -2.950 7.250
236 2HB ASN 32 2HB ASN 32 -5.778 -3.803 5.714
237 1HD2 ASN 32 1HD2 ASN 32 -7.201 -4.633 8.038
238 2HD2 ASN 32 2HD2 ASN 32 -8.865 -4.723 7.602
239 H SER 33 H SER 33 -7.925 -0.101 4.626
240 HA SER 33 HA SER 33 -8.159 1.435 7.087
241 1HB SER 33 1HB SER 33 -9.128 3.141 5.651
242 2HB SER 33 2HB SER 33 -9.169 2.006 4.299
243 HG SER 33 HG SER 33 -6.719 2.124 5.357
244 H GLU 34 H GLU 34 -10.293 1.847 7.933
245 HA GLU 34 HA GLU 34 -12.051 -0.416 7.714
246 1HB GLU 34 1HB GLU 34 -12.715 2.187 9.067
247 2HB GLU 34 2HB GLU 34 -11.497 1.134 9.757
248 1HG GLU 34 1HG GLU 34 -13.625 0.842 10.867
249 2HG GLU 34 2HG GLU 34 -13.121 -0.631 10.059
250 H GLU 35 H GLU 35 -12.301 3.070 6.975
251 HA GLU 35 HA GLU 35 -14.834 2.738 5.590
252 1HB GLU 35 1HB GLU 35 -14.679 5.159 5.174
253 2HB GLU 35 2HB GLU 35 -13.062 5.170 5.845
254 1HG GLU 35 1HG GLU 35 -13.921 4.575 8.021
255 2HG GLU 35 2HG GLU 35 -15.560 4.515 7.371
256 H HIS 36 H HIS 36 -11.538 3.595 4.803
257 HA HIS 36 HA HIS 36 -12.095 3.951 2.010
258 1HB HIS 36 1HB HIS 36 -9.549 4.066 3.629
259 2HB HIS 36 2HB HIS 36 -10.482 5.399 2.984
260 HD1 HIS 36 1HD HIS 36 -7.485 3.773 2.429
261 HD2 HIS 36 2HD HIS 36 -10.431 5.247 -0.073
262 HE1 HIS 36 1HE HIS 36 -6.369 4.086 0.184
263 HE2 HIS 36 2HE HIS 36 -8.065 5.437 -1.059
264 H GLY 37 H GLY 37 -11.400 1.265 3.899
265 1HA GLY 37 1HA GLY 37 -11.322 -0.323 1.512
266 2HA GLY 37 2HA GLY 37 -11.479 -0.904 3.162
267 H VAL 38 H VAL 38 -9.927 -2.331 1.665
268 HA VAL 38 HA VAL 38 -7.277 -1.633 2.609
269 HB VAL 38 HB VAL 38 -8.106 -3.634 3.680
270 1HG1 VAL 38 1HG1 VAL 38 -8.530 -4.778 0.935
271 2HG1 VAL 38 2HG1 VAL 38 -9.777 -4.354 2.111
272 3HG1 VAL 38 3HG1 VAL 38 -8.663 -5.678 2.444
273 1HG2 VAL 38 1HG2 VAL 38 -5.731 -3.619 3.211
274 2HG2 VAL 38 2HG2 VAL 38 -6.010 -4.284 1.611
275 3HG2 VAL 38 3HG2 VAL 38 -6.345 -5.267 3.041
276 H LYS 39 H LYS 39 -5.744 -1.271 1.279
277 HA LYS 39 HA LYS 39 -5.943 -2.177 -1.491
278 1HB LYS 39 1HB LYS 39 -4.826 0.011 -2.119
279 2HB LYS 39 2HB LYS 39 -5.268 0.589 -0.526
280 1HG LYS 39 1HG LYS 39 -7.648 0.200 -1.071
281 2HG LYS 39 2HG LYS 39 -7.158 -0.262 -2.705
282 1HD LYS 39 1HD LYS 39 -6.017 1.977 -2.876
283 2HD LYS 39 2HD LYS 39 -6.786 2.384 -1.338
284 1HE LYS 39 1HE LYS 39 -8.088 3.320 -3.101
285 2HE LYS 39 2HE LYS 39 -8.993 2.001 -2.360
286 1HZ LYS 39 1HZ LYS 39 -7.448 1.837 -4.885
287 2HZ LYS 39 2HZ LYS 39 -9.110 1.971 -4.797
288 3HZ LYS 39 3HZ LYS 39 -8.347 0.570 -4.229
289 H ALA 40 H ALA 40 -3.971 -2.506 -2.530
290 HA ALA 40 HA ALA 40 -1.627 -2.579 -0.778
291 1HB ALA 40 1HB ALA 40 -0.951 -4.608 -1.988
292 2HB ALA 40 2HB ALA 40 -2.471 -4.564 -2.889
293 3HB ALA 40 3HB ALA 40 -2.485 -4.826 -1.148
294 H TYR 41 H TYR 41 0.061 -1.493 -1.589
295 HA TYR 41 HA TYR 41 0.112 -0.923 -4.496
296 1HB TYR 41 1HB TYR 41 0.616 1.258 -4.176
297 2HB TYR 41 2HB TYR 41 1.313 1.087 -2.611
298 HD1 TYR 41 1HD TYR 41 -1.839 1.500 -4.477
299 HD2 TYR 41 2HD TYR 41 -0.026 1.364 -0.638
300 HE1 TYR 41 1HE TYR 41 -3.865 2.503 -3.477
301 HE2 TYR 41 2HE TYR 41 -2.028 2.353 0.367
302 HH TYR 41 HH TYR 41 -3.896 3.764 -0.336
303 H GLN 42 H GLN 42 2.442 -0.539 -5.179
304 HA GLN 42 HA GLN 42 4.287 -2.309 -4.052
305 1HB GLN 42 1HB GLN 42 6.072 -1.033 -5.240
306 2HB GLN 42 2HB GLN 42 4.978 0.256 -5.604
307 1HG GLN 42 1HG GLN 42 5.200 -1.103 -7.514
308 2HG GLN 42 2HG GLN 42 3.605 -1.453 -6.843
309 1HE2 GLN 42 1HE2 GLN 42 6.831 -2.637 -7.367
310 2HE2 GLN 42 2HE2 GLN 42 6.491 -4.269 -6.986
311 H ALA 43 H ALA 43 5.885 -2.128 -2.561
312 HA ALA 43 HA ALA 43 5.138 -1.148 -0.165
313 1HB ALA 43 1HB ALA 43 7.303 -1.688 0.682
314 2HB ALA 43 2HB ALA 43 7.974 -1.659 -0.950
315 3HB ALA 43 3HB ALA 43 6.785 -2.883 -0.509
316 H MET 44 H MET 44 6.771 0.713 -2.481
317 HA MET 44 HA MET 44 6.945 3.028 -0.736
318 1HB MET 44 1HB MET 44 8.740 2.144 0.322
319 2HB MET 44 2HB MET 44 9.484 3.208 -0.842
320 1HG MET 44 1HG MET 44 9.362 0.204 -0.986
321 2HG MET 44 2HG MET 44 10.771 1.174 -0.640
322 1HE MET 44 1HE MET 44 9.160 0.246 -4.846
323 2HE MET 44 2HE MET 44 8.095 0.978 -3.655
324 3HE MET 44 3HE MET 44 8.766 -0.625 -3.359
325 H CYS 45 H CYS 45 8.549 4.800 -1.531
326 HA CYS 45 HA CYS 45 8.205 5.323 -4.388
327 1HB CYS 45 1HB CYS 45 9.536 7.450 -3.798
328 2HB CYS 45 2HB CYS 45 9.576 6.892 -2.148
329 HA PRO 46 HA PRO 46 12.326 3.751 -5.372
330 1HB PRO 46 1HB PRO 46 12.137 4.518 -7.548
331 2HB PRO 46 2HB PRO 46 13.399 5.627 -7.017
332 1HG PRO 46 1HG PRO 46 11.118 6.561 -7.998
333 2HG PRO 46 2HG PRO 46 11.908 7.358 -6.629
334 1HD PRO 46 1HD PRO 46 9.521 5.558 -6.658
335 2HD PRO 46 2HD PRO 46 9.824 7.011 -5.694
336 H HIS 47 H HIS 47 12.055 5.686 -3.051
337 HA HIS 47 HA HIS 47 14.814 6.637 -2.973
338 1HB HIS 47 1HB HIS 47 14.096 8.428 -1.407
339 2HB HIS 47 2HB HIS 47 12.431 7.845 -1.520
340 HD2 HIS 47 2HD HIS 47 14.965 8.604 -4.461
341 HE1 HIS 47 1HE HIS 47 11.405 10.744 -5.167
342 HE2 HIS 47 2HE HIS 47 13.813 10.474 -5.751
343 H GLN 48 H GLN 48 12.216 5.550 -0.735
344 HA GLN 48 HA GLN 48 12.159 3.827 0.740
345 1HB GLN 48 1HB GLN 48 14.674 3.005 -0.682
346 2HB GLN 48 2HB GLN 48 13.040 2.479 -1.021
347 1HG GLN 48 1HG GLN 48 14.410 1.904 1.580
348 2HG GLN 48 2HG GLN 48 14.546 0.835 0.194
349 1HE2 GLN 48 1HE2 GLN 48 12.397 1.996 2.724
350 2HE2 GLN 48 2HE2 GLN 48 11.207 0.797 2.448
351 H GLU 49 H GLU 49 12.339 4.649 2.782
352 HA GLU 49 HA GLU 49 14.924 4.131 4.051
353 1HB GLU 49 1HB GLU 49 14.171 5.632 5.944
354 2HB GLU 49 2HB GLU 49 12.823 6.154 4.962
355 1HG GLU 49 1HG GLU 49 14.507 7.816 4.965
356 2HG GLU 49 2HG GLU 49 14.313 7.134 3.360
357 H ILE 50 H ILE 50 14.406 3.461 6.483
358 HA ILE 50 HA ILE 50 12.432 1.349 6.201
359 HB ILE 50 HB ILE 50 13.277 0.482 8.355
360 1HG1 ILE 50 1HG1 ILE 50 13.917 2.635 9.388
361 2HG1 ILE 50 2HG1 ILE 50 15.227 2.798 8.229
362 1HG2 ILE 50 1HG2 ILE 50 14.285 -0.284 6.292
363 2HG2 ILE 50 2HG2 ILE 50 15.506 -0.183 7.560
364 3HG2 ILE 50 3HG2 ILE 50 15.418 1.066 6.317
365 1HD1 ILE 50 1HD1 ILE 50 16.313 0.824 9.146
366 2HD1 ILE 50 2HD1 ILE 50 15.001 0.644 10.313
367 3HD1 ILE 50 3HD1 ILE 50 16.053 2.056 10.380
368 H LEU 51 H LEU 51 11.060 0.806 8.140
369 HA LEU 51 HA LEU 51 9.388 1.234 9.602
370 1HB LEU 51 1HB LEU 51 9.428 3.305 10.971
371 2HB LEU 51 2HB LEU 51 10.739 3.916 9.987
372 HG LEU 51 HG LEU 51 12.197 2.113 10.788
373 1HD1 LEU 51 1HD1 LEU 51 12.166 4.233 11.972
374 2HD1 LEU 51 2HD1 LEU 51 12.437 2.895 13.088
375 3HD1 LEU 51 3HD1 LEU 51 10.850 3.658 12.995
376 1HD2 LEU 51 1HD2 LEU 51 10.510 0.392 11.195
377 2HD2 LEU 51 2HD2 LEU 51 9.840 1.342 12.520
378 3HD2 LEU 51 3HD2 LEU 51 11.468 0.678 12.647
379 H LEU 52 H LEU 52 9.189 1.815 6.849
380 HA LEU 52 HA LEU 52 7.604 4.197 6.544
381 1HB LEU 52 1HB LEU 52 8.976 3.559 4.675
382 2HB LEU 52 2HB LEU 52 7.300 3.614 4.199
383 HG LEU 52 HG LEU 52 7.252 1.101 4.266
384 1HD1 LEU 52 1HD1 LEU 52 8.468 0.880 2.173
385 2HD1 LEU 52 2HD1 LEU 52 9.262 2.428 2.469
386 3HD1 LEU 52 3HD1 LEU 52 7.513 2.360 2.213
387 1HD2 LEU 52 1HD2 LEU 52 9.193 0.685 5.708
388 2HD2 LEU 52 2HD2 LEU 52 10.237 1.457 4.519
389 3HD2 LEU 52 3HD2 LEU 52 9.395 -0.038 4.117
390 H SER 53 H SER 53 6.732 0.765 6.711
391 HA SER 53 HA SER 53 3.912 1.326 6.258
392 1HB SER 53 1HB SER 53 5.043 -0.766 5.785
393 2HB SER 53 2HB SER 53 3.612 -0.910 6.703
394 HG SER 53 HG SER 53 5.064 -1.167 8.626
395 H GLU 54 H GLU 54 6.069 1.481 8.806
396 HA GLU 54 HA GLU 54 4.061 1.492 10.896
397 1HB GLU 54 1HB GLU 54 5.920 1.751 12.388
398 2HB GLU 54 2HB GLU 54 6.972 2.279 11.086
399 1HG GLU 54 1HG GLU 54 7.474 -0.003 11.820
400 2HG GLU 54 2HG GLU 54 6.985 0.060 10.131
401 H GLY 55 H GLY 55 4.343 3.638 8.549
402 1HA GLY 55 1HA GLY 55 4.646 5.831 8.284
403 2HA GLY 55 2HA GLY 55 5.037 5.999 9.986
404 H SER 56 H SER 56 2.790 6.911 7.753
405 HA SER 56 HA SER 56 0.628 6.772 9.667
406 1HB SER 56 1HB SER 56 0.376 9.257 9.391
407 2HB SER 56 2HB SER 56 1.914 9.101 8.532
408 HG SER 56 HG SER 56 1.490 8.472 11.266
409 H TYR 57 H TYR 57 -1.257 7.426 8.875
410 HA TYR 57 HA TYR 57 -1.707 7.594 5.969
411 1HB TYR 57 1HB TYR 57 -3.155 5.884 8.026
412 2HB TYR 57 2HB TYR 57 -2.211 5.312 6.667
413 HD1 TYR 57 1HD TYR 57 -5.437 6.412 7.770
414 HD2 TYR 57 2HD TYR 57 -3.053 5.643 4.339
415 HE1 TYR 57 1HE TYR 57 -7.458 6.328 6.401
416 HE2 TYR 57 2HE TYR 57 -5.082 5.559 2.950
417 HH TYR 57 HH TYR 57 -8.039 6.680 4.097
418 H GLU 58 H GLU 58 -2.649 9.486 5.562
419 HA GLU 58 HA GLU 58 -4.233 10.739 7.710
420 1HB GLU 58 1HB GLU 58 -2.533 11.986 5.547
421 2HB GLU 58 2HB GLU 58 -2.122 11.882 7.245
422 1HG GLU 58 1HG GLU 58 -3.956 13.380 7.807
423 2HG GLU 58 2HG GLU 58 -4.389 13.482 6.100
424 H GLY 59 H GLY 59 -6.321 10.325 7.182
425 1HA GLY 59 1HA GLY 59 -7.557 11.563 4.932
426 2HA GLY 59 2HA GLY 59 -8.342 10.526 6.113
427 H GLY 60 H GLY 60 -6.306 10.530 3.387
428 1HA GLY 60 1HA GLY 60 -7.367 8.859 1.605
429 2HA GLY 60 2HA GLY 60 -6.747 7.706 2.789
430 H VAL 61 H VAL 61 -4.737 10.238 3.068
431 HA VAL 61 HA VAL 61 -3.149 9.685 0.705
432 HB VAL 61 HB VAL 61 -3.037 12.006 2.664
433 1HG1 VAL 61 1HG1 VAL 61 -1.473 13.043 1.076
434 2HG1 VAL 61 2HG1 VAL 61 -1.488 11.572 0.102
435 3HG1 VAL 61 3HG1 VAL 61 -0.818 11.543 1.731
436 1HG2 VAL 61 1HG2 VAL 61 -5.002 12.019 1.222
437 2HG2 VAL 61 2HG2 VAL 61 -3.960 11.892 -0.195
438 3HG2 VAL 61 3HG2 VAL 61 -3.892 13.331 0.826
439 H ILE 62 H ILE 62 -1.078 9.118 0.853
440 HA ILE 62 HA ILE 62 -0.089 8.334 3.461
441 HB ILE 62 HB ILE 62 1.249 6.564 2.142
442 1HG1 ILE 62 1HG1 ILE 62 0.368 5.704 0.035
443 2HG1 ILE 62 2HG1 ILE 62 0.505 7.436 -0.145
444 1HG2 ILE 62 1HG2 ILE 62 -1.699 6.192 2.605
445 2HG2 ILE 62 2HG2 ILE 62 -0.398 5.966 3.775
446 3HG2 ILE 62 3HG2 ILE 62 -0.533 4.884 2.387
447 1HD1 ILE 62 1HD1 ILE 62 -1.899 7.672 0.270
448 2HD1 ILE 62 2HD1 ILE 62 -2.041 5.910 0.336
449 3HD1 ILE 62 3HD1 ILE 62 -1.508 6.712 -1.144
450 H THR 63 H THR 63 1.645 9.277 4.059
451 HA THR 63 HA THR 63 3.037 11.013 2.153
452 HB THR 63 HB THR 63 2.557 11.224 5.122
453 HG1 THR 63 1HG THR 63 1.492 12.491 2.823
454 1HG2 THR 63 1HG2 THR 63 3.835 13.206 3.205
455 2HG2 THR 63 2HG2 THR 63 4.678 12.308 4.470
456 3HG2 THR 63 3HG2 THR 63 3.466 13.512 4.905
457 H CYS 64 H CYS 64 5.259 10.782 1.892
458 HA CYS 64 HA CYS 64 6.518 8.719 3.405
459 1HB CYS 64 1HB CYS 64 7.130 8.338 1.227
460 2HB CYS 64 2HB CYS 64 8.492 9.295 1.805
461 H ARG 65 H ARG 65 6.379 12.026 3.684
462 HA ARG 65 HA ARG 65 7.230 13.464 5.256
463 1HB ARG 65 1HB ARG 65 8.419 12.580 7.230
464 2HB ARG 65 2HB ARG 65 8.519 11.013 6.457
465 1HG ARG 65 1HG ARG 65 6.099 10.778 6.544
466 2HG ARG 65 2HG ARG 65 5.998 12.333 7.387
467 1HD ARG 65 1HD ARG 65 7.440 11.459 9.161
468 2HD ARG 65 2HD ARG 65 7.577 9.924 8.310
469 HE ARG 65 HE ARG 65 4.883 10.571 8.854
470 1HH1 ARG 65 1HH1 ARG 65 7.856 9.271 10.317
471 2HH1 ARG 65 2HH1 ARG 65 7.043 8.375 11.507
472 1HH2 ARG 65 1HH2 ARG 65 3.762 9.275 10.564
473 2HH2 ARG 65 2HH2 ARG 65 4.726 8.416 11.651
474 H ALA 66 H ALA 66 9.913 11.184 5.330
475 HA ALA 66 HA ALA 66 11.760 13.269 4.362
476 1HB ALA 66 1HB ALA 66 12.220 11.134 6.444
477 2HB ALA 66 2HB ALA 66 11.995 12.854 6.763
478 3HB ALA 66 3HB ALA 66 13.421 12.296 5.886
479 H HIS 67 H HIS 67 10.295 11.161 3.001
480 HA HIS 67 HA HIS 67 10.564 9.985 1.189
481 1HB HIS 67 1HB HIS 67 12.770 9.448 0.147
482 2HB HIS 67 2HB HIS 67 13.557 10.209 1.526
483 HD2 HIS 67 2HD HIS 67 13.851 12.873 1.374
484 HE1 HIS 67 1HE HIS 67 11.478 13.551 -2.051
485 HE2 HIS 67 2HE HIS 67 13.289 14.439 -0.591
486 H LEU 68 H LEU 68 9.670 8.307 1.371
487 HA LEU 68 HA LEU 68 10.724 5.840 2.266
488 1HB LEU 68 1HB LEU 68 8.750 5.382 3.872
489 2HB LEU 68 2HB LEU 68 8.478 7.108 3.894
490 HG LEU 68 HG LEU 68 11.002 5.828 4.895
491 1HD1 LEU 68 1HD1 LEU 68 9.904 8.589 5.357
492 2HD1 LEU 68 2HD1 LEU 68 11.299 8.170 4.366
493 3HD1 LEU 68 3HD1 LEU 68 11.352 7.923 6.111
494 1HD2 LEU 68 1HD2 LEU 68 8.558 6.605 6.452
495 2HD2 LEU 68 2HD2 LEU 68 10.136 6.271 7.154
496 3HD2 LEU 68 3HD2 LEU 68 9.294 5.002 6.274
497 H TRP 69 H TRP 69 7.211 6.896 2.106
498 HA TRP 69 HA TRP 69 6.946 5.707 -0.565
499 1HB TRP 69 1HB TRP 69 6.477 3.935 1.285
500 2HB TRP 69 2HB TRP 69 5.256 4.120 0.035
501 HD1 TRP 69 HD TRP 69 2.899 4.076 0.924
502 HE1 TRP 69 1HE TRP 69 1.694 4.779 3.073
503 HE3 TRP 69 3HE TRP 69 6.867 5.910 3.551
504 HZ2 TRP 69 2HZ TRP 69 2.324 5.968 5.552
505 HZ3 TRP 69 3HZ TRP 69 6.474 6.823 5.802
506 HH2 TRP 69 HH TRP 69 4.249 6.854 6.766
507 H THR 70 H THR 70 5.442 6.919 -1.853
508 HA THR 70 HA THR 70 3.288 8.327 -0.514
509 HB THR 70 HB THR 70 3.784 10.071 -2.560
510 HG1 THR 70 1HG THR 70 5.737 10.131 -3.076
511 1HG2 THR 70 1HG2 THR 70 4.645 10.378 0.310
512 2HG2 THR 70 2HG2 THR 70 3.049 10.737 -0.348
513 3HG2 THR 70 3HG2 THR 70 4.443 11.711 -0.828
514 H PHE 71 H PHE 71 1.431 8.199 -1.414
515 HA PHE 71 HA PHE 71 1.163 7.889 -4.296
516 1HB PHE 71 1HB PHE 71 -0.046 5.971 -2.239
517 2HB PHE 71 2HB PHE 71 1.016 5.561 -3.564
518 HD1 PHE 71 1HD PHE 71 -2.418 5.830 -2.554
519 HD2 PHE 71 2HD PHE 71 0.145 5.849 -5.944
520 HE1 PHE 71 1HE PHE 71 -4.317 5.287 -3.985
521 HE2 PHE 71 2HE PHE 71 -1.758 5.294 -7.383
522 HZ PHE 71 HZ PHE 71 -4.002 5.014 -6.403
523 H ASN 72 H ASN 72 -0.664 8.561 -5.147
524 HA ASN 72 HA ASN 72 -2.017 10.506 -3.426
525 1HB ASN 72 1HB ASN 72 -1.802 10.330 -6.426
526 2HB ASN 72 2HB ASN 72 -0.780 11.314 -5.433
527 1HD2 ASN 72 1HD2 ASN 72 -1.353 13.186 -6.439
528 2HD2 ASN 72 2HD2 ASN 72 -2.888 13.955 -6.260
529 H ASP 73 H ASP 73 -3.697 9.395 -2.597
530 HA ASP 73 HA ASP 73 -5.163 7.313 -3.632
531 1HB ASP 73 1HB ASP 73 -6.004 9.465 -1.710
532 2HB ASP 73 2HB ASP 73 -5.335 7.886 -1.326
533 H GLY 74 H GLY 74 -5.716 10.743 -4.255
534 1HA GLY 74 1HA GLY 74 -7.692 11.671 -5.178
535 2HA GLY 74 2HA GLY 74 -8.237 10.055 -5.577
536 H THR 75 H THR 75 -5.103 10.247 -6.609
537 HA THR 75 HA THR 75 -6.026 10.948 -9.322
538 HB THR 75 HB THR 75 -3.561 12.181 -8.046
539 HG1 THR 75 1HG THR 75 -5.268 13.248 -7.205
540 1HG2 THR 75 1HG2 THR 75 -3.490 13.598 -10.063
541 2HG2 THR 75 2HG2 THR 75 -4.877 12.730 -10.723
542 3HG2 THR 75 3HG2 THR 75 -3.344 11.894 -10.494
543 H GLY 76 H GLY 76 -4.047 8.913 -7.359
544 1HA GLY 76 1HA GLY 76 -3.068 7.439 -9.666
545 2HA GLY 76 2HA GLY 76 -2.898 7.036 -7.967
546 H HIS 77 H HIS 77 -1.971 9.641 -10.097
547 HA HIS 77 HA HIS 77 0.824 9.351 -9.809
548 1HB HIS 77 1HB HIS 77 0.964 11.705 -10.668
549 2HB HIS 77 2HB HIS 77 -0.786 11.806 -10.553
550 HD1 HIS 77 1HD HIS 77 -1.942 11.436 -12.718
551 HD2 HIS 77 2HD HIS 77 1.685 9.415 -12.513
552 HE1 HIS 77 1HE HIS 77 -1.659 10.342 -14.934
553 HE2 HIS 77 2HE HIS 77 0.660 9.368 -14.864
554 H GLY 78 H GLY 78 1.728 9.392 -7.859
555 1HA GLY 78 1HA GLY 78 0.667 10.187 -5.533
556 2HA GLY 78 2HA GLY 78 1.341 11.710 -5.989
557 H ILE 79 H ILE 79 3.451 9.973 -7.272
558 HA ILE 79 HA ILE 79 4.588 8.800 -4.881
559 HB ILE 79 HB ILE 79 4.803 8.265 -7.773
560 1HG1 ILE 79 1HG1 ILE 79 4.060 6.378 -5.504
561 2HG1 ILE 79 2HG1 ILE 79 4.062 6.002 -7.240
562 1HG2 ILE 79 1HG2 ILE 79 7.130 8.046 -7.008
563 2HG2 ILE 79 2HG2 ILE 79 6.489 6.432 -7.331
564 3HG2 ILE 79 3HG2 ILE 79 6.616 7.016 -5.672
565 1HD1 ILE 79 1HD1 ILE 79 1.865 6.334 -6.420
566 2HD1 ILE 79 2HD1 ILE 79 2.345 7.401 -7.737
567 3HD1 ILE 79 3HD1 ILE 79 2.274 8.017 -6.090
568 H ASN 80 H ASN 80 4.906 11.464 -6.870
569 HA ASN 80 HA ASN 80 6.122 13.206 -6.824
570 1HB ASN 80 1HB ASN 80 7.891 13.563 -5.356
571 2HB ASN 80 2HB ASN 80 7.923 11.890 -4.802
572 1HD2 ASN 80 1HD2 ASN 80 7.408 12.136 -2.834
573 2HD2 ASN 80 2HD2 ASN 80 5.948 12.819 -2.143
574 HA PRO 81 HA PRO 81 6.852 14.681 -7.852
575 1HB PRO 81 1HB PRO 81 7.508 15.906 -9.675
576 2HB PRO 81 2HB PRO 81 6.885 14.686 -10.790
577 1HG PRO 81 1HG PRO 81 9.565 14.861 -9.487
578 2HG PRO 81 2HG PRO 81 9.153 14.356 -11.135
579 1HD PRO 81 1HD PRO 81 9.766 12.550 -9.275
580 2HD PRO 81 2HD PRO 81 8.452 12.244 -10.437
581 H ASP 82 H ASP 82 4.824 15.439 -9.370
582 HA ASP 82 HA ASP 82 2.803 13.466 -9.036
583 1HB ASP 82 1HB ASP 82 2.364 15.884 -8.800
584 2HB ASP 82 2HB ASP 82 1.274 15.133 -9.957
585 H ASP 83 H ASP 83 5.052 13.598 -11.253
586 HA ASP 83 HA ASP 83 3.671 12.795 -13.634
587 1HB ASP 83 1HB ASP 83 6.510 12.598 -12.764
588 2HB ASP 83 2HB ASP 83 5.837 13.912 -13.724
589 H CYS 84 H CYS 84 4.694 11.266 -10.677
590 HA CYS 84 HA CYS 84 4.937 8.709 -12.007
591 1HB CYS 84 1HB CYS 84 6.094 7.985 -10.071
592 2HB CYS 84 2HB CYS 84 5.687 9.458 -9.225
593 HG CYS 84 HG CYS 84 7.333 9.861 -12.141
594 H CYS 85 H CYS 85 3.824 7.111 -11.375
595 HA CYS 85 HA CYS 85 1.527 7.426 -9.572
596 1HB CYS 85 1HB CYS 85 0.576 7.436 -11.748
597 2HB CYS 85 2HB CYS 85 0.322 5.841 -11.076
598 HG CYS 85 HG CYS 85 1.337 4.524 -13.012
599 H LEU 86 H LEU 86 0.571 5.067 -9.248
600 HA LEU 86 HA LEU 86 2.776 3.229 -8.747
601 1HB LEU 86 1HB LEU 86 0.820 4.258 -6.718
602 2HB LEU 86 2HB LEU 86 2.548 4.620 -6.752
603 HG LEU 86 HG LEU 86 1.324 2.052 -6.145
604 1HD1 LEU 86 1HD1 LEU 86 4.223 2.976 -6.260
605 2HD1 LEU 86 2HD1 LEU 86 3.491 1.715 -7.279
606 3HD1 LEU 86 3HD1 LEU 86 3.650 1.487 -5.529
607 1HD2 LEU 86 1HD2 LEU 86 2.333 2.505 -3.926
608 2HD2 LEU 86 2HD2 LEU 86 1.059 3.625 -4.388
609 3HD2 LEU 86 3HD2 LEU 86 2.754 4.118 -4.499
610 H ALA 87 H ALA 87 1.974 1.085 -8.286
611 HA ALA 87 HA ALA 87 -0.479 0.610 -9.778
612 1HB ALA 87 1HB ALA 87 0.245 -1.710 -9.906
613 2HB ALA 87 2HB ALA 87 1.605 -1.357 -8.842
614 3HB ALA 87 3HB ALA 87 1.532 -0.629 -10.445
615 H GLU 88 H GLU 88 -2.314 0.197 -8.802
616 HA GLU 88 HA GLU 88 -2.373 -0.547 -5.990
617 1HB GLU 88 1HB GLU 88 -4.817 -0.262 -6.241
618 2HB GLU 88 2HB GLU 88 -4.597 0.137 -7.925
619 1HG GLU 88 1HG GLU 88 -3.308 2.121 -7.274
620 2HG GLU 88 2HG GLU 88 -3.636 1.733 -5.579
621 H TYR 89 H TYR 89 -2.619 -2.571 -5.463
622 HA TYR 89 HA TYR 89 -3.390 -4.424 -7.532
623 1HB TYR 89 1HB TYR 89 -2.436 -6.167 -5.995
624 2HB TYR 89 2HB TYR 89 -1.964 -4.857 -4.912
625 HD1 TYR 89 1HD TYR 89 -0.074 -3.444 -5.432
626 HD2 TYR 89 2HD TYR 89 -1.426 -6.358 -8.208
627 HE1 TYR 89 1HE TYR 89 1.962 -3.111 -6.780
628 HE2 TYR 89 2HE TYR 89 0.613 -6.038 -9.543
629 HH TYR 89 HH TYR 89 2.253 -4.427 -9.937
630 HA PRO 90 HA PRO 90 -7.412 -4.737 -5.737
631 1HB PRO 90 1HB PRO 90 -8.550 -6.005 -7.256
632 2HB PRO 90 2HB PRO 90 -7.549 -7.423 -6.932
633 1HG PRO 90 1HG PRO 90 -7.094 -5.177 -8.831
634 2HG PRO 90 2HG PRO 90 -6.747 -6.902 -9.027
635 1HD PRO 90 1HD PRO 90 -4.842 -5.120 -8.496
636 2HD PRO 90 2HD PRO 90 -4.777 -6.768 -7.829
637 H VAL 91 H VAL 91 -7.722 -5.154 -3.694
638 HA VAL 91 HA VAL 91 -6.722 -7.657 -2.553
639 HB VAL 91 HB VAL 91 -7.604 -5.149 -1.121
640 1HG1 VAL 91 1HG1 VAL 91 -6.451 -6.156 0.818
641 2HG1 VAL 91 2HG1 VAL 91 -6.219 -7.635 -0.121
642 3HG1 VAL 91 3HG1 VAL 91 -7.838 -7.068 0.248
643 1HG2 VAL 91 1HG2 VAL 91 -4.782 -6.040 -1.740
644 2HG2 VAL 91 2HG2 VAL 91 -5.223 -4.697 -0.695
645 3HG2 VAL 91 3HG2 VAL 91 -5.616 -4.644 -2.410
646 H GLU 92 H GLU 92 -8.206 -9.042 -1.771
647 HA GLU 92 HA GLU 92 -10.959 -8.080 -1.651
648 1HB GLU 92 1HB GLU 92 -10.002 -10.873 -2.270
649 2HB GLU 92 2HB GLU 92 -10.567 -9.680 -3.438
650 1HG GLU 92 1HG GLU 92 -12.774 -9.703 -2.478
651 2HG GLU 92 2HG GLU 92 -12.254 -10.854 -1.250
652 H VAL 93 H VAL 93 -11.954 -8.356 0.133
653 HA VAL 93 HA VAL 93 -10.492 -9.586 2.331
654 HB VAL 93 HB VAL 93 -10.738 -7.222 2.692
655 1HG1 VAL 93 1HG1 VAL 93 -12.608 -6.717 1.259
656 2HG1 VAL 93 2HG1 VAL 93 -12.916 -6.079 2.873
657 3HG1 VAL 93 3HG1 VAL 93 -13.711 -7.564 2.343
658 1HG2 VAL 93 1HG2 VAL 93 -11.950 -7.128 4.841
659 2HG2 VAL 93 2HG2 VAL 93 -10.954 -8.579 4.716
660 3HG2 VAL 93 3HG2 VAL 93 -12.697 -8.680 4.473
661 H LYS 94 H LYS 94 -11.318 -11.444 3.113
662 HA LYS 94 HA LYS 94 -14.222 -11.861 2.896
663 1HB LYS 94 1HB LYS 94 -13.977 -14.064 2.196
664 2HB LYS 94 2HB LYS 94 -12.359 -14.196 2.857
665 1HG LYS 94 1HG LYS 94 -12.902 -12.578 0.407
666 2HG LYS 94 2HG LYS 94 -12.559 -14.311 0.362
667 1HD LYS 94 1HD LYS 94 -10.340 -13.739 1.682
668 2HD LYS 94 2HD LYS 94 -10.862 -12.112 1.456
669 1HE LYS 94 1HE LYS 94 -9.201 -13.058 -0.128
670 2HE LYS 94 2HE LYS 94 -10.441 -11.997 -0.680
671 1HZ LYS 94 1HZ LYS 94 -10.573 -15.048 -0.821
672 2HZ LYS 94 2HZ LYS 94 -10.084 -14.076 -2.079
673 3HZ LYS 94 3HZ LYS 94 -11.647 -13.963 -1.563
674 H GLY 95 H GLY 95 -14.514 -11.289 5.069
675 1HA GLY 95 1HA GLY 95 -14.115 -13.294 6.996
676 2HA GLY 95 2HA GLY 95 -14.521 -11.627 7.358
677 H ASP 96 H ASP 96 -12.243 -13.969 7.537
678 HA ASP 96 HA ASP 96 -10.276 -12.062 8.672
679 1HB ASP 96 1HB ASP 96 -9.283 -13.914 9.794
680 2HB ASP 96 2HB ASP 96 -10.369 -15.061 9.088
681 H ASP 97 H ASP 97 -10.769 -13.570 5.830
682 HA ASP 97 HA ASP 97 -7.873 -14.052 5.456
683 1HB ASP 97 1HB ASP 97 -8.540 -15.261 3.417
684 2HB ASP 97 2HB ASP 97 -10.224 -15.051 3.847
685 H ILE 98 H ILE 98 -6.741 -13.027 3.984
686 HA ILE 98 HA ILE 98 -8.172 -11.019 2.400
687 HB ILE 98 HB ILE 98 -5.522 -10.796 3.756
688 1HG1 ILE 98 1HG1 ILE 98 -6.550 -8.811 4.751
689 2HG1 ILE 98 2HG1 ILE 98 -7.034 -10.268 5.555
690 1HG2 ILE 98 1HG2 ILE 98 -5.480 -8.439 2.948
691 2HG2 ILE 98 2HG2 ILE 98 -6.943 -8.769 2.021
692 3HG2 ILE 98 3HG2 ILE 98 -5.447 -9.623 1.639
693 1HD1 ILE 98 1HD1 ILE 98 -8.901 -8.834 5.371
694 2HD1 ILE 98 2HD1 ILE 98 -9.157 -10.061 4.129
695 3HD1 ILE 98 3HD1 ILE 98 -8.559 -8.455 3.681
696 H TYR 99 H TYR 99 -7.832 -11.300 0.335
697 HA TYR 99 HA TYR 99 -5.297 -12.560 -0.552
698 1HB TYR 99 1HB TYR 99 -6.567 -13.220 -2.645
699 2HB TYR 99 2HB TYR 99 -8.025 -12.829 -1.788
700 HD1 TYR 99 1HD TYR 99 -7.795 -14.080 0.834
701 HD2 TYR 99 2HD TYR 99 -6.337 -15.489 -2.909
702 HE1 TYR 99 1HE TYR 99 -7.913 -16.386 1.654
703 HE2 TYR 99 2HE TYR 99 -6.441 -17.794 -2.085
704 HH TYR 99 HH TYR 99 -8.081 -18.597 0.787
705 H VAL 100 H VAL 100 -4.263 -11.680 -2.225
706 HA VAL 100 HA VAL 100 -5.378 -9.207 -3.410
707 HB VAL 100 HB VAL 100 -2.498 -9.486 -2.569
708 1HG1 VAL 100 1HG1 VAL 100 -2.352 -7.073 -2.983
709 2HG1 VAL 100 2HG1 VAL 100 -4.025 -7.092 -3.544
710 3HG1 VAL 100 3HG1 VAL 100 -2.791 -7.992 -4.423
711 1HG2 VAL 100 1HG2 VAL 100 -2.952 -7.855 -0.778
712 2HG2 VAL 100 2HG2 VAL 100 -3.847 -9.366 -0.561
713 3HG2 VAL 100 3HG2 VAL 100 -4.667 -7.941 -1.190
714 H SER 101 H SER 101 -4.935 -8.999 -5.504
715 HA SER 101 HA SER 101 -3.414 -11.159 -6.795
716 1HB SER 101 1HB SER 101 -5.118 -8.989 -8.084
717 2HB SER 101 2HB SER 101 -5.726 -10.585 -7.660
718 HG SER 101 HG SER 101 -5.150 -10.915 -9.668
719 H THR 102 H THR 102 -1.386 -10.766 -7.056
720 HA THR 102 HA THR 102 -0.496 -8.006 -7.468
721 HB THR 102 HB THR 102 1.676 -8.834 -6.459
722 HG1 THR 102 1HG THR 102 0.724 -10.774 -4.927
723 1HG2 THR 102 1HG2 THR 102 -0.780 -8.879 -4.686
724 2HG2 THR 102 2HG2 THR 102 0.105 -7.433 -5.180
725 3HG2 THR 102 3HG2 THR 102 0.876 -8.625 -4.135
726 H LYS 103 H LYS 103 0.143 -11.387 -8.135
727 HA LYS 103 HA LYS 103 2.150 -10.783 -10.083
728 1HB LYS 103 1HB LYS 103 0.786 -13.409 -9.536
729 2HB LYS 103 2HB LYS 103 2.132 -12.810 -8.585
730 1HG LYS 103 1HG LYS 103 3.557 -12.851 -10.553
731 2HG LYS 103 2HG LYS 103 2.210 -13.440 -11.526
732 1HD LYS 103 1HD LYS 103 2.071 -15.441 -10.150
733 2HD LYS 103 2HD LYS 103 3.354 -14.822 -9.108
734 1HE LYS 103 1HE LYS 103 3.676 -15.425 -12.033
735 2HE LYS 103 2HE LYS 103 4.140 -16.513 -10.725
736 1HZ LYS 103 1HZ LYS 103 6.003 -15.258 -11.551
737 2HZ LYS 103 2HZ LYS 103 5.721 -14.900 -9.937
738 3HZ LYS 103 3HZ LYS 103 5.284 -13.788 -11.145
739 H GLY 104 H GLY 104 1.488 -9.861 -11.856
740 1HA GLY 104 1HA GLY 104 -1.047 -10.643 -13.091
741 2HA GLY 104 2HA GLY 104 0.436 -10.787 -14.034
742 H ILE 105 H ILE 105 -0.251 -8.334 -11.652
743 HA ILE 105 HA ILE 105 -0.623 -6.344 -13.750
744 HB ILE 105 HB ILE 105 -0.937 -6.146 -10.732
745 1HG1 ILE 105 1HG1 ILE 105 -2.679 -7.486 -11.824
746 2HG1 ILE 105 2HG1 ILE 105 -3.012 -6.163 -12.934
747 1HG2 ILE 105 1HG2 ILE 105 -1.909 -3.926 -11.124
748 2HG2 ILE 105 2HG2 ILE 105 -1.525 -4.061 -12.839
749 3HG2 ILE 105 3HG2 ILE 105 -0.227 -3.996 -11.648
750 1HD1 ILE 105 1HD1 ILE 105 -4.672 -6.260 -11.179
751 2HD1 ILE 105 2HD1 ILE 105 -3.730 -4.771 -11.077
752 3HD1 ILE 105 3HD1 ILE 105 -3.409 -6.096 -9.961
753 H LEU 106 H LEU 106 1.008 -4.943 -14.278
754 HA LEU 106 HA LEU 106 3.525 -5.541 -13.235
755 1HB LEU 106 1HB LEU 106 4.203 -3.696 -14.823
756 2HB LEU 106 2HB LEU 106 2.527 -3.602 -15.281
757 HG LEU 106 HG LEU 106 4.209 -6.089 -15.635
758 1HD1 LEU 106 1HD1 LEU 106 1.834 -6.569 -15.475
759 2HD1 LEU 106 2HD1 LEU 106 2.438 -6.859 -17.102
760 3HD1 LEU 106 3HD1 LEU 106 1.502 -5.403 -16.757
761 1HD2 LEU 106 1HD2 LEU 106 4.279 -5.508 -18.009
762 2HD2 LEU 106 2HD2 LEU 106 5.082 -4.298 -17.011
763 3HD2 LEU 106 3HD2 LEU 106 3.474 -3.980 -17.656
764 HA PRO 107 HA PRO 107 3.720 -2.420 -9.998
765 1HB PRO 107 1HB PRO 107 5.558 -3.452 -9.145
766 2HB PRO 107 2HB PRO 107 6.455 -2.230 -10.045
767 1HG PRO 107 1HG PRO 107 6.827 -4.827 -10.447
768 2HG PRO 107 2HG PRO 107 6.918 -3.662 -11.789
769 1HD PRO 107 1HD PRO 107 4.725 -5.548 -11.061
770 2HD PRO 107 2HD PRO 107 5.354 -5.076 -12.657
771 H ASN 108 H ASN 108 3.652 -0.279 -10.132
772 HA ASN 108 HA ASN 108 4.742 0.989 -12.519
773 1HB ASN 108 1HB ASN 108 3.360 2.901 -11.746
774 2HB ASN 108 2HB ASN 108 2.696 1.839 -10.560
775 1HD2 ASN 108 1HD2 ASN 108 2.570 -0.475 -12.465
776 2HD2 ASN 108 2HD2 ASN 108 1.257 -0.109 -13.511
777 H LYS 109 H LYS 109 6.360 2.050 -12.253
778 HA LYS 109 HA LYS 109 8.129 3.335 -11.475
779 1HB LYS 109 1HB LYS 109 6.087 4.280 -9.443
780 2HB LYS 109 2HB LYS 109 6.152 4.856 -11.093
781 1HG LYS 109 1HG LYS 109 8.365 5.233 -9.091
782 2HG LYS 109 2HG LYS 109 7.145 6.428 -9.490
783 1HD LYS 109 1HD LYS 109 7.877 6.422 -11.821
784 2HD LYS 109 2HD LYS 109 9.095 5.205 -11.438
785 1HE LYS 109 1HE LYS 109 10.219 6.729 -9.957
786 2HE LYS 109 2HE LYS 109 8.966 7.946 -10.212
787 1HZ LYS 109 1HZ LYS 109 10.741 6.879 -12.329
788 2HZ LYS 109 2HZ LYS 109 10.963 8.336 -11.534
789 3HZ LYS 109 3HZ LYS 109 9.599 8.111 -12.504
790 H ALA 110 H ALA 110 9.399 3.891 -9.350
791 HA ALA 110 HA ALA 110 10.430 3.470 -7.439
792 1HB ALA 110 1HB ALA 110 8.034 1.837 -6.667
793 2HB ALA 110 2HB ALA 110 8.184 3.584 -6.479
794 3HB ALA 110 3HB ALA 110 9.251 2.505 -5.583
795 H HIS 111 H HIS 111 8.845 0.424 -7.681
796 HA HIS 111 HA HIS 111 11.436 -0.847 -8.136
797 1HB HIS 111 1HB HIS 111 9.406 -1.835 -6.122
798 2HB HIS 111 2HB HIS 111 10.880 -0.973 -5.698
799 HD1 HIS 111 1HD HIS 111 9.661 -4.343 -6.828
800 HD2 HIS 111 2HD HIS 111 13.244 -2.461 -5.864
801 HE1 HIS 111 1HE HIS 111 11.343 -6.168 -6.597
802 HE2 HIS 111 2HE HIS 111 13.413 -5.024 -5.759
803 H SER 112 H SER 112 11.114 -1.590 -10.064
804 HA SER 112 HA SER 112 8.602 -2.903 -10.705
805 1HB SER 112 1HB SER 112 9.134 -2.366 -13.034
806 2HB SER 112 2HB SER 112 10.689 -1.689 -12.544
807 HG SER 112 HG SER 112 8.630 -0.611 -11.145
Start of MODEL 8
1 1H MET 1 1HT MET 1 0.154 -18.297 -8.879
2 2H MET 1 2HT MET 1 -0.863 -18.663 -10.169
3 3H MET 1 3HT MET 1 -0.309 -19.907 -9.163
4 HA MET 1 HA MET 1 -2.589 -19.332 -8.740
5 1HB MET 1 1HB MET 1 -2.362 -18.823 -6.280
6 2HB MET 1 2HB MET 1 -0.647 -18.573 -6.545
7 1HG MET 1 1HG MET 1 -2.103 -21.169 -6.996
8 2HG MET 1 2HG MET 1 -1.127 -20.778 -5.587
9 1HE MET 1 1HE MET 1 -0.723 -23.410 -7.338
10 2HE MET 1 2HE MET 1 0.251 -23.029 -5.917
11 3HE MET 1 3HE MET 1 1.037 -23.473 -7.431
12 H SER 2 H SER 2 -4.077 -17.767 -7.856
13 HA SER 2 HA SER 2 -3.187 -15.005 -8.031
14 1HB SER 2 1HB SER 2 -5.183 -14.422 -9.343
15 2HB SER 2 2HB SER 2 -5.664 -16.122 -9.378
16 HG SER 2 HG SER 2 -3.112 -15.752 -10.171
17 H PHE 3 H PHE 3 -3.944 -13.837 -6.424
18 HA PHE 3 HA PHE 3 -4.889 -13.240 -4.503
19 1HB PHE 3 1HB PHE 3 -7.207 -14.040 -3.884
20 2HB PHE 3 2HB PHE 3 -7.177 -15.081 -5.297
21 HD1 PHE 3 1HD PHE 3 -7.518 -14.211 -7.497
22 HD2 PHE 3 2HD PHE 3 -7.320 -11.606 -4.140
23 HE1 PHE 3 1HE PHE 3 -8.418 -12.381 -8.870
24 HE2 PHE 3 2HE PHE 3 -8.219 -9.770 -5.505
25 HZ PHE 3 HZ PHE 3 -8.769 -10.156 -7.873
26 H GLU 4 H GLU 4 -3.257 -14.025 -3.406
27 HA GLU 4 HA GLU 4 -3.554 -16.679 -2.187
28 1HB GLU 4 1HB GLU 4 -1.107 -14.960 -2.629
29 2HB GLU 4 2HB GLU 4 -1.569 -16.357 -3.587
30 1HG GLU 4 1HG GLU 4 -1.283 -17.798 -1.650
31 2HG GLU 4 2HG GLU 4 -0.787 -16.397 -0.698
32 H LYS 5 H LYS 5 -3.337 -16.787 0.065
33 HA LYS 5 HA LYS 5 -4.141 -14.364 1.367
34 1HB LYS 5 1HB LYS 5 -3.607 -17.093 2.508
35 2HB LYS 5 2HB LYS 5 -5.179 -16.480 2.007
36 1HG LYS 5 1HG LYS 5 -5.013 -14.735 3.725
37 2HG LYS 5 2HG LYS 5 -3.474 -15.415 4.246
38 1HD LYS 5 1HD LYS 5 -4.590 -17.527 4.776
39 2HD LYS 5 2HD LYS 5 -6.140 -16.818 4.309
40 1HE LYS 5 1HE LYS 5 -5.821 -15.083 6.026
41 2HE LYS 5 2HE LYS 5 -4.316 -15.857 6.507
42 1HZ LYS 5 1HZ LYS 5 -5.593 -17.845 7.103
43 2HZ LYS 5 2HZ LYS 5 -7.029 -17.020 6.702
44 3HZ LYS 5 3HZ LYS 5 -6.068 -16.478 7.964
45 H ILE 6 H ILE 6 -2.921 -12.968 2.095
46 HA ILE 6 HA ILE 6 -0.142 -13.615 2.659
47 HB ILE 6 HB ILE 6 -0.529 -11.653 1.267
48 1HG1 ILE 6 1HG1 ILE 6 0.581 -10.934 3.981
49 2HG1 ILE 6 2HG1 ILE 6 0.813 -9.966 2.530
50 1HG2 ILE 6 1HG2 ILE 6 -2.681 -10.914 1.993
51 2HG2 ILE 6 2HG2 ILE 6 -1.530 -9.584 2.100
52 3HG2 ILE 6 3HG2 ILE 6 -2.026 -10.441 3.561
53 1HD1 ILE 6 1HD1 ILE 6 1.788 -12.794 2.931
54 2HD1 ILE 6 2HD1 ILE 6 2.766 -11.331 2.994
55 3HD1 ILE 6 3HD1 ILE 6 2.016 -11.819 1.478
56 H CYS 7 H CYS 7 -2.966 -12.244 4.135
57 HA CYS 7 HA CYS 7 -2.192 -13.272 6.691
58 1HB CYS 7 1HB CYS 7 -0.948 -11.245 6.833
59 2HB CYS 7 2HB CYS 7 -2.372 -11.063 7.832
60 HG CYS 7 HG CYS 7 -1.587 -8.705 6.409
61 H SER 8 H SER 8 -3.799 -12.053 8.280
62 HA SER 8 HA SER 8 -6.517 -12.400 7.182
63 1HB SER 8 1HB SER 8 -7.156 -13.423 9.161
64 2HB SER 8 2HB SER 8 -5.771 -12.926 10.066
65 HG SER 8 HG SER 8 -4.555 -14.413 8.911
66 H LEU 9 H LEU 9 -8.077 -11.039 8.110
67 HA LEU 9 HA LEU 9 -7.294 -8.339 8.436
68 1HB LEU 9 1HB LEU 9 -9.882 -9.589 9.264
69 2HB LEU 9 2HB LEU 9 -9.484 -9.366 7.600
70 HG LEU 9 HG LEU 9 -9.375 -6.797 8.197
71 1HD1 LEU 9 1HD1 LEU 9 -11.163 -7.793 6.872
72 2HD1 LEU 9 2HD1 LEU 9 -11.798 -6.566 7.965
73 3HD1 LEU 9 3HD1 LEU 9 -12.003 -8.276 8.344
74 1HD2 LEU 9 1HD2 LEU 9 -9.369 -7.073 10.635
75 2HD2 LEU 9 2HD2 LEU 9 -10.961 -7.833 10.552
76 3HD2 LEU 9 3HD2 LEU 9 -10.771 -6.141 10.105
77 H ASP 10 H ASP 10 -7.651 -10.904 10.729
78 HA ASP 10 HA ASP 10 -7.753 -9.166 13.043
79 1HB ASP 10 1HB ASP 10 -8.538 -11.629 12.917
80 2HB ASP 10 2HB ASP 10 -7.699 -11.099 14.360
81 H ASP 11 H ASP 11 -5.351 -10.026 10.877
82 HA ASP 11 HA ASP 11 -3.132 -9.758 12.722
83 1HB ASP 11 1HB ASP 11 -3.161 -9.905 9.689
84 2HB ASP 11 2HB ASP 11 -2.930 -11.272 10.761
85 H ILE 12 H ILE 12 -4.638 -7.917 10.061
86 HA ILE 12 HA ILE 12 -3.362 -5.573 11.223
87 HB ILE 12 HB ILE 12 -3.479 -4.401 9.073
88 1HG1 ILE 12 1HG1 ILE 12 -5.450 -5.468 8.110
89 2HG1 ILE 12 2HG1 ILE 12 -4.592 -6.983 8.004
90 1HG2 ILE 12 1HG2 ILE 12 -2.175 -7.092 8.838
91 2HG2 ILE 12 2HG2 ILE 12 -1.455 -5.640 9.544
92 3HG2 ILE 12 3HG2 ILE 12 -1.810 -5.707 7.812
93 1HD1 ILE 12 1HD1 ILE 12 -3.933 -4.459 6.465
94 2HD1 ILE 12 2HD1 ILE 12 -4.750 -5.874 5.809
95 3HD1 ILE 12 3HD1 ILE 12 -3.069 -5.990 6.329
96 H TRP 13 H TRP 13 -4.614 -4.506 12.353
97 HA TRP 13 HA TRP 13 -7.437 -4.832 12.347
98 1HB TRP 13 1HB TRP 13 -7.339 -3.285 14.301
99 2HB TRP 13 2HB TRP 13 -5.609 -3.102 14.014
100 HD1 TRP 13 HD TRP 13 -4.294 -5.698 13.938
101 HE1 TRP 13 1HE TRP 13 -4.570 -7.580 15.674
102 HE3 TRP 13 3HE TRP 13 -8.727 -4.248 16.038
103 HZ2 TRP 13 2HZ TRP 13 -6.385 -8.336 17.673
104 HZ3 TRP 13 3HZ TRP 13 -9.654 -5.610 17.868
105 HH2 TRP 13 HH TRP 13 -8.509 -7.606 18.665
106 H VAL 14 H VAL 14 -8.854 -2.853 12.593
107 HA VAL 14 HA VAL 14 -8.937 -1.386 10.264
108 HB VAL 14 HB VAL 14 -10.894 -1.603 11.698
109 1HG1 VAL 14 1HG1 VAL 14 -11.138 -0.342 13.806
110 2HG1 VAL 14 2HG1 VAL 14 -9.445 0.135 13.693
111 3HG1 VAL 14 3HG1 VAL 14 -9.870 -1.563 13.889
112 1HG2 VAL 14 1HG2 VAL 14 -11.730 0.699 11.678
113 2HG2 VAL 14 2HG2 VAL 14 -10.844 0.313 10.200
114 3HG2 VAL 14 3HG2 VAL 14 -10.083 1.285 11.459
115 H GLY 15 H GLY 15 -7.536 0.041 9.482
116 1HA GLY 15 1HA GLY 15 -6.545 2.135 11.249
117 2HA GLY 15 2HA GLY 15 -6.494 2.145 9.493
118 H GLU 16 H GLU 16 -5.471 -0.833 10.006
119 HA GLU 16 HA GLU 16 -2.728 -0.129 10.797
120 1HB GLU 16 1HB GLU 16 -3.865 -2.850 10.296
121 2HB GLU 16 2HB GLU 16 -4.004 -2.179 11.870
122 1HG GLU 16 1HG GLU 16 -1.496 -2.886 10.346
123 2HG GLU 16 2HG GLU 16 -2.131 -3.676 11.793
124 H MET 17 H MET 17 -1.009 -0.739 9.475
125 HA MET 17 HA MET 17 -1.555 -1.802 6.854
126 1HB MET 17 1HB MET 17 -1.914 0.583 6.518
127 2HB MET 17 2HB MET 17 -0.478 0.015 5.685
128 1HG MET 17 1HG MET 17 0.916 0.924 7.502
129 2HG MET 17 2HG MET 17 -0.540 1.568 8.260
130 1HE MET 17 1HE MET 17 1.280 4.742 6.872
131 2HE MET 17 2HE MET 17 2.034 3.283 7.519
132 3HE MET 17 3HE MET 17 0.603 3.956 8.297
133 H GLU 18 H GLU 18 0.199 -2.824 6.037
134 HA GLU 18 HA GLU 18 2.778 -2.178 6.999
135 1HB GLU 18 1HB GLU 18 2.269 -3.581 8.817
136 2HB GLU 18 2HB GLU 18 3.406 -4.441 7.799
137 1HG GLU 18 1HG GLU 18 1.574 -5.762 6.870
138 2HG GLU 18 2HG GLU 18 0.459 -4.940 7.967
139 H THR 19 H THR 19 4.454 -2.857 5.787
140 HA THR 19 HA THR 19 3.751 -3.651 3.140
141 HB THR 19 HB THR 19 6.459 -3.147 4.423
142 HG1 THR 19 1HG THR 19 6.228 -1.146 3.180
143 1HG2 THR 19 1HG2 THR 19 7.279 -2.853 2.114
144 2HG2 THR 19 2HG2 THR 19 5.689 -3.298 1.495
145 3HG2 THR 19 3HG2 THR 19 6.661 -4.483 2.370
146 H PHE 20 H PHE 20 4.051 -5.556 2.188
147 HA PHE 20 HA PHE 20 5.515 -7.675 3.578
148 1HB PHE 20 1HB PHE 20 3.053 -8.200 3.709
149 2HB PHE 20 2HB PHE 20 3.956 -9.327 2.733
150 HD1 PHE 20 1HD PHE 20 3.486 -9.723 0.476
151 HD2 PHE 20 2HD PHE 20 1.572 -6.504 2.501
152 HE1 PHE 20 1HE PHE 20 1.937 -9.468 -1.408
153 HE2 PHE 20 2HE PHE 20 0.018 -6.252 0.583
154 HZ PHE 20 HZ PHE 20 0.207 -7.732 -1.351
155 H GLU 21 H GLU 21 6.280 -9.265 1.987
156 HA GLU 21 HA GLU 21 6.773 -7.911 -0.563
157 1HB GLU 21 1HB GLU 21 8.584 -9.878 0.848
158 2HB GLU 21 2HB GLU 21 8.794 -8.135 0.812
159 1HG GLU 21 1HG GLU 21 9.088 -8.217 -1.609
160 2HG GLU 21 2HG GLU 21 8.924 -9.969 -1.560
161 H THR 22 H THR 22 6.373 -8.923 -2.388
162 HA THR 22 HA THR 22 4.704 -11.266 -2.271
163 HB THR 22 HB THR 22 4.340 -10.845 -4.670
164 HG1 THR 22 1HG THR 22 5.495 -9.192 -5.685
165 1HG2 THR 22 1HG2 THR 22 4.505 -8.242 -3.166
166 2HG2 THR 22 2HG2 THR 22 3.136 -9.362 -3.100
167 3HG2 THR 22 3HG2 THR 22 3.544 -8.534 -4.608
168 H SER 23 H SER 23 5.175 -13.038 -3.954
169 HA SER 23 HA SER 23 7.734 -14.119 -3.532
170 1HB SER 23 1HB SER 23 6.954 -15.905 -4.983
171 2HB SER 23 2HB SER 23 5.624 -14.864 -5.513
172 HG SER 23 HG SER 23 6.095 -15.730 -2.846
173 H ASP 24 H ASP 24 6.498 -11.922 -5.830
174 HA ASP 24 HA ASP 24 8.435 -12.381 -7.917
175 1HB ASP 24 1HB ASP 24 7.622 -10.187 -8.792
176 2HB ASP 24 2HB ASP 24 6.600 -10.049 -7.373
177 H GLY 25 H GLY 25 8.487 -10.925 -4.886
178 1HA GLY 25 1HA GLY 25 11.048 -9.655 -5.474
179 2HA GLY 25 2HA GLY 25 10.411 -10.020 -3.873
180 H THR 26 H THR 26 7.769 -8.824 -4.904
181 HA THR 26 HA THR 26 8.494 -6.025 -5.078
182 HB THR 26 HB THR 26 5.834 -7.417 -5.447
183 HG1 THR 26 1HG THR 26 7.965 -6.702 -7.092
184 1HG2 THR 26 1HG2 THR 26 5.588 -5.049 -4.784
185 2HG2 THR 26 2HG2 THR 26 5.092 -5.301 -6.456
186 3HG2 THR 26 3HG2 THR 26 6.660 -4.571 -6.102
187 H GLU 27 H GLU 27 8.187 -4.631 -3.432
188 HA GLU 27 HA GLU 27 6.972 -5.718 -1.033
189 1HB GLU 27 1HB GLU 27 9.114 -4.601 -0.715
190 2HB GLU 27 2HB GLU 27 7.844 -3.727 0.112
191 1HG GLU 27 1HG GLU 27 7.773 -2.107 -1.731
192 2HG GLU 27 2HG GLU 27 9.112 -2.958 -2.500
193 H VAL 28 H VAL 28 5.024 -5.274 -0.456
194 HA VAL 28 HA VAL 28 3.656 -3.033 -1.753
195 HB VAL 28 HB VAL 28 2.477 -5.742 -1.116
196 1HG1 VAL 28 1HG1 VAL 28 0.496 -5.021 -2.354
197 2HG1 VAL 28 2HG1 VAL 28 1.198 -3.410 -2.516
198 3HG1 VAL 28 3HG1 VAL 28 0.795 -4.042 -0.917
199 1HG2 VAL 28 1HG2 VAL 28 2.300 -6.090 -3.548
200 2HG2 VAL 28 2HG2 VAL 28 3.974 -5.913 -3.016
201 3HG2 VAL 28 3HG2 VAL 28 3.155 -4.570 -3.812
202 H LEU 29 H LEU 29 2.403 -1.886 -0.460
203 HA LEU 29 HA LEU 29 2.565 -2.288 2.477
204 1HB LEU 29 1HB LEU 29 1.393 0.060 1.022
205 2HB LEU 29 2HB LEU 29 3.126 -0.121 1.038
206 HG LEU 29 HG LEU 29 3.251 0.177 3.380
207 1HD1 LEU 29 1HD1 LEU 29 2.396 2.423 3.632
208 2HD1 LEU 29 2HD1 LEU 29 1.353 2.177 2.234
209 3HD1 LEU 29 3HD1 LEU 29 3.101 2.163 2.031
210 1HD2 LEU 29 1HD2 LEU 29 0.243 0.230 3.429
211 2HD2 LEU 29 2HD2 LEU 29 1.311 0.583 4.791
212 3HD2 LEU 29 3HD2 LEU 29 1.267 -1.040 4.101
213 H ILE 30 H ILE 30 0.834 -3.509 3.176
214 HA ILE 30 HA ILE 30 -1.664 -3.233 1.715
215 HB ILE 30 HB ILE 30 -0.868 -5.555 2.111
216 1HG1 ILE 30 1HG1 ILE 30 -3.387 -4.856 3.572
217 2HG1 ILE 30 2HG1 ILE 30 -2.917 -6.500 3.136
218 1HG2 ILE 30 1HG2 ILE 30 -0.912 -6.589 4.317
219 2HG2 ILE 30 2HG2 ILE 30 -1.203 -5.007 5.040
220 3HG2 ILE 30 3HG2 ILE 30 0.309 -5.322 4.191
221 1HD1 ILE 30 1HD1 ILE 30 -4.509 -5.618 1.542
222 2HD1 ILE 30 2HD1 ILE 30 -2.944 -5.863 0.766
223 3HD1 ILE 30 3HD1 ILE 30 -3.464 -4.238 1.218
224 H VAL 31 H VAL 31 -3.145 -1.876 2.415
225 HA VAL 31 HA VAL 31 -3.057 -1.006 5.243
226 HB VAL 31 HB VAL 31 -4.224 0.466 2.872
227 1HG1 VAL 31 1HG1 VAL 31 -4.265 2.413 4.371
228 2HG1 VAL 31 2HG1 VAL 31 -3.702 1.389 5.689
229 3HG1 VAL 31 3HG1 VAL 31 -5.269 1.081 4.942
230 1HG2 VAL 31 1HG2 VAL 31 -1.578 0.969 4.234
231 2HG2 VAL 31 2HG2 VAL 31 -2.299 1.982 2.985
232 3HG2 VAL 31 3HG2 VAL 31 -1.803 0.330 2.606
233 H ASN 32 H ASN 32 -4.830 -1.671 6.422
234 HA ASN 32 HA ASN 32 -7.303 -2.083 4.870
235 1HB ASN 32 1HB ASN 32 -6.426 -3.353 7.474
236 2HB ASN 32 2HB ASN 32 -6.583 -4.156 5.917
237 1HD2 ASN 32 1HD2 ASN 32 -8.238 -2.944 8.659
238 2HD2 ASN 32 2HD2 ASN 32 -9.793 -3.601 8.310
239 H SER 33 H SER 33 -8.332 -0.292 4.948
240 HA SER 33 HA SER 33 -8.704 1.093 7.480
241 1HB SER 33 1HB SER 33 -7.890 2.503 5.657
242 2HB SER 33 2HB SER 33 -9.529 2.985 6.069
243 HG SER 33 HG SER 33 -8.998 1.149 3.979
244 H GLU 34 H GLU 34 -10.958 1.776 8.010
245 HA GLU 34 HA GLU 34 -12.794 -0.356 7.434
246 1HB GLU 34 1HB GLU 34 -13.292 2.270 8.852
247 2HB GLU 34 2HB GLU 34 -12.873 0.742 9.623
248 1HG GLU 34 1HG GLU 34 -14.960 -0.235 8.832
249 2HG GLU 34 2HG GLU 34 -15.375 1.272 8.027
250 H GLU 35 H GLU 35 -12.659 3.095 6.592
251 HA GLU 35 HA GLU 35 -15.062 2.854 5.054
252 1HB GLU 35 1HB GLU 35 -14.714 5.238 4.507
253 2HB GLU 35 2HB GLU 35 -13.200 5.186 5.397
254 1HG GLU 35 1HG GLU 35 -14.386 4.639 7.433
255 2HG GLU 35 2HG GLU 35 -15.911 4.603 6.547
256 H HIS 36 H HIS 36 -11.639 3.370 4.260
257 HA HIS 36 HA HIS 36 -12.369 3.351 1.472
258 1HB HIS 36 1HB HIS 36 -9.612 3.530 2.737
259 2HB HIS 36 2HB HIS 36 -10.603 4.899 2.255
260 HD1 HIS 36 1HD HIS 36 -11.197 4.903 -0.440
261 HD2 HIS 36 2HD HIS 36 -7.836 2.799 0.799
262 HE1 HIS 36 1HE HIS 36 -9.801 4.620 -2.485
263 HE2 HIS 36 2HE HIS 36 -7.644 3.775 -1.608
264 H GLY 37 H GLY 37 -11.667 1.076 3.780
265 1HA GLY 37 1HA GLY 37 -11.769 -1.012 1.775
266 2HA GLY 37 2HA GLY 37 -11.885 -1.223 3.517
267 H VAL 38 H VAL 38 -10.314 -2.771 1.730
268 HA VAL 38 HA VAL 38 -7.734 -2.238 2.923
269 HB VAL 38 HB VAL 38 -8.723 -4.417 3.522
270 1HG1 VAL 38 1HG1 VAL 38 -8.720 -5.024 0.577
271 2HG1 VAL 38 2HG1 VAL 38 -10.133 -4.841 1.616
272 3HG1 VAL 38 3HG1 VAL 38 -9.028 -6.197 1.856
273 1HG2 VAL 38 1HG2 VAL 38 -6.314 -4.292 3.402
274 2HG2 VAL 38 2HG2 VAL 38 -6.362 -4.654 1.680
275 3HG2 VAL 38 3HG2 VAL 38 -6.852 -5.883 2.851
276 H LYS 39 H LYS 39 -6.159 -1.607 1.692
277 HA LYS 39 HA LYS 39 -6.455 -1.909 -1.207
278 1HB LYS 39 1HB LYS 39 -5.587 0.588 0.283
279 2HB LYS 39 2HB LYS 39 -7.127 0.342 -0.537
280 1HG LYS 39 1HG LYS 39 -4.499 0.270 -1.961
281 2HG LYS 39 2HG LYS 39 -5.460 1.730 -1.779
282 1HD LYS 39 1HD LYS 39 -6.575 -0.760 -2.936
283 2HD LYS 39 2HD LYS 39 -5.760 0.417 -3.980
284 1HE LYS 39 1HE LYS 39 -7.406 2.107 -3.085
285 2HE LYS 39 2HE LYS 39 -8.262 0.763 -2.332
286 1HZ LYS 39 1HZ LYS 39 -7.718 1.096 -5.224
287 2HZ LYS 39 2HZ LYS 39 -9.208 1.326 -4.491
288 3HZ LYS 39 3HZ LYS 39 -8.548 -0.220 -4.567
289 H ALA 40 H ALA 40 -4.525 -2.159 -2.316
290 HA ALA 40 HA ALA 40 -2.122 -2.553 -0.679
291 1HB ALA 40 1HB ALA 40 -3.113 -4.710 -1.287
292 2HB ALA 40 2HB ALA 40 -1.558 -4.478 -2.086
293 3HB ALA 40 3HB ALA 40 -3.058 -4.254 -2.988
294 H TYR 41 H TYR 41 -0.667 -1.102 -1.254
295 HA TYR 41 HA TYR 41 -0.469 -0.187 -4.086
296 1HB TYR 41 1HB TYR 41 0.493 1.830 -3.242
297 2HB TYR 41 2HB TYR 41 0.670 1.167 -1.638
298 HD1 TYR 41 1HD TYR 41 -1.561 2.955 -3.865
299 HD2 TYR 41 2HD TYR 41 -1.234 0.951 -0.125
300 HE1 TYR 41 1HE TYR 41 -3.575 4.122 -3.060
301 HE2 TYR 41 2HE TYR 41 -3.240 2.100 0.686
302 HH TYR 41 HH TYR 41 -5.273 3.904 -1.406
303 H GLN 42 H GLN 42 1.743 -0.385 -4.956
304 HA GLN 42 HA GLN 42 3.644 -1.928 -3.472
305 1HB GLN 42 1HB GLN 42 3.746 -1.560 -6.016
306 2HB GLN 42 2HB GLN 42 5.265 -1.349 -5.171
307 1HG GLN 42 1HG GLN 42 5.023 1.026 -5.224
308 2HG GLN 42 2HG GLN 42 3.450 0.882 -6.008
309 1HE2 GLN 42 1HE2 GLN 42 3.341 0.356 -8.128
310 2HE2 GLN 42 2HE2 GLN 42 4.768 0.458 -9.151
311 H ALA 43 H ALA 43 5.254 -1.276 -2.140
312 HA ALA 43 HA ALA 43 4.641 1.215 -0.825
313 1HB ALA 43 1HB ALA 43 6.746 -0.829 -0.123
314 2HB ALA 43 2HB ALA 43 5.095 -0.815 0.483
315 3HB ALA 43 3HB ALA 43 6.198 0.496 0.904
316 H MET 44 H MET 44 7.644 -0.185 -1.762
317 HA MET 44 HA MET 44 9.588 0.609 -2.453
318 1HB MET 44 1HB MET 44 9.584 2.562 -4.129
319 2HB MET 44 2HB MET 44 7.839 2.501 -3.983
320 1HG MET 44 1HG MET 44 8.179 1.206 -5.837
321 2HG MET 44 2HG MET 44 8.114 -0.009 -4.571
322 1HE MET 44 1HE MET 44 11.985 -0.960 -4.223
323 2HE MET 44 2HE MET 44 10.388 -1.167 -3.495
324 3HE MET 44 3HE MET 44 11.268 0.360 -3.325
325 H CYS 45 H CYS 45 8.570 4.006 -2.430
326 HA CYS 45 HA CYS 45 9.853 5.771 -1.794
327 1HB CYS 45 1HB CYS 45 9.506 4.292 0.822
328 2HB CYS 45 2HB CYS 45 8.671 5.741 0.286
329 HA PRO 46 HA PRO 46 13.891 3.964 -2.573
330 1HB PRO 46 1HB PRO 46 13.614 4.824 -4.715
331 2HB PRO 46 2HB PRO 46 14.793 5.991 -4.100
332 1HG PRO 46 1HG PRO 46 12.480 6.827 -5.087
333 2HG PRO 46 2HG PRO 46 13.172 7.581 -3.640
334 1HD PRO 46 1HD PRO 46 10.882 5.702 -3.882
335 2HD PRO 46 2HD PRO 46 11.152 7.032 -2.736
336 H HIS 47 H HIS 47 13.307 5.329 -0.106
337 HA HIS 47 HA HIS 47 15.879 6.509 0.516
338 1HB HIS 47 1HB HIS 47 14.783 8.418 1.734
339 2HB HIS 47 2HB HIS 47 13.280 7.997 0.938
340 HD2 HIS 47 2HD HIS 47 16.850 8.724 -0.543
341 HE1 HIS 47 1HE HIS 47 13.972 10.923 -2.682
342 HE2 HIS 47 2HE HIS 47 16.392 10.354 -2.466
343 H GLN 48 H GLN 48 15.769 7.141 2.870
344 HA GLN 48 HA GLN 48 15.642 6.756 4.990
345 1HB GLN 48 1HB GLN 48 13.258 7.406 4.653
346 2HB GLN 48 2HB GLN 48 13.557 6.455 6.091
347 1HG GLN 48 1HG GLN 48 12.615 4.491 5.074
348 2HG GLN 48 2HG GLN 48 12.408 5.347 3.546
349 1HE2 GLN 48 1HE2 GLN 48 10.222 4.909 3.627
350 2HE2 GLN 48 2HE2 GLN 48 9.130 5.780 4.669
351 H GLU 49 H GLU 49 16.120 5.389 6.553
352 HA GLU 49 HA GLU 49 16.184 2.585 5.763
353 1HB GLU 49 1HB GLU 49 17.909 3.995 7.828
354 2HB GLU 49 2HB GLU 49 18.410 3.713 6.177
355 1HG GLU 49 1HG GLU 49 19.516 2.080 7.414
356 2HG GLU 49 2HG GLU 49 18.182 1.236 6.650
357 H ILE 50 H ILE 50 14.117 2.216 6.313
358 HA ILE 50 HA ILE 50 13.408 1.174 8.696
359 HB ILE 50 HB ILE 50 13.551 3.564 9.596
360 1HG1 ILE 50 1HG1 ILE 50 10.739 2.426 9.576
361 2HG1 ILE 50 2HG1 ILE 50 11.331 3.642 10.699
362 1HG2 ILE 50 1HG2 ILE 50 11.859 5.205 8.942
363 2HG2 ILE 50 2HG2 ILE 50 11.304 4.108 7.679
364 3HG2 ILE 50 3HG2 ILE 50 12.935 4.773 7.614
365 1HD1 ILE 50 1HD1 ILE 50 12.946 2.054 11.593
366 2HD1 ILE 50 2HD1 ILE 50 12.344 0.816 10.484
367 3HD1 ILE 50 3HD1 ILE 50 11.291 1.467 11.737
368 H LEU 51 H LEU 51 10.893 0.849 8.614
369 HA LEU 51 HA LEU 51 10.221 0.311 5.876
370 1HB LEU 51 1HB LEU 51 8.138 -0.707 6.837
371 2HB LEU 51 2HB LEU 51 8.695 -0.244 8.424
372 HG LEU 51 HG LEU 51 9.006 -2.636 7.881
373 1HD1 LEU 51 1HD1 LEU 51 9.510 -2.495 5.553
374 2HD1 LEU 51 2HD1 LEU 51 10.799 -3.340 6.408
375 3HD1 LEU 51 3HD1 LEU 51 11.033 -1.670 5.895
376 1HD2 LEU 51 1HD2 LEU 51 11.563 -1.118 8.426
377 2HD2 LEU 51 2HD2 LEU 51 11.305 -2.833 8.746
378 3HD2 LEU 51 3HD2 LEU 51 10.373 -1.625 9.626
379 H LEU 52 H LEU 52 8.710 1.226 4.637
380 HA LEU 52 HA LEU 52 7.881 3.910 5.099
381 1HB LEU 52 1HB LEU 52 6.818 1.902 3.091
382 2HB LEU 52 2HB LEU 52 8.305 2.780 2.868
383 HG LEU 52 HG LEU 52 7.061 4.903 2.675
384 1HD1 LEU 52 1HD1 LEU 52 6.111 2.728 0.864
385 2HD1 LEU 52 2HD1 LEU 52 7.626 3.612 0.720
386 3HD1 LEU 52 3HD1 LEU 52 6.085 4.452 0.506
387 1HD2 LEU 52 1HD2 LEU 52 5.043 4.395 3.959
388 2HD2 LEU 52 2HD2 LEU 52 4.616 3.151 2.798
389 3HD2 LEU 52 3HD2 LEU 52 4.609 4.847 2.304
390 H SER 53 H SER 53 6.467 0.767 5.562
391 HA SER 53 HA SER 53 3.774 1.417 5.761
392 1HB SER 53 1HB SER 53 4.567 -0.737 5.315
393 2HB SER 53 2HB SER 53 3.636 -0.712 6.787
394 HG SER 53 HG SER 53 5.429 -1.211 7.900
395 H GLU 54 H GLU 54 6.371 2.101 7.869
396 HA GLU 54 HA GLU 54 4.621 2.243 10.175
397 1HB GLU 54 1HB GLU 54 7.626 2.563 10.050
398 2HB GLU 54 2HB GLU 54 6.823 1.022 10.296
399 1HG GLU 54 1HG GLU 54 5.800 1.924 12.355
400 2HG GLU 54 2HG GLU 54 6.734 3.400 12.130
401 H GLY 55 H GLY 55 5.013 4.101 7.678
402 1HA GLY 55 1HA GLY 55 5.241 6.336 7.217
403 2HA GLY 55 2HA GLY 55 5.779 6.609 8.875
404 H SER 56 H SER 56 3.165 7.005 6.688
405 HA SER 56 HA SER 56 1.173 6.790 8.675
406 1HB SER 56 1HB SER 56 1.962 8.756 9.449
407 2HB SER 56 2HB SER 56 0.541 9.178 8.479
408 HG SER 56 HG SER 56 1.725 10.403 7.347
409 H TYR 57 H TYR 57 -0.821 6.967 8.033
410 HA TYR 57 HA TYR 57 -1.381 7.192 5.142
411 1HB TYR 57 1HB TYR 57 -2.478 5.121 7.066
412 2HB TYR 57 2HB TYR 57 -1.427 4.812 5.694
413 HD1 TYR 57 1HD TYR 57 -2.362 5.328 3.341
414 HD2 TYR 57 2HD TYR 57 -4.816 5.060 6.803
415 HE1 TYR 57 1HE TYR 57 -4.348 4.982 1.906
416 HE2 TYR 57 2HE TYR 57 -6.793 4.717 5.393
417 HH TYR 57 HH TYR 57 -7.521 5.182 3.150
418 H GLU 58 H GLU 58 -2.549 8.771 4.800
419 HA GLU 58 HA GLU 58 -4.491 9.722 6.744
420 1HB GLU 58 1HB GLU 58 -4.603 11.702 5.121
421 2HB GLU 58 2HB GLU 58 -3.270 10.915 4.275
422 1HG GLU 58 1HG GLU 58 -3.100 11.902 7.096
423 2HG GLU 58 2HG GLU 58 -2.522 12.777 5.689
424 H GLY 59 H GLY 59 -6.555 10.562 5.543
425 1HA GLY 59 1HA GLY 59 -8.528 9.839 4.608
426 2HA GLY 59 2HA GLY 59 -7.775 8.263 4.422
427 H GLY 60 H GLY 60 -6.124 8.193 2.657
428 1HA GLY 60 1HA GLY 60 -7.261 9.490 0.249
429 2HA GLY 60 2HA GLY 60 -6.642 7.841 0.263
430 H VAL 61 H VAL 61 -4.677 9.525 2.239
431 HA VAL 61 HA VAL 61 -2.828 10.192 0.090
432 HB VAL 61 HB VAL 61 -3.382 11.740 2.639
433 1HG1 VAL 61 1HG1 VAL 61 -1.236 12.219 0.569
434 2HG1 VAL 61 2HG1 VAL 61 -0.968 11.672 2.223
435 3HG1 VAL 61 3HG1 VAL 61 -1.611 13.287 1.919
436 1HG2 VAL 61 1HG2 VAL 61 -3.606 12.521 -0.258
437 2HG2 VAL 61 2HG2 VAL 61 -3.888 13.591 1.111
438 3HG2 VAL 61 3HG2 VAL 61 -4.942 12.200 0.844
439 H ILE 62 H ILE 62 -0.784 9.472 0.388
440 HA ILE 62 HA ILE 62 -0.277 7.923 2.852
441 HB ILE 62 HB ILE 62 0.744 7.344 0.068
442 1HG1 ILE 62 1HG1 ILE 62 -1.632 6.829 0.247
443 2HG1 ILE 62 2HG1 ILE 62 -1.330 5.895 1.711
444 1HG2 ILE 62 1HG2 ILE 62 1.065 5.779 2.627
445 2HG2 ILE 62 2HG2 ILE 62 2.342 6.654 1.763
446 3HG2 ILE 62 3HG2 ILE 62 1.565 5.247 1.020
447 1HD1 ILE 62 1HD1 ILE 62 -0.263 5.229 -1.018
448 2HD1 ILE 62 2HD1 ILE 62 -1.635 4.468 -0.224
449 3HD1 ILE 62 3HD1 ILE 62 -0.019 4.307 0.463
450 H THR 63 H THR 63 1.476 8.516 3.948
451 HA THR 63 HA THR 63 3.461 10.195 2.604
452 HB THR 63 HB THR 63 2.883 9.898 5.579
453 HG1 THR 63 1HG THR 63 1.157 11.083 4.755
454 1HG2 THR 63 1HG2 THR 63 4.597 11.885 4.068
455 2HG2 THR 63 2HG2 THR 63 5.200 10.564 5.070
456 3HG2 THR 63 3HG2 THR 63 4.304 11.892 5.807
457 H CYS 64 H CYS 64 5.419 9.165 2.227
458 HA CYS 64 HA CYS 64 5.767 6.501 2.950
459 1HB CYS 64 1HB CYS 64 6.953 7.186 1.014
460 2HB CYS 64 2HB CYS 64 8.189 6.787 2.196
461 H ARG 65 H ARG 65 6.739 9.344 4.556
462 HA ARG 65 HA ARG 65 6.293 8.495 7.038
463 1HB ARG 65 1HB ARG 65 9.306 8.348 6.609
464 2HB ARG 65 2HB ARG 65 8.273 6.947 6.881
465 1HG ARG 65 1HG ARG 65 7.616 7.937 9.068
466 2HG ARG 65 2HG ARG 65 8.773 9.228 8.787
467 1HD ARG 65 1HD ARG 65 9.443 6.304 9.011
468 2HD ARG 65 2HD ARG 65 9.680 7.520 10.258
469 HE ARG 65 HE ARG 65 11.015 7.666 7.659
470 1HH1 ARG 65 1HH1 ARG 65 11.164 7.699 11.219
471 2HH1 ARG 65 2HH1 ARG 65 12.820 8.035 11.300
472 1HH2 ARG 65 1HH2 ARG 65 13.343 8.121 7.790
473 2HH2 ARG 65 2HH2 ARG 65 14.086 8.245 9.313
474 H ALA 66 H ALA 66 8.689 10.295 5.198
475 HA ALA 66 HA ALA 66 7.487 12.686 6.252
476 1HB ALA 66 1HB ALA 66 9.584 13.701 6.941
477 2HB ALA 66 2HB ALA 66 10.458 12.220 6.543
478 3HB ALA 66 3HB ALA 66 9.280 12.227 7.854
479 H HIS 67 H HIS 67 10.626 12.374 4.689
480 HA HIS 67 HA HIS 67 11.546 13.403 2.953
481 1HB HIS 67 1HB HIS 67 9.031 12.579 1.436
482 2HB HIS 67 2HB HIS 67 10.383 11.509 1.758
483 HD2 HIS 67 2HD HIS 67 10.554 15.147 0.186
484 HE1 HIS 67 1HE HIS 67 12.332 12.442 -2.497
485 HE2 HIS 67 2HE HIS 67 11.658 14.819 -2.100
486 H LEU 68 H LEU 68 8.262 14.302 1.946
487 HA LEU 68 HA LEU 68 8.316 16.958 2.816
488 1HB LEU 68 1HB LEU 68 9.122 16.560 -0.073
489 2HB LEU 68 2HB LEU 68 10.151 17.218 1.184
490 HG LEU 68 HG LEU 68 7.642 18.512 0.125
491 1HD1 LEU 68 1HD1 LEU 68 9.716 19.544 2.053
492 2HD1 LEU 68 2HD1 LEU 68 8.049 19.113 2.443
493 3HD1 LEU 68 3HD1 LEU 68 8.383 20.477 1.375
494 1HD2 LEU 68 1HD2 LEU 68 9.158 20.111 -0.916
495 2HD2 LEU 68 2HD2 LEU 68 9.430 18.481 -1.531
496 3HD2 LEU 68 3HD2 LEU 68 10.542 19.178 -0.351
497 H TRP 69 H TRP 69 7.443 15.196 -0.172
498 HA TRP 69 HA TRP 69 4.743 16.199 0.152
499 1HB TRP 69 1HB TRP 69 4.418 15.442 -2.225
500 2HB TRP 69 2HB TRP 69 6.134 15.051 -2.266
501 HD1 TRP 69 HD TRP 69 4.344 18.234 -0.971
502 HE1 TRP 69 1HE TRP 69 5.406 20.256 -2.106
503 HE3 TRP 69 3HE TRP 69 7.646 15.796 -4.014
504 HZ2 TRP 69 2HZ TRP 69 7.381 20.773 -4.064
505 HZ3 TRP 69 3HZ TRP 69 9.079 17.141 -5.500
506 HH2 TRP 69 HH TRP 69 8.946 19.572 -5.519
507 H THR 70 H THR 70 3.214 14.477 -1.179
508 HA THR 70 HA THR 70 3.421 11.949 0.265
509 HB THR 70 HB THR 70 1.006 12.131 0.849
510 HG1 THR 70 1HG THR 70 1.426 14.719 -0.191
511 1HG2 THR 70 1HG2 THR 70 2.697 12.721 2.530
512 2HG2 THR 70 2HG2 THR 70 1.268 13.749 2.682
513 3HG2 THR 70 3HG2 THR 70 2.726 14.374 1.920
514 H PHE 71 H PHE 71 1.801 10.360 -0.545
515 HA PHE 71 HA PHE 71 1.400 10.618 -3.450
516 1HB PHE 71 1HB PHE 71 1.539 8.215 -1.598
517 2HB PHE 71 2HB PHE 71 2.682 8.648 -2.860
518 HD1 PHE 71 1HD PHE 71 -0.392 6.931 -2.087
519 HD2 PHE 71 2HD PHE 71 2.016 8.425 -5.246
520 HE1 PHE 71 1HE PHE 71 -1.627 5.523 -3.677
521 HE2 PHE 71 2HE PHE 71 0.788 7.026 -6.844
522 HZ PHE 71 HZ PHE 71 -1.039 5.571 -6.062
523 H ASN 72 H ASN 72 -0.712 10.160 -4.317
524 HA ASN 72 HA ASN 72 -2.838 10.215 -2.290
525 1HB ASN 72 1HB ASN 72 -2.889 11.506 -5.025
526 2HB ASN 72 2HB ASN 72 -2.648 12.358 -3.503
527 1HD2 ASN 72 1HD2 ASN 72 -4.339 12.574 -2.109
528 2HD2 ASN 72 2HD2 ASN 72 -5.982 12.351 -2.560
529 H ASP 73 H ASP 73 -4.203 8.640 -2.307
530 HA ASP 73 HA ASP 73 -4.001 6.319 -3.784
531 1HB ASP 73 1HB ASP 73 -6.361 7.463 -2.275
532 2HB ASP 73 2HB ASP 73 -5.159 6.331 -1.676
533 H GLY 74 H GLY 74 -6.476 8.853 -4.075
534 1HA GLY 74 1HA GLY 74 -8.172 9.129 -5.642
535 2HA GLY 74 2HA GLY 74 -7.617 7.681 -6.468
536 H THR 75 H THR 75 -5.120 8.225 -7.050
537 HA THR 75 HA THR 75 -5.364 10.131 -9.204
538 HB THR 75 HB THR 75 -3.111 10.426 -7.169
539 HG1 THR 75 1HG THR 75 -5.037 11.335 -6.431
540 1HG2 THR 75 1HG2 THR 75 -3.728 12.038 -9.660
541 2HG2 THR 75 2HG2 THR 75 -2.405 10.890 -9.482
542 3HG2 THR 75 3HG2 THR 75 -2.427 12.364 -8.511
543 H GLY 76 H GLY 76 -3.262 7.905 -7.369
544 1HA GLY 76 1HA GLY 76 -2.614 6.480 -9.836
545 2HA GLY 76 2HA GLY 76 -2.247 5.976 -8.192
546 H HIS 77 H HIS 77 -1.580 9.091 -9.534
547 HA HIS 77 HA HIS 77 1.269 8.583 -9.817
548 1HB HIS 77 1HB HIS 77 -0.326 11.115 -10.169
549 2HB HIS 77 2HB HIS 77 -0.113 9.945 -11.458
550 HD1 HIS 77 1HD HIS 77 1.167 13.054 -10.473
551 HD2 HIS 77 2HD HIS 77 2.910 9.556 -11.852
552 HE1 HIS 77 1HE HIS 77 3.389 13.731 -11.419
553 HE2 HIS 77 2HE HIS 77 4.522 11.582 -11.932
554 H GLY 78 H GLY 78 2.873 9.675 -8.433
555 1HA GLY 78 1HA GLY 78 3.258 9.831 -6.131
556 2HA GLY 78 2HA GLY 78 1.616 10.429 -5.913
557 H ILE 79 H ILE 79 1.960 12.359 -4.957
558 HA ILE 79 HA ILE 79 3.144 14.413 -6.537
559 HB ILE 79 HB ILE 79 2.289 14.519 -3.592
560 1HG1 ILE 79 1HG1 ILE 79 0.786 15.455 -6.067
561 2HG1 ILE 79 2HG1 ILE 79 0.318 15.878 -4.433
562 1HG2 ILE 79 1HG2 ILE 79 3.929 16.242 -4.126
563 2HG2 ILE 79 2HG2 ILE 79 2.347 16.956 -3.821
564 3HG2 ILE 79 3HG2 ILE 79 2.932 16.782 -5.477
565 1HD1 ILE 79 1HD1 ILE 79 -1.083 14.117 -5.279
566 2HD1 ILE 79 2HD1 ILE 79 -0.118 13.533 -3.921
567 3HD1 ILE 79 3HD1 ILE 79 0.327 13.102 -5.572
568 H ASN 80 H ASN 80 3.968 12.330 -3.924
569 HA ASN 80 HA ASN 80 6.809 13.104 -4.150
570 1HB ASN 80 1HB ASN 80 5.433 11.387 -2.039
571 2HB ASN 80 2HB ASN 80 5.922 13.056 -1.813
572 1HD2 ASN 80 1HD2 ASN 80 7.083 9.754 -2.174
573 2HD2 ASN 80 2HD2 ASN 80 8.689 9.988 -1.642
574 HA PRO 81 HA PRO 81 8.718 12.505 -4.471
575 1HB PRO 81 1HB PRO 81 10.595 11.584 -5.397
576 2HB PRO 81 2HB PRO 81 9.802 11.511 -6.975
577 1HG PRO 81 1HG PRO 81 9.799 9.486 -4.766
578 2HG PRO 81 2HG PRO 81 9.876 9.235 -6.521
579 1HD PRO 81 1HD PRO 81 7.629 8.822 -5.199
580 2HD PRO 81 2HD PRO 81 7.628 9.584 -6.807
581 H ASP 82 H ASP 82 7.454 11.465 -7.325
582 HA ASP 82 HA ASP 82 5.699 13.245 -8.319
583 1HB ASP 82 1HB ASP 82 8.417 14.278 -9.228
584 2HB ASP 82 2HB ASP 82 7.413 15.100 -8.043
585 H ASP 83 H ASP 83 8.653 11.661 -9.099
586 HA ASP 83 HA ASP 83 7.936 11.126 -11.843
587 1HB ASP 83 1HB ASP 83 10.322 11.295 -11.146
588 2HB ASP 83 2HB ASP 83 9.961 9.788 -11.975
589 H CYS 84 H CYS 84 7.279 9.657 -8.863
590 HA CYS 84 HA CYS 84 6.900 7.094 -10.116
591 1HB CYS 84 1HB CYS 84 6.646 6.181 -7.912
592 2HB CYS 84 2HB CYS 84 6.727 7.772 -7.196
593 HG CYS 84 HG CYS 84 9.450 7.733 -8.829
594 H CYS 85 H CYS 85 5.211 6.042 -10.002
595 HA CYS 85 HA CYS 85 2.738 7.015 -8.946
596 1HB CYS 85 1HB CYS 85 2.275 7.614 -11.118
597 2HB CYS 85 2HB CYS 85 1.685 5.970 -11.041
598 HG CYS 85 HG CYS 85 3.553 4.771 -12.540
599 H LEU 86 H LEU 86 1.377 5.361 -8.569
600 HA LEU 86 HA LEU 86 2.927 2.884 -8.111
601 1HB LEU 86 1HB LEU 86 1.711 2.494 -6.037
602 2HB LEU 86 2HB LEU 86 0.754 3.933 -6.301
603 HG LEU 86 HG LEU 86 2.627 5.362 -5.899
604 1HD1 LEU 86 1HD1 LEU 86 3.150 4.822 -3.576
605 2HD1 LEU 86 2HD1 LEU 86 2.488 3.205 -3.818
606 3HD1 LEU 86 3HD1 LEU 86 1.439 4.617 -3.954
607 1HD2 LEU 86 1HD2 LEU 86 4.409 4.055 -6.940
608 2HD2 LEU 86 2HD2 LEU 86 4.308 2.868 -5.640
609 3HD2 LEU 86 3HD2 LEU 86 4.853 4.508 -5.294
610 H ALA 87 H ALA 87 1.365 1.052 -7.461
611 HA ALA 87 HA ALA 87 -0.815 0.956 -9.404
612 1HB ALA 87 1HB ALA 87 1.159 -1.242 -8.770
613 2HB ALA 87 2HB ALA 87 1.098 -0.311 -10.264
614 3HB ALA 87 3HB ALA 87 -0.229 -1.392 -9.846
615 H GLU 88 H GLU 88 -2.616 -0.096 -8.698
616 HA GLU 88 HA GLU 88 -2.781 -0.789 -5.864
617 1HB GLU 88 1HB GLU 88 -5.222 -0.648 -6.287
618 2HB GLU 88 2HB GLU 88 -4.893 -0.317 -7.980
619 1HG GLU 88 1HG GLU 88 -3.683 1.741 -7.275
620 2HG GLU 88 2HG GLU 88 -4.239 1.441 -5.629
621 H TYR 89 H TYR 89 -2.681 -2.889 -5.418
622 HA TYR 89 HA TYR 89 -2.826 -4.820 -7.592
623 1HB TYR 89 1HB TYR 89 -1.895 -6.418 -5.954
624 2HB TYR 89 2HB TYR 89 -1.996 -5.180 -4.706
625 HD1 TYR 89 1HD TYR 89 -0.252 -6.243 -7.739
626 HD2 TYR 89 2HD TYR 89 -0.457 -3.338 -4.651
627 HE1 TYR 89 1HE TYR 89 1.959 -5.396 -8.389
628 HE2 TYR 89 2HE TYR 89 1.744 -2.490 -5.289
629 HH TYR 89 HH TYR 89 3.210 -3.481 -8.196
630 HA PRO 90 HA PRO 90 -6.882 -6.187 -6.527
631 1HB PRO 90 1HB PRO 90 -7.302 -7.845 -8.041
632 2HB PRO 90 2HB PRO 90 -6.211 -8.954 -7.211
633 1HG PRO 90 1HG PRO 90 -5.651 -7.031 -9.409
634 2HG PRO 90 2HG PRO 90 -4.926 -8.615 -9.088
635 1HD PRO 90 1HD PRO 90 -3.602 -6.341 -8.565
636 2HD PRO 90 2HD PRO 90 -3.450 -7.774 -7.534
637 H VAL 91 H VAL 91 -7.488 -6.403 -4.508
638 HA VAL 91 HA VAL 91 -6.408 -8.581 -2.923
639 HB VAL 91 HB VAL 91 -5.353 -6.558 -2.134
640 1HG1 VAL 91 1HG1 VAL 91 -6.631 -4.654 -1.231
641 2HG1 VAL 91 2HG1 VAL 91 -8.119 -5.404 -1.812
642 3HG1 VAL 91 3HG1 VAL 91 -6.883 -4.889 -2.960
643 1HG2 VAL 91 1HG2 VAL 91 -6.071 -6.532 0.217
644 2HG2 VAL 91 2HG2 VAL 91 -5.993 -8.179 -0.417
645 3HG2 VAL 91 3HG2 VAL 91 -7.547 -7.376 -0.236
646 H GLU 92 H GLU 92 -7.828 -9.726 -1.837
647 HA GLU 92 HA GLU 92 -10.623 -8.844 -1.894
648 1HB GLU 92 1HB GLU 92 -9.607 -11.618 -2.375
649 2HB GLU 92 2HB GLU 92 -10.165 -10.488 -3.615
650 1HG GLU 92 1HG GLU 92 -12.389 -10.511 -2.667
651 2HG GLU 92 2HG GLU 92 -11.858 -11.622 -1.411
652 H VAL 93 H VAL 93 -11.507 -8.912 -0.105
653 HA VAL 93 HA VAL 93 -10.268 -10.347 2.136
654 HB VAL 93 HB VAL 93 -10.123 -7.938 2.437
655 1HG1 VAL 93 1HG1 VAL 93 -11.996 -7.165 1.142
656 2HG1 VAL 93 2HG1 VAL 93 -12.114 -6.529 2.787
657 3HG1 VAL 93 3HG1 VAL 93 -13.125 -7.884 2.291
658 1HG2 VAL 93 1HG2 VAL 93 -11.145 -7.732 4.668
659 2HG2 VAL 93 2HG2 VAL 93 -10.371 -9.305 4.454
660 3HG2 VAL 93 3HG2 VAL 93 -12.122 -9.160 4.342
661 H LYS 94 H LYS 94 -11.364 -11.880 3.044
662 HA LYS 94 HA LYS 94 -14.202 -11.772 2.816
663 1HB LYS 94 1HB LYS 94 -13.685 -13.420 1.145
664 2HB LYS 94 2HB LYS 94 -14.427 -14.242 2.494
665 1HG LYS 94 1HG LYS 94 -12.660 -15.583 1.652
666 2HG LYS 94 2HG LYS 94 -12.227 -14.997 3.255
667 1HD LYS 94 1HD LYS 94 -10.327 -14.831 1.853
668 2HD LYS 94 2HD LYS 94 -10.872 -13.225 2.219
669 1HE LYS 94 1HE LYS 94 -10.265 -13.381 -0.127
670 2HE LYS 94 2HE LYS 94 -11.983 -13.066 0.051
671 1HZ LYS 94 1HZ LYS 94 -11.570 -14.677 -1.639
672 2HZ LYS 94 2HZ LYS 94 -12.426 -15.418 -0.397
673 3HZ LYS 94 3HZ LYS 94 -10.786 -15.726 -0.581
674 H GLY 95 H GLY 95 -14.692 -11.218 4.789
675 1HA GLY 95 1HA GLY 95 -14.482 -13.159 6.867
676 2HA GLY 95 2HA GLY 95 -15.120 -11.532 7.039
677 H ASP 96 H ASP 96 -12.629 -13.567 7.641
678 HA ASP 96 HA ASP 96 -10.955 -11.353 8.698
679 1HB ASP 96 1HB ASP 96 -10.030 -12.988 10.250
680 2HB ASP 96 2HB ASP 96 -11.123 -14.217 9.647
681 H ASP 97 H ASP 97 -11.075 -13.188 6.111
682 HA ASP 97 HA ASP 97 -8.166 -13.696 6.106
683 1HB ASP 97 1HB ASP 97 -8.620 -15.183 4.234
684 2HB ASP 97 2HB ASP 97 -10.345 -14.894 4.397
685 H ILE 98 H ILE 98 -6.860 -12.850 4.591
686 HA ILE 98 HA ILE 98 -8.110 -11.100 2.617
687 HB ILE 98 HB ILE 98 -5.739 -10.543 4.374
688 1HG1 ILE 98 1HG1 ILE 98 -7.944 -10.129 5.361
689 2HG1 ILE 98 2HG1 ILE 98 -8.357 -9.096 3.996
690 1HG2 ILE 98 1HG2 ILE 98 -6.754 -8.901 2.015
691 2HG2 ILE 98 2HG2 ILE 98 -5.226 -9.768 2.073
692 3HG2 ILE 98 3HG2 ILE 98 -5.490 -8.388 3.134
693 1HD1 ILE 98 1HD1 ILE 98 -6.656 -7.529 4.607
694 2HD1 ILE 98 2HD1 ILE 98 -6.195 -8.558 5.974
695 3HD1 ILE 98 3HD1 ILE 98 -7.800 -7.804 5.928
696 H TYR 99 H TYR 99 -7.611 -11.639 0.661
697 HA TYR 99 HA TYR 99 -5.108 -13.064 0.138
698 1HB TYR 99 1HB TYR 99 -6.304 -13.883 -1.928
699 2HB TYR 99 2HB TYR 99 -7.753 -13.170 -1.272
700 HD1 TYR 99 1HD TYR 99 -5.888 -16.131 -1.509
701 HD2 TYR 99 2HD TYR 99 -8.330 -14.001 1.228
702 HE1 TYR 99 1HE TYR 99 -6.268 -18.195 -0.255
703 HE2 TYR 99 2HE TYR 99 -8.723 -16.076 2.490
704 HH TYR 99 HH TYR 99 -6.904 -18.881 1.991
705 H VAL 100 H VAL 100 -3.851 -12.355 -1.397
706 HA VAL 100 HA VAL 100 -4.599 -9.874 -2.782
707 HB VAL 100 HB VAL 100 -2.300 -9.009 -2.483
708 1HG1 VAL 100 1HG1 VAL 100 -3.981 -8.266 -0.939
709 2HG1 VAL 100 2HG1 VAL 100 -2.432 -8.425 -0.110
710 3HG1 VAL 100 3HG1 VAL 100 -3.680 -9.653 0.108
711 1HG2 VAL 100 1HG2 VAL 100 -0.771 -10.046 -0.854
712 2HG2 VAL 100 2HG2 VAL 100 -1.108 -11.125 -2.210
713 3HG2 VAL 100 3HG2 VAL 100 -1.905 -11.384 -0.658
714 H SER 101 H SER 101 -3.707 -9.579 -4.804
715 HA SER 101 HA SER 101 -2.206 -11.841 -5.905
716 1HB SER 101 1HB SER 101 -4.395 -10.266 -7.293
717 2HB SER 101 2HB SER 101 -4.591 -11.891 -6.641
718 HG SER 101 HG SER 101 -3.932 -11.431 -9.033
719 H THR 102 H THR 102 -0.611 -11.272 -7.376
720 HA THR 102 HA THR 102 -0.217 -8.400 -7.857
721 HB THR 102 HB THR 102 1.948 -10.495 -7.343
722 HG1 THR 102 1HG THR 102 0.376 -9.131 -5.694
723 1HG2 THR 102 1HG2 THR 102 3.467 -8.559 -7.181
724 2HG2 THR 102 2HG2 THR 102 2.125 -7.468 -7.534
725 3HG2 THR 102 3HG2 THR 102 2.692 -8.592 -8.766
726 H LYS 103 H LYS 103 -1.094 -11.215 -9.110
727 HA LYS 103 HA LYS 103 0.382 -11.065 -11.593
728 1HB LYS 103 1HB LYS 103 -1.815 -12.925 -10.667
729 2HB LYS 103 2HB LYS 103 -0.092 -13.250 -10.547
730 1HG LYS 103 1HG LYS 103 0.084 -13.227 -12.986
731 2HG LYS 103 2HG LYS 103 -1.659 -12.959 -13.090
732 1HD LYS 103 1HD LYS 103 -2.069 -15.050 -11.931
733 2HD LYS 103 2HD LYS 103 -0.333 -15.299 -11.745
734 1HE LYS 103 1HE LYS 103 -0.094 -15.375 -14.186
735 2HE LYS 103 2HE LYS 103 -1.838 -15.183 -14.351
736 1HZ LYS 103 1HZ LYS 103 -0.507 -17.427 -12.955
737 2HZ LYS 103 2HZ LYS 103 -1.090 -17.491 -14.519
738 3HZ LYS 103 3HZ LYS 103 -2.175 -17.276 -13.234
739 H GLY 104 H GLY 104 -0.419 -10.111 -13.358
740 1HA GLY 104 1HA GLY 104 -3.260 -9.376 -13.390
741 2HA GLY 104 2HA GLY 104 -2.230 -9.549 -14.810
742 H ILE 105 H ILE 105 -1.713 -7.912 -11.750
743 HA ILE 105 HA ILE 105 -1.445 -5.414 -13.231
744 HB ILE 105 HB ILE 105 -2.087 -5.845 -10.298
745 1HG1 ILE 105 1HG1 ILE 105 -3.966 -6.293 -11.798
746 2HG1 ILE 105 2HG1 ILE 105 -3.729 -4.751 -12.604
747 1HG2 ILE 105 1HG2 ILE 105 -0.669 -3.846 -10.605
748 2HG2 ILE 105 2HG2 ILE 105 -2.310 -3.386 -10.153
749 3HG2 ILE 105 3HG2 ILE 105 -1.786 -3.242 -11.831
750 1HD1 ILE 105 1HD1 ILE 105 -4.606 -5.103 -9.751
751 2HD1 ILE 105 2HD1 ILE 105 -5.624 -4.661 -11.115
752 3HD1 ILE 105 3HD1 ILE 105 -4.349 -3.569 -10.577
753 H LEU 106 H LEU 106 0.518 -5.053 -13.709
754 HA LEU 106 HA LEU 106 2.742 -6.165 -12.250
755 1HB LEU 106 1HB LEU 106 2.656 -4.300 -14.629
756 2HB LEU 106 2HB LEU 106 2.604 -6.039 -14.754
757 HG LEU 106 HG LEU 106 4.937 -4.539 -13.587
758 1HD1 LEU 106 1HD1 LEU 106 4.670 -7.371 -14.567
759 2HD1 LEU 106 2HD1 LEU 106 4.747 -6.880 -12.884
760 3HD1 LEU 106 3HD1 LEU 106 6.139 -6.628 -13.942
761 1HD2 LEU 106 1HD2 LEU 106 6.054 -4.935 -15.732
762 2HD2 LEU 106 2HD2 LEU 106 4.641 -3.893 -15.913
763 3HD2 LEU 106 3HD2 LEU 106 4.552 -5.591 -16.384
764 HA PRO 107 HA PRO 107 3.506 -2.537 -9.588
765 1HB PRO 107 1HB PRO 107 5.652 -2.886 -8.735
766 2HB PRO 107 2HB PRO 107 6.294 -3.305 -10.338
767 1HG PRO 107 1HG PRO 107 4.595 -4.961 -8.509
768 2HG PRO 107 2HG PRO 107 6.110 -5.395 -9.322
769 1HD PRO 107 1HD PRO 107 3.687 -6.079 -10.320
770 2HD PRO 107 2HD PRO 107 5.077 -5.676 -11.362
771 H ASN 108 H ASN 108 3.534 -0.584 -10.159
772 HA ASN 108 HA ASN 108 4.029 0.248 -12.890
773 1HB ASN 108 1HB ASN 108 2.907 1.668 -10.481
774 2HB ASN 108 2HB ASN 108 2.016 0.722 -11.687
775 1HD2 ASN 108 1HD2 ASN 108 0.669 2.452 -11.891
776 2HD2 ASN 108 2HD2 ASN 108 1.053 3.751 -12.926
777 H LYS 109 H LYS 109 5.419 1.701 -13.463
778 HA LYS 109 HA LYS 109 7.366 2.864 -13.715
779 1HB LYS 109 1HB LYS 109 6.763 4.133 -11.085
780 2HB LYS 109 2HB LYS 109 5.689 4.368 -12.442
781 1HG LYS 109 1HG LYS 109 7.124 6.277 -12.311
782 2HG LYS 109 2HG LYS 109 7.527 5.369 -13.750
783 1HD LYS 109 1HD LYS 109 9.554 6.184 -12.759
784 2HD LYS 109 2HD LYS 109 9.506 4.428 -12.636
785 1HE LYS 109 1HE LYS 109 8.911 4.528 -10.324
786 2HE LYS 109 2HE LYS 109 8.723 6.278 -10.395
787 1HZ LYS 109 1HZ LYS 109 11.016 6.554 -10.750
788 2HZ LYS 109 2HZ LYS 109 11.314 4.914 -10.883
789 3HZ LYS 109 3HZ LYS 109 10.870 5.572 -9.399
790 H ALA 110 H ALA 110 7.436 2.564 -10.340
791 HA ALA 110 HA ALA 110 10.284 2.344 -10.165
792 1HB ALA 110 1HB ALA 110 8.952 3.219 -8.292
793 2HB ALA 110 2HB ALA 110 9.976 1.873 -7.788
794 3HB ALA 110 3HB ALA 110 8.254 1.618 -8.054
795 H HIS 111 H HIS 111 7.881 0.021 -9.296
796 HA HIS 111 HA HIS 111 7.736 -2.260 -9.517
797 1HB HIS 111 1HB HIS 111 9.650 -1.782 -11.818
798 2HB HIS 111 2HB HIS 111 7.901 -1.834 -11.920
799 HD1 HIS 111 1HD HIS 111 10.828 -4.167 -11.332
800 HD2 HIS 111 2HD HIS 111 6.813 -4.321 -12.360
801 HE1 HIS 111 1HE HIS 111 10.402 -6.531 -11.999
802 HE2 HIS 111 2HE HIS 111 8.140 -6.459 -12.995
803 H SER 112 H SER 112 8.642 -2.812 -7.514
804 HA SER 112 HA SER 112 11.432 -3.403 -7.439
805 1HB SER 112 1HB SER 112 10.408 -2.558 -5.412
806 2HB SER 112 2HB SER 112 10.818 -4.253 -5.133
807 HG SER 112 HG SER 112 8.664 -4.604 -5.975
Start of MODEL 9
1 1H MET 1 1HT MET 1 -2.918 -19.648 -6.081
2 2H MET 1 2HT MET 1 -4.145 -18.894 -6.935
3 3H MET 1 3HT MET 1 -3.314 -18.039 -5.766
4 HA MET 1 HA MET 1 -1.281 -18.167 -7.042
5 1HB MET 1 1HB MET 1 -3.044 -19.487 -9.120
6 2HB MET 1 2HB MET 1 -1.751 -20.272 -8.226
7 1HG MET 1 1HG MET 1 -1.437 -18.034 -10.221
8 2HG MET 1 2HG MET 1 -1.032 -19.731 -10.478
9 1HE MET 1 1HE MET 1 1.000 -17.386 -11.089
10 2HE MET 1 2HE MET 1 1.383 -19.091 -11.311
11 3HE MET 1 3HE MET 1 2.488 -18.050 -10.414
12 H SER 2 H SER 2 -4.384 -17.644 -8.853
13 HA SER 2 HA SER 2 -3.687 -15.178 -9.930
14 1HB SER 2 1HB SER 2 -6.105 -14.863 -10.186
15 2HB SER 2 2HB SER 2 -6.420 -16.090 -8.961
16 HG SER 2 HG SER 2 -4.897 -16.678 -11.239
17 H PHE 3 H PHE 3 -5.509 -15.967 -7.009
18 HA PHE 3 HA PHE 3 -4.540 -13.528 -5.666
19 1HB PHE 3 1HB PHE 3 -6.402 -13.975 -4.090
20 2HB PHE 3 2HB PHE 3 -6.945 -15.302 -5.098
21 HD1 PHE 3 1HD PHE 3 -6.963 -11.731 -4.603
22 HD2 PHE 3 2HD PHE 3 -7.924 -14.857 -7.327
23 HE1 PHE 3 1HE PHE 3 -8.416 -10.189 -5.847
24 HE2 PHE 3 2HE PHE 3 -9.377 -13.316 -8.582
25 HZ PHE 3 HZ PHE 3 -9.624 -10.981 -7.840
26 H GLU 4 H GLU 4 -3.582 -13.845 -3.723
27 HA GLU 4 HA GLU 4 -3.311 -16.571 -2.753
28 1HB GLU 4 1HB GLU 4 -0.981 -14.685 -3.176
29 2HB GLU 4 2HB GLU 4 -1.346 -16.042 -4.227
30 1HG GLU 4 1HG GLU 4 -0.976 -17.588 -2.392
31 2HG GLU 4 2HG GLU 4 -0.628 -16.236 -1.313
32 H LYS 5 H LYS 5 -3.060 -16.601 -0.487
33 HA LYS 5 HA LYS 5 -4.000 -14.228 0.796
34 1HB LYS 5 1HB LYS 5 -3.125 -16.865 1.975
35 2HB LYS 5 2HB LYS 5 -4.774 -16.369 1.623
36 1HG LYS 5 1HG LYS 5 -4.491 -14.520 3.264
37 2HG LYS 5 2HG LYS 5 -2.932 -15.214 3.701
38 1HD LYS 5 1HD LYS 5 -4.051 -17.313 4.308
39 2HD LYS 5 2HD LYS 5 -5.604 -16.571 3.919
40 1HE LYS 5 1HE LYS 5 -5.333 -16.384 6.278
41 2HE LYS 5 2HE LYS 5 -5.072 -14.796 5.589
42 1HZ LYS 5 1HZ LYS 5 -2.952 -16.660 6.434
43 2HZ LYS 5 2HZ LYS 5 -3.455 -15.318 7.290
44 3HZ LYS 5 3HZ LYS 5 -2.651 -15.125 5.809
45 H ILE 6 H ILE 6 -3.007 -12.746 1.768
46 HA ILE 6 HA ILE 6 -0.101 -12.910 1.785
47 HB ILE 6 HB ILE 6 -1.143 -11.075 0.540
48 1HG1 ILE 6 1HG1 ILE 6 0.446 -10.175 2.946
49 2HG1 ILE 6 2HG1 ILE 6 0.172 -9.187 1.514
50 1HG2 ILE 6 1HG2 ILE 6 -2.219 -10.119 3.166
51 2HG2 ILE 6 2HG2 ILE 6 -3.143 -10.724 1.806
52 3HG2 ILE 6 3HG2 ILE 6 -2.258 -9.197 1.660
53 1HD1 ILE 6 1HD1 ILE 6 2.362 -10.212 1.432
54 2HD1 ILE 6 2HD1 ILE 6 1.343 -10.854 0.148
55 3HD1 ILE 6 3HD1 ILE 6 1.648 -11.814 1.594
56 H CYS 7 H CYS 7 -2.836 -12.094 3.795
57 HA CYS 7 HA CYS 7 -1.522 -12.960 6.177
58 1HB CYS 7 1HB CYS 7 -0.392 -10.895 6.212
59 2HB CYS 7 2HB CYS 7 -1.716 -10.729 7.344
60 HG CYS 7 HG CYS 7 -1.630 -8.317 6.195
61 H SER 8 H SER 8 -2.857 -11.985 8.141
62 HA SER 8 HA SER 8 -5.723 -12.243 7.495
63 1HB SER 8 1HB SER 8 -6.136 -13.490 9.376
64 2HB SER 8 2HB SER 8 -4.639 -13.309 10.149
65 HG SER 8 HG SER 8 -5.411 -15.237 8.775
66 H LEU 9 H LEU 9 -7.130 -11.125 8.787
67 HA LEU 9 HA LEU 9 -6.461 -8.464 9.484
68 1HB LEU 9 1HB LEU 9 -8.863 -10.003 10.397
69 2HB LEU 9 2HB LEU 9 -8.717 -9.432 8.761
70 HG LEU 9 HG LEU 9 -8.665 -7.043 9.773
71 1HD1 LEU 9 1HD1 LEU 9 -11.130 -8.742 10.080
72 2HD1 LEU 9 2HD1 LEU 9 -10.579 -7.969 8.594
73 3HD1 LEU 9 3HD1 LEU 9 -11.098 -6.983 9.961
74 1HD2 LEU 9 1HD2 LEU 9 -8.246 -7.692 12.121
75 2HD2 LEU 9 2HD2 LEU 9 -9.792 -8.541 12.153
76 3HD2 LEU 9 3HD2 LEU 9 -9.751 -6.788 11.951
77 H ASP 10 H ASP 10 -6.536 -11.366 11.315
78 HA ASP 10 HA ASP 10 -6.444 -10.371 13.948
79 1HB ASP 10 1HB ASP 10 -5.185 -12.840 12.719
80 2HB ASP 10 2HB ASP 10 -6.712 -12.741 13.572
81 H ASP 11 H ASP 11 -4.097 -10.328 11.440
82 HA ASP 11 HA ASP 11 -2.111 -9.198 13.271
83 1HB ASP 11 1HB ASP 11 -1.737 -10.265 10.461
84 2HB ASP 11 2HB ASP 11 -1.235 -11.062 11.945
85 H ILE 12 H ILE 12 -3.742 -8.637 10.170
86 HA ILE 12 HA ILE 12 -2.866 -5.849 10.292
87 HB ILE 12 HB ILE 12 -2.275 -6.730 8.322
88 1HG1 ILE 12 1HG1 ILE 12 -4.726 -5.067 7.753
89 2HG1 ILE 12 2HG1 ILE 12 -3.513 -5.458 6.550
90 1HG2 ILE 12 1HG2 ILE 12 -5.103 -7.698 7.857
91 2HG2 ILE 12 2HG2 ILE 12 -3.680 -8.700 8.134
92 3HG2 ILE 12 3HG2 ILE 12 -3.839 -7.788 6.631
93 1HD1 ILE 12 1HD1 ILE 12 -1.800 -4.328 7.838
94 2HD1 ILE 12 2HD1 ILE 12 -2.984 -3.939 9.085
95 3HD1 ILE 12 3HD1 ILE 12 -3.142 -3.244 7.472
96 H TRP 13 H TRP 13 -4.054 -4.504 11.097
97 HA TRP 13 HA TRP 13 -6.885 -5.078 11.424
98 1HB TRP 13 1HB TRP 13 -6.702 -3.426 13.306
99 2HB TRP 13 2HB TRP 13 -4.981 -3.393 12.971
100 HD1 TRP 13 HD TRP 13 -3.633 -5.752 13.262
101 HE1 TRP 13 1HE TRP 13 -4.057 -7.685 14.904
102 HE3 TRP 13 3HE TRP 13 -8.474 -4.699 14.512
103 HZ2 TRP 13 2HZ TRP 13 -6.172 -8.645 16.504
104 HZ3 TRP 13 3HZ TRP 13 -9.631 -6.181 16.092
105 HH2 TRP 13 HH TRP 13 -8.504 -8.114 17.066
106 H VAL 14 H VAL 14 -8.323 -3.300 11.566
107 HA VAL 14 HA VAL 14 -8.236 -1.757 9.221
108 HB VAL 14 HB VAL 14 -10.344 -2.611 10.116
109 1HG1 VAL 14 1HG1 VAL 14 -9.975 -0.699 12.407
110 2HG1 VAL 14 2HG1 VAL 14 -9.949 -2.459 12.485
111 3HG1 VAL 14 3HG1 VAL 14 -11.441 -1.618 12.065
112 1HG2 VAL 14 1HG2 VAL 14 -10.462 -0.694 8.663
113 2HG2 VAL 14 2HG2 VAL 14 -10.271 0.394 10.039
114 3HG2 VAL 14 3HG2 VAL 14 -11.726 -0.590 9.890
115 H GLY 15 H GLY 15 -7.399 0.144 8.841
116 1HA GLY 15 1HA GLY 15 -7.028 2.126 10.959
117 2HA GLY 15 2HA GLY 15 -6.895 2.360 9.229
118 H GLU 16 H GLU 16 -5.349 -0.427 9.647
119 HA GLU 16 HA GLU 16 -2.790 0.878 10.135
120 1HB GLU 16 1HB GLU 16 -2.054 -1.489 10.928
121 2HB GLU 16 2HB GLU 16 -3.763 -1.823 10.948
122 1HG GLU 16 1HG GLU 16 -4.192 -0.189 12.587
123 2HG GLU 16 2HG GLU 16 -2.548 0.440 12.484
124 H MET 17 H MET 17 -0.950 -0.115 9.056
125 HA MET 17 HA MET 17 -1.564 -1.687 6.708
126 1HB MET 17 1HB MET 17 -1.980 0.607 5.995
127 2HB MET 17 2HB MET 17 -0.602 -0.113 5.181
128 1HG MET 17 1HG MET 17 0.913 1.113 6.686
129 2HG MET 17 2HG MET 17 -0.478 1.880 7.442
130 1HE MET 17 1HE MET 17 2.059 3.388 6.133
131 2HE MET 17 2HE MET 17 0.742 4.225 6.956
132 3HE MET 17 3HE MET 17 1.245 4.739 5.348
133 H GLU 18 H GLU 18 0.274 -2.756 5.909
134 HA GLU 18 HA GLU 18 2.756 -1.692 6.578
135 1HB GLU 18 1HB GLU 18 2.557 -2.882 8.656
136 2HB GLU 18 2HB GLU 18 3.816 -3.627 7.697
137 1HG GLU 18 1HG GLU 18 2.269 -5.398 7.050
138 2HG GLU 18 2HG GLU 18 1.056 -4.686 8.116
139 H THR 19 H THR 19 4.551 -2.571 5.454
140 HA THR 19 HA THR 19 3.892 -3.600 2.891
141 HB THR 19 HB THR 19 6.598 -3.314 4.216
142 HG1 THR 19 1HG THR 19 6.429 -1.317 3.804
143 1HG2 THR 19 1HG2 THR 19 7.475 -3.246 1.907
144 2HG2 THR 19 2HG2 THR 19 5.851 -3.558 1.288
145 3HG2 THR 19 3HG2 THR 19 6.676 -4.780 2.253
146 H PHE 20 H PHE 20 3.881 -5.584 2.175
147 HA PHE 20 HA PHE 20 5.243 -7.718 3.656
148 1HB PHE 20 1HB PHE 20 3.482 -9.273 2.878
149 2HB PHE 20 2HB PHE 20 2.554 -7.930 2.263
150 HD1 PHE 20 1HD PHE 20 1.317 -6.453 3.797
151 HD2 PHE 20 2HD PHE 20 3.566 -9.763 5.232
152 HE1 PHE 20 1HE PHE 20 0.123 -6.332 5.918
153 HE2 PHE 20 2HE PHE 20 2.371 -9.630 7.373
154 HZ PHE 20 HZ PHE 20 0.647 -7.924 7.719
155 H GLU 21 H GLU 21 6.028 -9.355 2.234
156 HA GLU 21 HA GLU 21 6.265 -8.437 -0.533
157 1HB GLU 21 1HB GLU 21 7.956 -10.466 0.965
158 2HB GLU 21 2HB GLU 21 8.393 -8.784 0.704
159 1HG GLU 21 1HG GLU 21 8.479 -9.135 -1.693
160 2HG GLU 21 2HG GLU 21 7.962 -10.804 -1.480
161 H THR 22 H THR 22 5.665 -9.785 -2.170
162 HA THR 22 HA THR 22 3.789 -11.871 -1.495
163 HB THR 22 HB THR 22 3.400 -11.976 -3.934
164 HG1 THR 22 1HG THR 22 4.600 -10.556 -5.273
165 1HG2 THR 22 1HG2 THR 22 3.666 -9.124 -2.982
166 2HG2 THR 22 2HG2 THR 22 2.274 -10.170 -2.669
167 3HG2 THR 22 3HG2 THR 22 2.659 -9.672 -4.321
168 H SER 23 H SER 23 4.041 -13.907 -3.103
169 HA SER 23 HA SER 23 6.487 -15.149 -2.355
170 1HB SER 23 1HB SER 23 5.546 -17.108 -3.496
171 2HB SER 23 2HB SER 23 4.267 -16.065 -4.132
172 HG SER 23 HG SER 23 3.234 -16.299 -2.298
173 H ASP 24 H ASP 24 5.429 -13.323 -5.011
174 HA ASP 24 HA ASP 24 7.366 -14.394 -6.896
175 1HB ASP 24 1HB ASP 24 5.568 -11.979 -7.118
176 2HB ASP 24 2HB ASP 24 5.155 -13.594 -7.681
177 H GLY 25 H GLY 25 7.383 -12.168 -4.383
178 1HA GLY 25 1HA GLY 25 9.988 -11.152 -5.261
179 2HA GLY 25 2HA GLY 25 9.371 -11.121 -3.614
180 H THR 26 H THR 26 6.754 -10.089 -4.770
181 HA THR 26 HA THR 26 7.520 -7.396 -5.563
182 HB THR 26 HB THR 26 4.757 -8.602 -5.264
183 HG1 THR 26 1HG THR 26 5.048 -8.767 -7.684
184 1HG2 THR 26 1HG2 THR 26 5.803 -6.296 -6.911
185 2HG2 THR 26 2HG2 THR 26 4.856 -6.156 -5.431
186 3HG2 THR 26 3HG2 THR 26 4.133 -6.862 -6.879
187 H GLU 27 H GLU 27 7.720 -5.876 -3.909
188 HA GLU 27 HA GLU 27 6.463 -6.545 -1.387
189 1HB GLU 27 1HB GLU 27 7.752 -4.630 -0.501
190 2HB GLU 27 2HB GLU 27 8.368 -4.327 -2.123
191 1HG GLU 27 1HG GLU 27 9.324 -6.615 -2.118
192 2HG GLU 27 2HG GLU 27 8.778 -6.793 -0.456
193 H VAL 28 H VAL 28 4.687 -5.752 -0.722
194 HA VAL 28 HA VAL 28 3.451 -3.518 -2.182
195 HB VAL 28 HB VAL 28 2.123 -6.042 -1.193
196 1HG1 VAL 28 1HG1 VAL 28 0.588 -4.204 -1.193
197 2HG1 VAL 28 2HG1 VAL 28 0.188 -5.334 -2.487
198 3HG1 VAL 28 3HG1 VAL 28 1.004 -3.821 -2.866
199 1HG2 VAL 28 1HG2 VAL 28 1.843 -6.690 -3.552
200 2HG2 VAL 28 2HG2 VAL 28 3.541 -6.594 -3.077
201 3HG2 VAL 28 3HG2 VAL 28 2.818 -5.300 -4.029
202 H LEU 29 H LEU 29 2.293 -2.156 -0.892
203 HA LEU 29 HA LEU 29 2.560 -2.434 2.031
204 1HB LEU 29 1HB LEU 29 1.254 -0.136 0.621
205 2HB LEU 29 2HB LEU 29 2.983 -0.260 0.483
206 HG LEU 29 HG LEU 29 3.256 -0.008 2.861
207 1HD1 LEU 29 1HD1 LEU 29 2.424 2.256 3.162
208 2HD1 LEU 29 2HD1 LEU 29 1.395 2.056 1.745
209 3HD1 LEU 29 3HD1 LEU 29 3.149 2.001 1.575
210 1HD2 LEU 29 1HD2 LEU 29 0.258 0.118 3.022
211 2HD2 LEU 29 2HD2 LEU 29 1.371 0.454 4.349
212 3HD2 LEU 29 3HD2 LEU 29 1.278 -1.170 3.660
213 H ILE 30 H ILE 30 0.900 -3.550 2.929
214 HA ILE 30 HA ILE 30 -1.687 -3.498 1.604
215 HB ILE 30 HB ILE 30 -0.561 -5.329 3.755
216 1HG1 ILE 30 1HG1 ILE 30 -1.738 -5.828 1.052
217 2HG1 ILE 30 2HG1 ILE 30 -1.245 -7.134 2.127
218 1HG2 ILE 30 1HG2 ILE 30 -2.830 -4.812 4.454
219 2HG2 ILE 30 2HG2 ILE 30 -2.724 -6.478 3.890
220 3HG2 ILE 30 3HG2 ILE 30 -3.441 -5.242 2.854
221 1HD1 ILE 30 1HD1 ILE 30 1.096 -6.392 1.939
222 2HD1 ILE 30 2HD1 ILE 30 0.576 -5.105 0.869
223 3HD1 ILE 30 3HD1 ILE 30 0.387 -6.784 0.375
224 H VAL 31 H VAL 31 -3.028 -2.019 2.176
225 HA VAL 31 HA VAL 31 -2.917 -0.933 4.917
226 HB VAL 31 HB VAL 31 -4.179 0.304 2.467
227 1HG1 VAL 31 1HG1 VAL 31 -3.607 1.480 5.182
228 2HG1 VAL 31 2HG1 VAL 31 -5.185 1.073 4.513
229 3HG1 VAL 31 3HG1 VAL 31 -4.231 2.364 3.791
230 1HG2 VAL 31 1HG2 VAL 31 -2.323 1.857 2.413
231 2HG2 VAL 31 2HG2 VAL 31 -1.762 0.200 2.159
232 3HG2 VAL 31 3HG2 VAL 31 -1.533 0.992 3.725
233 H ASN 32 H ASN 32 -4.594 -1.567 6.173
234 HA ASN 32 HA ASN 32 -7.107 -2.274 4.832
235 1HB ASN 32 1HB ASN 32 -6.301 -2.525 7.758
236 2HB ASN 32 2HB ASN 32 -6.159 -3.827 6.589
237 1HD2 ASN 32 1HD2 ASN 32 -7.499 -5.149 7.847
238 2HD2 ASN 32 2HD2 ASN 32 -9.210 -4.912 7.879
239 H SER 33 H SER 33 -8.258 -0.435 4.469
240 HA SER 33 HA SER 33 -7.917 1.795 6.324
241 1HB SER 33 1HB SER 33 -8.819 3.156 4.574
242 2HB SER 33 2HB SER 33 -9.335 1.737 3.661
243 HG SER 33 HG SER 33 -7.260 1.245 3.245
244 H GLU 34 H GLU 34 -9.728 2.829 7.229
245 HA GLU 34 HA GLU 34 -11.788 0.989 7.953
246 1HB GLU 34 1HB GLU 34 -10.952 2.465 9.650
247 2HB GLU 34 2HB GLU 34 -12.653 2.797 9.390
248 1HG GLU 34 1HG GLU 34 -12.106 4.767 8.096
249 2HG GLU 34 2HG GLU 34 -10.387 4.437 8.300
250 H GLU 35 H GLU 35 -11.676 3.784 5.888
251 HA GLU 35 HA GLU 35 -14.462 3.235 5.138
252 1HB GLU 35 1HB GLU 35 -12.844 5.746 4.715
253 2HB GLU 35 2HB GLU 35 -14.078 5.519 5.947
254 1HG GLU 35 1HG GLU 35 -15.768 5.257 4.216
255 2HG GLU 35 2HG GLU 35 -14.530 5.420 2.976
256 H HIS 36 H HIS 36 -11.221 3.727 3.924
257 HA HIS 36 HA HIS 36 -12.053 3.584 1.172
258 1HB HIS 36 1HB HIS 36 -9.260 3.727 2.344
259 2HB HIS 36 2HB HIS 36 -10.239 5.109 1.902
260 HD1 HIS 36 1HD HIS 36 -10.846 5.225 -0.771
261 HD2 HIS 36 2HD HIS 36 -7.599 2.919 0.363
262 HE1 HIS 36 1HE HIS 36 -9.480 4.934 -2.842
263 HE2 HIS 36 2HE HIS 36 -7.348 4.107 -1.907
264 H GLY 37 H GLY 37 -11.608 1.218 3.427
265 1HA GLY 37 1HA GLY 37 -11.655 -0.840 1.455
266 2HA GLY 37 2HA GLY 37 -11.681 -1.051 3.197
267 H VAL 38 H VAL 38 -10.342 -2.892 2.078
268 HA VAL 38 HA VAL 38 -7.627 -2.387 2.840
269 HB VAL 38 HB VAL 38 -8.837 -4.878 1.590
270 1HG1 VAL 38 1HG1 VAL 38 -6.276 -4.510 3.143
271 2HG1 VAL 38 2HG1 VAL 38 -6.409 -4.788 1.407
272 3HG1 VAL 38 3HG1 VAL 38 -6.902 -6.047 2.540
273 1HG2 VAL 38 1HG2 VAL 38 -8.422 -4.224 4.509
274 2HG2 VAL 38 2HG2 VAL 38 -8.962 -5.778 3.873
275 3HG2 VAL 38 3HG2 VAL 38 -9.974 -4.346 3.682
276 H LYS 39 H LYS 39 -6.035 -1.899 1.542
277 HA LYS 39 HA LYS 39 -6.379 -2.245 -1.341
278 1HB LYS 39 1HB LYS 39 -5.127 -0.096 -1.656
279 2HB LYS 39 2HB LYS 39 -5.331 0.207 0.058
280 1HG LYS 39 1HG LYS 39 -6.991 1.429 -1.206
281 2HG LYS 39 2HG LYS 39 -7.779 0.171 -0.248
282 1HD LYS 39 1HD LYS 39 -7.876 -1.274 -2.215
283 2HD LYS 39 2HD LYS 39 -7.067 -0.041 -3.176
284 1HE LYS 39 1HE LYS 39 -8.961 1.488 -2.771
285 2HE LYS 39 2HE LYS 39 -9.762 0.209 -1.861
286 1HZ LYS 39 1HZ LYS 39 -8.960 0.016 -4.713
287 2HZ LYS 39 2HZ LYS 39 -10.539 0.318 -4.173
288 3HZ LYS 39 3HZ LYS 39 -9.811 -1.153 -3.841
289 H ALA 40 H ALA 40 -4.665 -2.830 -2.456
290 HA ALA 40 HA ALA 40 -2.171 -3.253 -0.999
291 1HB ALA 40 1HB ALA 40 -3.331 -5.386 -1.339
292 2HB ALA 40 2HB ALA 40 -1.875 -5.305 -2.328
293 3HB ALA 40 3HB ALA 40 -3.457 -5.046 -3.064
294 H TYR 41 H TYR 41 -0.693 -1.950 -1.853
295 HA TYR 41 HA TYR 41 -0.485 -1.734 -4.740
296 1HB TYR 41 1HB TYR 41 -1.834 0.197 -4.191
297 2HB TYR 41 2HB TYR 41 -0.209 0.717 -4.597
298 HD1 TYR 41 1HD TYR 41 -2.716 0.504 -1.961
299 HD2 TYR 41 2HD TYR 41 1.291 1.622 -2.851
300 HE1 TYR 41 1HE TYR 41 -2.599 1.752 0.149
301 HE2 TYR 41 2HE TYR 41 1.418 2.867 -0.748
302 HH TYR 41 HH TYR 41 -0.853 2.557 1.731
303 H GLN 42 H GLN 42 1.653 -0.976 -5.418
304 HA GLN 42 HA GLN 42 3.795 -2.124 -4.097
305 1HB GLN 42 1HB GLN 42 5.268 -0.617 -5.449
306 2HB GLN 42 2HB GLN 42 3.819 0.207 -6.009
307 1HG GLN 42 1HG GLN 42 4.617 -1.435 -7.614
308 2HG GLN 42 2HG GLN 42 3.011 -1.830 -7.007
309 1HE2 GLN 42 1HE2 GLN 42 6.389 -2.681 -6.980
310 2HE2 GLN 42 2HE2 GLN 42 6.191 -4.223 -6.253
311 H ALA 43 H ALA 43 5.239 -1.647 -2.702
312 HA ALA 43 HA ALA 43 4.821 0.786 -1.147
313 1HB ALA 43 1HB ALA 43 6.146 -1.820 -0.384
314 2HB ALA 43 2HB ALA 43 4.532 -1.332 0.060
315 3HB ALA 43 3HB ALA 43 5.922 -0.457 0.705
316 H MET 44 H MET 44 7.507 -1.388 -1.366
317 HA MET 44 HA MET 44 9.675 -1.271 -1.636
318 1HB MET 44 1HB MET 44 9.026 0.573 -3.918
319 2HB MET 44 2HB MET 44 8.962 -1.184 -3.961
320 1HG MET 44 1HG MET 44 11.419 0.474 -3.430
321 2HG MET 44 2HG MET 44 11.026 -0.328 -4.954
322 1HE MET 44 1HE MET 44 13.406 -1.510 -4.878
323 2HE MET 44 2HE MET 44 13.944 -2.510 -3.532
324 3HE MET 44 3HE MET 44 13.794 -0.756 -3.320
325 H CYS 45 H CYS 45 9.207 2.152 -2.549
326 HA CYS 45 HA CYS 45 10.563 3.907 -2.190
327 1HB CYS 45 1HB CYS 45 11.192 4.381 0.247
328 2HB CYS 45 2HB CYS 45 10.309 2.914 0.644
329 HA PRO 46 HA PRO 46 14.598 1.916 -2.250
330 1HB PRO 46 1HB PRO 46 14.157 1.237 -4.437
331 2HB PRO 46 2HB PRO 46 15.295 2.555 -4.748
332 1HG PRO 46 1HG PRO 46 12.797 2.480 -5.815
333 2HG PRO 46 2HG PRO 46 13.630 3.991 -5.432
334 1HD PRO 46 1HD PRO 46 11.289 2.811 -4.151
335 2HD PRO 46 2HD PRO 46 11.971 4.441 -3.961
336 H HIS 47 H HIS 47 13.611 4.746 -1.502
337 HA HIS 47 HA HIS 47 15.955 6.283 -2.416
338 1HB HIS 47 1HB HIS 47 14.765 8.280 -2.030
339 2HB HIS 47 2HB HIS 47 13.596 7.499 -0.990
340 HD2 HIS 47 2HD HIS 47 14.294 7.095 -4.884
341 HE1 HIS 47 1HE HIS 47 10.149 7.320 -4.056
342 HE2 HIS 47 2HE HIS 47 11.882 7.064 -5.862
343 H GLN 48 H GLN 48 13.856 6.627 0.528
344 HA GLN 48 HA GLN 48 16.311 6.409 2.064
345 1HB GLN 48 1HB GLN 48 14.747 7.340 3.938
346 2HB GLN 48 2HB GLN 48 13.719 7.839 2.609
347 1HG GLN 48 1HG GLN 48 16.567 8.725 3.030
348 2HG GLN 48 2HG GLN 48 15.141 9.661 3.431
349 1HE2 GLN 48 1HE2 GLN 48 17.210 8.596 0.869
350 2HE2 GLN 48 2HE2 GLN 48 16.527 9.620 -0.343
351 H GLU 49 H GLU 49 13.033 5.341 1.706
352 HA GLU 49 HA GLU 49 12.075 3.347 2.105
353 1HB GLU 49 1HB GLU 49 14.854 2.387 2.803
354 2HB GLU 49 2HB GLU 49 14.116 2.327 1.216
355 1HG GLU 49 1HG GLU 49 12.521 0.698 1.933
356 2HG GLU 49 2HG GLU 49 13.078 0.838 3.601
357 H ILE 50 H ILE 50 14.498 2.844 4.604
358 HA ILE 50 HA ILE 50 14.339 2.214 6.750
359 HB ILE 50 HB ILE 50 12.101 4.288 6.906
360 1HG1 ILE 50 1HG1 ILE 50 14.247 5.190 6.045
361 2HG1 ILE 50 2HG1 ILE 50 15.058 4.585 7.484
362 1HG2 ILE 50 1HG2 ILE 50 13.820 3.094 9.097
363 2HG2 ILE 50 2HG2 ILE 50 12.105 2.774 8.843
364 3HG2 ILE 50 3HG2 ILE 50 12.641 4.388 9.310
365 1HD1 ILE 50 1HD1 ILE 50 14.625 6.952 7.674
366 2HD1 ILE 50 2HD1 ILE 50 13.700 6.043 8.873
367 3HD1 ILE 50 3HD1 ILE 50 12.901 6.664 7.430
368 H LEU 51 H LEU 51 11.010 2.975 6.400
369 HA LEU 51 HA LEU 51 9.937 0.469 5.765
370 1HB LEU 51 1HB LEU 51 8.502 0.312 7.856
371 2HB LEU 51 2HB LEU 51 9.541 1.488 8.614
372 HG LEU 51 HG LEU 51 11.419 -0.119 8.534
373 1HD1 LEU 51 1HD1 LEU 51 10.545 -1.595 10.282
374 2HD1 LEU 51 2HD1 LEU 51 8.899 -1.125 9.853
375 3HD1 LEU 51 3HD1 LEU 51 10.014 0.071 10.519
376 1HD2 LEU 51 1HD2 LEU 51 10.683 -1.434 6.605
377 2HD2 LEU 51 2HD2 LEU 51 9.304 -2.029 7.528
378 3HD2 LEU 51 3HD2 LEU 51 10.944 -2.465 8.010
379 H LEU 52 H LEU 52 8.970 1.705 4.210
380 HA LEU 52 HA LEU 52 7.910 4.256 4.813
381 1HB LEU 52 1HB LEU 52 8.695 3.814 2.574
382 2HB LEU 52 2HB LEU 52 7.045 4.361 2.547
383 HG LEU 52 HG LEU 52 7.615 2.668 0.848
384 1HD1 LEU 52 1HD1 LEU 52 7.725 0.309 1.381
385 2HD1 LEU 52 2HD1 LEU 52 7.804 0.716 3.093
386 3HD1 LEU 52 3HD1 LEU 52 9.094 1.232 2.005
387 1HD2 LEU 52 1HD2 LEU 52 5.412 1.870 2.735
388 2HD2 LEU 52 2HD2 LEU 52 5.539 1.408 1.027
389 3HD2 LEU 52 3HD2 LEU 52 5.323 3.091 1.474
390 H SER 53 H SER 53 6.658 1.166 5.115
391 HA SER 53 HA SER 53 3.906 1.725 5.110
392 1HB SER 53 1HB SER 53 4.695 -0.350 4.525
393 2HB SER 53 2HB SER 53 3.970 -0.558 6.094
394 HG SER 53 HG SER 53 5.964 -0.883 6.949
395 H GLU 54 H GLU 54 6.441 2.432 7.239
396 HA GLU 54 HA GLU 54 4.873 2.303 9.705
397 1HB GLU 54 1HB GLU 54 7.764 3.158 9.263
398 2HB GLU 54 2HB GLU 54 7.314 1.479 9.364
399 1HG GLU 54 1HG GLU 54 8.228 1.963 11.439
400 2HG GLU 54 2HG GLU 54 6.503 1.891 11.701
401 H GLY 55 H GLY 55 4.862 4.169 7.172
402 1HA GLY 55 1HA GLY 55 4.655 6.439 6.691
403 2HA GLY 55 2HA GLY 55 5.217 6.797 8.323
404 H SER 56 H SER 56 2.660 7.284 6.432
405 HA SER 56 HA SER 56 0.664 6.448 8.305
406 1HB SER 56 1HB SER 56 1.156 9.390 7.860
407 2HB SER 56 2HB SER 56 1.436 8.443 9.343
408 HG SER 56 HG SER 56 -0.691 8.181 9.642
409 H TYR 57 H TYR 57 -1.380 6.942 7.635
410 HA TYR 57 HA TYR 57 -1.733 7.380 4.718
411 1HB TYR 57 1HB TYR 57 -2.994 5.097 6.256
412 2HB TYR 57 2HB TYR 57 -1.631 4.929 5.158
413 HD1 TYR 57 1HD TYR 57 -1.962 5.684 2.764
414 HD2 TYR 57 2HD TYR 57 -5.185 4.934 5.417
415 HE1 TYR 57 1HE TYR 57 -3.472 5.412 0.837
416 HE2 TYR 57 2HE TYR 57 -6.703 4.661 3.533
417 HH TYR 57 HH TYR 57 -5.455 4.501 0.257
418 H GLU 58 H GLU 58 -3.156 8.698 4.214
419 HA GLU 58 HA GLU 58 -5.339 9.322 6.071
420 1HB GLU 58 1HB GLU 58 -4.151 11.003 3.845
421 2HB GLU 58 2HB GLU 58 -3.515 11.101 5.470
422 1HG GLU 58 1HG GLU 58 -4.910 12.990 5.093
423 2HG GLU 58 2HG GLU 58 -5.699 11.946 6.262
424 H GLY 59 H GLY 59 -7.386 9.696 4.772
425 1HA GLY 59 1HA GLY 59 -8.945 9.088 3.212
426 2HA GLY 59 2HA GLY 59 -8.050 7.584 3.123
427 H GLY 60 H GLY 60 -6.707 10.694 2.129
428 1HA GLY 60 1HA GLY 60 -6.968 11.268 -0.301
429 2HA GLY 60 2HA GLY 60 -6.637 9.569 -0.600
430 H VAL 61 H VAL 61 -4.675 10.408 1.976
431 HA VAL 61 HA VAL 61 -2.535 11.248 0.169
432 HB VAL 61 HB VAL 61 -2.944 12.298 2.998
433 1HG1 VAL 61 1HG1 VAL 61 -0.596 12.078 2.450
434 2HG1 VAL 61 2HG1 VAL 61 -1.067 13.776 2.524
435 3HG1 VAL 61 3HG1 VAL 61 -0.851 12.987 0.961
436 1HG2 VAL 61 1HG2 VAL 61 -3.326 14.471 1.938
437 2HG2 VAL 61 2HG2 VAL 61 -4.543 13.289 1.452
438 3HG2 VAL 61 3HG2 VAL 61 -3.233 13.710 0.349
439 H ILE 62 H ILE 62 -0.871 9.931 0.229
440 HA ILE 62 HA ILE 62 -0.604 8.140 2.543
441 HB ILE 62 HB ILE 62 0.747 7.866 -0.184
442 1HG1 ILE 62 1HG1 ILE 62 -1.706 7.668 -0.340
443 2HG1 ILE 62 2HG1 ILE 62 -1.690 6.459 0.930
444 1HG2 ILE 62 1HG2 ILE 62 0.504 5.917 2.109
445 2HG2 ILE 62 2HG2 ILE 62 1.967 6.777 1.633
446 3HG2 ILE 62 3HG2 ILE 62 1.251 5.587 0.545
447 1HD1 ILE 62 1HD1 ILE 62 -1.941 5.441 -1.245
448 2HD1 ILE 62 2HD1 ILE 62 -0.436 4.948 -0.477
449 3HD1 ILE 62 3HD1 ILE 62 -0.412 6.140 -1.773
450 H THR 63 H THR 63 1.224 8.242 3.816
451 HA THR 63 HA THR 63 3.141 10.336 3.115
452 HB THR 63 HB THR 63 2.072 9.416 5.783
453 HG1 THR 63 1HG THR 63 1.631 11.619 4.114
454 1HG2 THR 63 1HG2 THR 63 4.461 10.033 5.967
455 2HG2 THR 63 2HG2 THR 63 3.424 11.180 6.802
456 3HG2 THR 63 3HG2 THR 63 4.109 11.605 5.244
457 H CYS 64 H CYS 64 5.083 9.417 2.515
458 HA CYS 64 HA CYS 64 5.980 6.871 3.390
459 1HB CYS 64 1HB CYS 64 7.558 9.249 2.292
460 2HB CYS 64 2HB CYS 64 7.035 7.837 1.378
461 H ARG 65 H ARG 65 7.412 6.353 5.035
462 HA ARG 65 HA ARG 65 6.970 7.493 7.513
463 1HB ARG 65 1HB ARG 65 9.500 6.023 6.764
464 2HB ARG 65 2HB ARG 65 7.961 5.206 6.905
465 1HG ARG 65 1HG ARG 65 9.204 4.812 8.895
466 2HG ARG 65 2HG ARG 65 7.840 5.840 9.289
467 1HD ARG 65 1HD ARG 65 9.270 7.793 9.364
468 2HD ARG 65 2HD ARG 65 10.661 6.808 8.912
469 HE ARG 65 HE ARG 65 9.403 5.717 11.170
470 1HH1 ARG 65 1HH1 ARG 65 11.380 8.571 10.299
471 2HH1 ARG 65 2HH1 ARG 65 12.116 8.677 11.818
472 1HH2 ARG 65 1HH2 ARG 65 10.457 5.904 13.257
473 2HH2 ARG 65 2HH2 ARG 65 11.583 7.158 13.539
474 H ALA 66 H ALA 66 9.922 7.860 5.510
475 HA ALA 66 HA ALA 66 10.144 10.525 6.572
476 1HB ALA 66 1HB ALA 66 11.483 9.132 8.099
477 2HB ALA 66 2HB ALA 66 12.458 10.290 7.201
478 3HB ALA 66 3HB ALA 66 12.448 8.595 6.722
479 H HIS 67 H HIS 67 9.648 11.272 4.562
480 HA HIS 67 HA HIS 67 11.903 11.774 2.992
481 1HB HIS 67 1HB HIS 67 9.782 10.217 1.448
482 2HB HIS 67 2HB HIS 67 11.243 9.461 2.075
483 HD2 HIS 67 2HD HIS 67 11.772 12.986 0.646
484 HE1 HIS 67 1HE HIS 67 13.296 10.292 -2.192
485 HE2 HIS 67 2HE HIS 67 13.495 12.550 -1.185
486 H LEU 68 H LEU 68 8.450 11.560 1.989
487 HA LEU 68 HA LEU 68 8.194 14.397 2.435
488 1HB LEU 68 1HB LEU 68 7.477 13.138 -0.242
489 2HB LEU 68 2HB LEU 68 9.051 13.840 0.021
490 HG LEU 68 HG LEU 68 7.924 16.059 0.435
491 1HD1 LEU 68 1HD1 LEU 68 7.484 14.764 -2.245
492 2HD1 LEU 68 2HD1 LEU 68 8.980 15.509 -1.679
493 3HD1 LEU 68 3HD1 LEU 68 7.544 16.496 -1.928
494 1HD2 LEU 68 1HD2 LEU 68 5.661 16.347 -0.424
495 2HD2 LEU 68 2HD2 LEU 68 5.686 15.249 0.952
496 3HD2 LEU 68 3HD2 LEU 68 5.530 14.607 -0.687
497 H TRP 69 H TRP 69 5.946 14.918 2.765
498 HA TRP 69 HA TRP 69 4.689 12.543 3.748
499 1HB TRP 69 1HB TRP 69 5.010 14.232 5.391
500 2HB TRP 69 2HB TRP 69 3.282 14.011 5.149
501 HD1 TRP 69 HD TRP 69 1.875 16.054 4.364
502 HE1 TRP 69 1HE TRP 69 2.390 18.534 3.997
503 HE3 TRP 69 3HE TRP 69 6.979 15.845 4.554
504 HZ2 TRP 69 2HZ TRP 69 4.670 20.202 3.811
505 HZ3 TRP 69 3HZ TRP 69 8.254 17.935 4.274
506 HH2 TRP 69 HH TRP 69 7.124 20.062 3.910
507 H THR 70 H THR 70 4.021 14.625 1.051
508 HA THR 70 HA THR 70 1.230 13.747 1.156
509 HB THR 70 HB THR 70 0.930 15.389 -0.721
510 HG1 THR 70 1HG THR 70 3.230 15.316 -1.252
511 1HG2 THR 70 1HG2 THR 70 1.075 17.375 0.712
512 2HG2 THR 70 2HG2 THR 70 2.110 16.495 1.838
513 3HG2 THR 70 3HG2 THR 70 0.431 16.006 1.618
514 H PHE 71 H PHE 71 0.670 12.079 -0.025
515 HA PHE 71 HA PHE 71 1.589 11.923 -2.764
516 1HB PHE 71 1HB PHE 71 1.304 9.557 -0.901
517 2HB PHE 71 2HB PHE 71 2.823 10.155 -1.564
518 HD1 PHE 71 1HD PHE 71 -0.035 8.081 -2.117
519 HD2 PHE 71 2HD PHE 71 3.173 10.077 -4.030
520 HE1 PHE 71 1HE PHE 71 -0.364 6.688 -4.099
521 HE2 PHE 71 2HE PHE 71 2.859 8.691 -6.017
522 HZ PHE 71 HZ PHE 71 1.069 6.980 -6.047
523 H ASN 72 H ASN 72 -0.102 11.276 -4.167
524 HA ASN 72 HA ASN 72 -2.731 11.505 -2.884
525 1HB ASN 72 1HB ASN 72 -2.004 11.770 -5.809
526 2HB ASN 72 2HB ASN 72 -2.134 13.108 -4.690
527 1HD2 ASN 72 1HD2 ASN 72 -3.720 14.125 -5.774
528 2HD2 ASN 72 2HD2 ASN 72 -5.336 13.550 -5.925
529 H ASP 73 H ASP 73 -3.476 9.593 -2.282
530 HA ASP 73 HA ASP 73 -2.960 7.054 -3.471
531 1HB ASP 73 1HB ASP 73 -5.229 7.934 -1.647
532 2HB ASP 73 2HB ASP 73 -3.719 7.195 -1.143
533 H GLY 74 H GLY 74 -5.522 9.382 -3.846
534 1HA GLY 74 1HA GLY 74 -7.277 9.583 -5.294
535 2HA GLY 74 2HA GLY 74 -7.372 7.835 -5.270
536 H THR 75 H THR 75 -4.852 9.966 -6.470
537 HA THR 75 HA THR 75 -5.558 9.388 -9.190
538 HB THR 75 HB THR 75 -3.133 10.846 -8.101
539 HG1 THR 75 1HG THR 75 -5.747 11.433 -8.194
540 1HG2 THR 75 1HG2 THR 75 -3.062 11.885 -10.331
541 2HG2 THR 75 2HG2 THR 75 -4.444 10.912 -10.831
542 3HG2 THR 75 3HG2 THR 75 -2.906 10.131 -10.462
543 H GLY 76 H GLY 76 -3.088 8.274 -6.901
544 1HA GLY 76 1HA GLY 76 -2.437 6.116 -8.749
545 2HA GLY 76 2HA GLY 76 -1.999 6.204 -7.044
546 H HIS 77 H HIS 77 -1.602 8.613 -9.500
547 HA HIS 77 HA HIS 77 1.293 8.460 -9.496
548 1HB HIS 77 1HB HIS 77 -0.771 10.115 -10.969
549 2HB HIS 77 2HB HIS 77 0.192 8.806 -11.629
550 HD1 HIS 77 1HD HIS 77 -0.006 12.263 -11.914
551 HD2 HIS 77 2HD HIS 77 3.106 9.632 -11.285
552 HE1 HIS 77 1HE HIS 77 2.014 13.498 -12.643
553 HE2 HIS 77 2HE HIS 77 3.848 12.118 -11.786
554 H GLY 78 H GLY 78 2.483 9.834 -8.291
555 1HA GLY 78 1HA GLY 78 2.799 11.276 -6.469
556 2HA GLY 78 2HA GLY 78 1.079 11.620 -6.516
557 H ILE 79 H ILE 79 1.318 13.777 -6.411
558 HA ILE 79 HA ILE 79 1.961 15.127 -8.876
559 HB ILE 79 HB ILE 79 0.949 16.175 -6.188
560 1HG1 ILE 79 1HG1 ILE 79 -0.494 15.855 -8.842
561 2HG1 ILE 79 2HG1 ILE 79 -1.163 16.716 -7.470
562 1HG2 ILE 79 1HG2 ILE 79 0.558 18.338 -7.249
563 2HG2 ILE 79 2HG2 ILE 79 1.314 17.753 -8.725
564 3HG2 ILE 79 3HG2 ILE 79 2.271 17.907 -7.249
565 1HD1 ILE 79 1HD1 ILE 79 -2.119 14.512 -7.633
566 2HD1 ILE 79 2HD1 ILE 79 -1.173 14.673 -6.154
567 3HD1 ILE 79 3HD1 ILE 79 -0.515 13.790 -7.531
568 H ASN 80 H ASN 80 3.130 14.725 -5.659
569 HA ASN 80 HA ASN 80 5.816 15.279 -6.365
570 1HB ASN 80 1HB ASN 80 4.443 17.011 -4.344
571 2HB ASN 80 2HB ASN 80 4.956 17.611 -5.919
572 1HD2 ASN 80 1HD2 ASN 80 5.666 18.538 -3.292
573 2HD2 ASN 80 2HD2 ASN 80 7.378 18.434 -3.136
574 HA PRO 81 HA PRO 81 7.279 14.253 -6.095
575 1HB PRO 81 1HB PRO 81 9.057 13.195 -5.184
576 2HB PRO 81 2HB PRO 81 8.289 11.666 -5.617
577 1HG PRO 81 1HG PRO 81 8.378 13.035 -3.000
578 2HG PRO 81 2HG PRO 81 8.083 11.329 -3.360
579 1HD PRO 81 1HD PRO 81 6.113 12.954 -2.511
580 2HD PRO 81 2HD PRO 81 5.813 11.647 -3.678
581 H ASP 82 H ASP 82 7.809 12.758 -8.010
582 HA ASP 82 HA ASP 82 5.360 11.435 -8.955
583 1HB ASP 82 1HB ASP 82 6.574 11.386 -11.181
584 2HB ASP 82 2HB ASP 82 7.824 12.359 -10.431
585 H ASP 83 H ASP 83 8.320 10.538 -7.638
586 HA ASP 83 HA ASP 83 8.443 8.053 -9.197
587 1HB ASP 83 1HB ASP 83 10.364 9.093 -7.171
588 2HB ASP 83 2HB ASP 83 10.482 9.512 -8.873
589 H CYS 84 H CYS 84 6.653 8.895 -6.818
590 HA CYS 84 HA CYS 84 7.129 6.563 -5.069
591 1HB CYS 84 1HB CYS 84 5.724 7.641 -3.599
592 2HB CYS 84 2HB CYS 84 5.585 9.063 -4.642
593 HG CYS 84 HG CYS 84 7.946 8.495 -2.362
594 H CYS 85 H CYS 85 5.582 7.186 -7.479
595 HA CYS 85 HA CYS 85 2.785 6.948 -7.062
596 1HB CYS 85 1HB CYS 85 2.471 6.384 -9.337
597 2HB CYS 85 2HB CYS 85 4.139 5.955 -9.539
598 HG CYS 85 HG CYS 85 5.071 8.416 -9.815
599 H LEU 86 H LEU 86 1.393 5.243 -7.576
600 HA LEU 86 HA LEU 86 2.524 2.709 -6.622
601 1HB LEU 86 1HB LEU 86 1.334 3.682 -4.794
602 2HB LEU 86 2HB LEU 86 0.474 2.276 -5.358
603 HG LEU 86 HG LEU 86 -0.394 5.100 -6.011
604 1HD1 LEU 86 1HD1 LEU 86 -1.268 3.439 -7.563
605 2HD1 LEU 86 2HD1 LEU 86 -2.553 4.096 -6.548
606 3HD1 LEU 86 3HD1 LEU 86 -1.895 2.496 -6.211
607 1HD2 LEU 86 1HD2 LEU 86 -0.453 4.734 -3.598
608 2HD2 LEU 86 2HD2 LEU 86 -1.427 3.283 -3.845
609 3HD2 LEU 86 3HD2 LEU 86 -2.071 4.865 -4.282
610 H ALA 87 H ALA 87 1.120 0.836 -6.980
611 HA ALA 87 HA ALA 87 -0.401 1.055 -9.441
612 1HB ALA 87 1HB ALA 87 0.408 -1.235 -10.035
613 2HB ALA 87 2HB ALA 87 1.480 -1.182 -8.638
614 3HB ALA 87 3HB ALA 87 1.719 -0.054 -9.969
615 H GLU 88 H GLU 88 -2.490 0.314 -8.933
616 HA GLU 88 HA GLU 88 -2.902 -0.904 -6.373
617 1HB GLU 88 1HB GLU 88 -4.868 -0.057 -8.509
618 2HB GLU 88 2HB GLU 88 -4.479 0.797 -7.022
619 1HG GLU 88 1HG GLU 88 -5.416 -1.107 -5.745
620 2HG GLU 88 2HG GLU 88 -5.912 -1.838 -7.264
621 H TYR 89 H TYR 89 -3.124 -2.934 -5.909
622 HA TYR 89 HA TYR 89 -3.429 -4.868 -8.062
623 1HB TYR 89 1HB TYR 89 -2.649 -6.505 -6.267
624 2HB TYR 89 2HB TYR 89 -2.340 -5.106 -5.247
625 HD1 TYR 89 1HD TYR 89 -0.678 -3.358 -6.087
626 HD2 TYR 89 2HD TYR 89 -1.051 -7.216 -7.781
627 HE1 TYR 89 1HE TYR 89 1.547 -3.119 -7.084
628 HE2 TYR 89 2HE TYR 89 1.191 -7.001 -8.795
629 HH TYR 89 HH TYR 89 2.712 -5.263 -9.475
630 HA PRO 90 HA PRO 90 -7.543 -5.734 -6.544
631 1HB PRO 90 1HB PRO 90 -8.316 -7.332 -7.986
632 2HB PRO 90 2HB PRO 90 -7.138 -8.516 -7.425
633 1HG PRO 90 1HG PRO 90 -6.894 -6.454 -9.564
634 2HG PRO 90 2HG PRO 90 -6.226 -8.094 -9.508
635 1HD PRO 90 1HD PRO 90 -4.733 -5.919 -9.080
636 2HD PRO 90 2HD PRO 90 -4.415 -7.443 -8.220
637 H VAL 91 H VAL 91 -8.090 -6.189 -4.532
638 HA VAL 91 HA VAL 91 -6.775 -8.390 -3.165
639 HB VAL 91 HB VAL 91 -5.664 -6.339 -2.465
640 1HG1 VAL 91 1HG1 VAL 91 -8.389 -5.329 -1.703
641 2HG1 VAL 91 2HG1 VAL 91 -7.348 -4.715 -2.987
642 3HG1 VAL 91 3HG1 VAL 91 -6.864 -4.544 -1.299
643 1HG2 VAL 91 1HG2 VAL 91 -6.014 -6.442 -0.035
644 2HG2 VAL 91 2HG2 VAL 91 -5.995 -8.062 -0.745
645 3HG2 VAL 91 3HG2 VAL 91 -7.521 -7.313 -0.297
646 H GLU 92 H GLU 92 -8.076 -9.466 -1.712
647 HA GLU 92 HA GLU 92 -10.843 -8.558 -1.637
648 1HB GLU 92 1HB GLU 92 -9.998 -11.425 -2.060
649 2HB GLU 92 2HB GLU 92 -10.627 -10.343 -3.301
650 1HG GLU 92 1HG GLU 92 -12.097 -11.246 -0.845
651 2HG GLU 92 2HG GLU 92 -12.365 -11.839 -2.485
652 H VAL 93 H VAL 93 -11.906 -8.845 0.179
653 HA VAL 93 HA VAL 93 -10.264 -9.686 2.430
654 HB VAL 93 HB VAL 93 -10.715 -7.294 2.473
655 1HG1 VAL 93 1HG1 VAL 93 -13.638 -7.999 2.563
656 2HG1 VAL 93 2HG1 VAL 93 -12.781 -7.174 1.256
657 3HG1 VAL 93 3HG1 VAL 93 -12.962 -6.391 2.823
658 1HG2 VAL 93 1HG2 VAL 93 -10.487 -8.413 4.616
659 2HG2 VAL 93 2HG2 VAL 93 -12.212 -8.766 4.642
660 3HG2 VAL 93 3HG2 VAL 93 -11.651 -7.096 4.748
661 H LYS 94 H LYS 94 -10.881 -11.289 3.609
662 HA LYS 94 HA LYS 94 -13.617 -12.318 3.572
663 1HB LYS 94 1HB LYS 94 -12.514 -14.489 4.170
664 2HB LYS 94 2HB LYS 94 -10.957 -13.731 3.962
665 1HG LYS 94 1HG LYS 94 -12.918 -14.270 1.755
666 2HG LYS 94 2HG LYS 94 -11.458 -15.189 2.101
667 1HD LYS 94 1HD LYS 94 -10.139 -13.101 1.721
668 2HD LYS 94 2HD LYS 94 -11.623 -12.338 1.167
669 1HE LYS 94 1HE LYS 94 -10.228 -14.690 0.046
670 2HE LYS 94 2HE LYS 94 -10.396 -13.107 -0.713
671 1HZ LYS 94 1HZ LYS 94 -12.619 -15.040 -0.221
672 2HZ LYS 94 2HZ LYS 94 -11.994 -14.630 -1.721
673 3HZ LYS 94 3HZ LYS 94 -12.828 -13.483 -0.814
674 H GLY 95 H GLY 95 -14.345 -12.780 5.730
675 1HA GLY 95 1HA GLY 95 -14.231 -12.844 8.062
676 2HA GLY 95 2HA GLY 95 -13.420 -11.305 7.860
677 H ASP 96 H ASP 96 -11.424 -11.165 8.241
678 HA ASP 96 HA ASP 96 -9.442 -11.460 9.204
679 1HB ASP 96 1HB ASP 96 -10.060 -14.396 9.551
680 2HB ASP 96 2HB ASP 96 -10.214 -13.115 10.768
681 H ASP 97 H ASP 97 -10.186 -13.445 6.472
682 HA ASP 97 HA ASP 97 -7.300 -13.653 6.028
683 1HB ASP 97 1HB ASP 97 -7.815 -15.248 4.285
684 2HB ASP 97 2HB ASP 97 -9.534 -15.025 4.525
685 H ILE 98 H ILE 98 -6.293 -12.574 4.530
686 HA ILE 98 HA ILE 98 -7.895 -11.022 2.637
687 HB ILE 98 HB ILE 98 -5.411 -10.240 4.149
688 1HG1 ILE 98 1HG1 ILE 98 -7.658 -10.066 5.226
689 2HG1 ILE 98 2HG1 ILE 98 -8.101 -8.920 3.962
690 1HG2 ILE 98 1HG2 ILE 98 -6.785 -8.716 1.902
691 2HG2 ILE 98 2HG2 ILE 98 -5.189 -9.454 1.808
692 3HG2 ILE 98 3HG2 ILE 98 -5.467 -8.093 2.896
693 1HD1 ILE 98 1HD1 ILE 98 -5.903 -8.454 5.927
694 2HD1 ILE 98 2HD1 ILE 98 -7.516 -7.744 5.987
695 3HD1 ILE 98 3HD1 ILE 98 -6.429 -7.357 4.653
696 H TYR 99 H TYR 99 -7.541 -11.395 0.647
697 HA TYR 99 HA TYR 99 -5.074 -12.780 -0.180
698 1HB TYR 99 1HB TYR 99 -6.452 -13.566 -2.152
699 2HB TYR 99 2HB TYR 99 -7.858 -12.945 -1.323
700 HD1 TYR 99 1HD TYR 99 -5.946 -15.806 -1.908
701 HD2 TYR 99 2HD TYR 99 -8.120 -13.877 1.191
702 HE1 TYR 99 1HE TYR 99 -6.151 -17.947 -0.730
703 HE2 TYR 99 2HE TYR 99 -8.332 -16.017 2.378
704 HH TYR 99 HH TYR 99 -6.507 -18.747 1.521
705 H VAL 100 H VAL 100 -4.078 -12.124 -2.058
706 HA VAL 100 HA VAL 100 -4.987 -9.576 -3.195
707 HB VAL 100 HB VAL 100 -2.121 -10.230 -2.459
708 1HG1 VAL 100 1HG1 VAL 100 -2.227 -8.850 -4.446
709 2HG1 VAL 100 2HG1 VAL 100 -1.606 -7.906 -3.092
710 3HG1 VAL 100 3HG1 VAL 100 -3.275 -7.696 -3.621
711 1HG2 VAL 100 1HG2 VAL 100 -3.400 -9.710 -0.448
712 2HG2 VAL 100 2HG2 VAL 100 -3.960 -8.204 -1.185
713 3HG2 VAL 100 3HG2 VAL 100 -2.255 -8.420 -0.806
714 H SER 101 H SER 101 -4.526 -9.381 -5.317
715 HA SER 101 HA SER 101 -3.586 -11.808 -6.651
716 1HB SER 101 1HB SER 101 -5.190 -9.491 -7.761
717 2HB SER 101 2HB SER 101 -5.900 -10.990 -7.168
718 HG SER 101 HG SER 101 -4.466 -12.025 -8.719
719 H THR 102 H THR 102 -1.524 -11.669 -7.231
720 HA THR 102 HA THR 102 -0.423 -9.039 -7.916
721 HB THR 102 HB THR 102 1.055 -11.604 -7.230
722 HG1 THR 102 1HG THR 102 -0.336 -10.026 -5.705
723 1HG2 THR 102 1HG2 THR 102 1.984 -8.721 -7.342
724 2HG2 THR 102 2HG2 THR 102 2.343 -9.948 -8.554
725 3HG2 THR 102 3HG2 THR 102 2.980 -10.117 -6.915
726 H LYS 103 H LYS 103 -0.970 -12.296 -9.022
727 HA LYS 103 HA LYS 103 0.577 -12.073 -11.393
728 1HB LYS 103 1HB LYS 103 -1.605 -14.038 -10.676
729 2HB LYS 103 2HB LYS 103 0.087 -14.246 -10.279
730 1HG LYS 103 1HG LYS 103 -0.856 -14.030 -13.120
731 2HG LYS 103 2HG LYS 103 -0.840 -15.560 -12.265
732 1HD LYS 103 1HD LYS 103 1.145 -15.413 -13.618
733 2HD LYS 103 2HD LYS 103 1.605 -15.366 -11.929
734 1HE LYS 103 1HE LYS 103 1.984 -13.001 -12.024
735 2HE LYS 103 2HE LYS 103 1.453 -12.922 -13.706
736 1HZ LYS 103 1HZ LYS 103 3.813 -14.374 -12.642
737 2HZ LYS 103 2HZ LYS 103 3.864 -12.957 -13.523
738 3HZ LYS 103 3HZ LYS 103 3.362 -14.380 -14.260
739 H GLY 104 H GLY 104 0.028 -10.652 -12.869
740 1HA GLY 104 1HA GLY 104 -2.814 -10.399 -13.590
741 2HA GLY 104 2HA GLY 104 -1.540 -10.477 -14.800
742 H ILE 105 H ILE 105 -0.368 -8.813 -12.180
743 HA ILE 105 HA ILE 105 -1.167 -6.229 -13.355
744 HB ILE 105 HB ILE 105 -0.391 -6.783 -10.468
745 1HG1 ILE 105 1HG1 ILE 105 -2.728 -6.361 -9.879
746 2HG1 ILE 105 2HG1 ILE 105 -2.612 -7.724 -10.979
747 1HG2 ILE 105 1HG2 ILE 105 -1.415 -4.259 -11.764
748 2HG2 ILE 105 2HG2 ILE 105 0.223 -4.537 -11.167
749 3HG2 ILE 105 3HG2 ILE 105 -1.130 -4.477 -10.036
750 1HD1 ILE 105 1HD1 ILE 105 -3.315 -6.307 -12.835
751 2HD1 ILE 105 2HD1 ILE 105 -3.442 -4.935 -11.728
752 3HD1 ILE 105 3HD1 ILE 105 -4.504 -6.326 -11.531
753 H LEU 106 H LEU 106 0.522 -4.760 -13.858
754 HA LEU 106 HA LEU 106 3.183 -5.768 -13.552
755 1HB LEU 106 1HB LEU 106 3.658 -3.878 -15.115
756 2HB LEU 106 2HB LEU 106 1.952 -3.581 -15.225
757 HG LEU 106 HG LEU 106 3.254 -6.139 -16.166
758 1HD1 LEU 106 1HD1 LEU 106 0.469 -5.092 -16.618
759 2HD1 LEU 106 2HD1 LEU 106 0.915 -6.450 -15.586
760 3HD1 LEU 106 3HD1 LEU 106 1.152 -6.553 -17.329
761 1HD2 LEU 106 1HD2 LEU 106 2.918 -5.269 -18.428
762 2HD2 LEU 106 2HD2 LEU 106 4.031 -4.272 -17.498
763 3HD2 LEU 106 3HD2 LEU 106 2.370 -3.737 -17.750
764 HA PRO 107 HA PRO 107 3.555 -2.835 -10.079
765 1HB PRO 107 1HB PRO 107 5.279 -4.032 -9.175
766 2HB PRO 107 2HB PRO 107 6.333 -2.924 -10.056
767 1HG PRO 107 1HG PRO 107 6.392 -5.568 -10.471
768 2HG PRO 107 2HG PRO 107 6.664 -4.411 -11.787
769 1HD PRO 107 1HD PRO 107 4.224 -6.011 -11.149
770 2HD PRO 107 2HD PRO 107 4.955 -5.623 -12.719
771 H ASN 108 H ASN 108 3.686 -0.755 -10.101
772 HA ASN 108 HA ASN 108 4.536 0.640 -12.521
773 1HB ASN 108 1HB ASN 108 3.000 1.608 -10.083
774 2HB ASN 108 2HB ASN 108 2.280 1.064 -11.589
775 1HD2 ASN 108 1HD2 ASN 108 1.853 3.513 -10.281
776 2HD2 ASN 108 2HD2 ASN 108 2.275 4.753 -11.382
777 H LYS 109 H LYS 109 5.469 2.997 -11.930
778 HA LYS 109 HA LYS 109 8.069 2.517 -11.013
779 1HB LYS 109 1HB LYS 109 8.403 4.946 -11.245
780 2HB LYS 109 2HB LYS 109 6.669 5.092 -11.422
781 1HG LYS 109 1HG LYS 109 6.763 3.763 -13.487
782 2HG LYS 109 2HG LYS 109 8.492 3.516 -13.269
783 1HD LYS 109 1HD LYS 109 8.872 5.930 -13.530
784 2HD LYS 109 2HD LYS 109 7.140 6.162 -13.792
785 1HE LYS 109 1HE LYS 109 7.246 4.676 -15.741
786 2HE LYS 109 2HE LYS 109 8.970 4.452 -15.473
787 1HZ LYS 109 1HZ LYS 109 7.686 7.044 -16.153
788 2HZ LYS 109 2HZ LYS 109 8.513 6.039 -17.205
789 3HZ LYS 109 3HZ LYS 109 9.347 6.782 -15.963
790 H ALA 110 H ALA 110 8.485 2.109 -9.268
791 HA ALA 110 HA ALA 110 8.443 3.598 -6.890
792 1HB ALA 110 1HB ALA 110 6.965 2.143 -5.496
793 2HB ALA 110 2HB ALA 110 6.479 1.277 -6.953
794 3HB ALA 110 3HB ALA 110 6.053 2.977 -6.755
795 H HIS 111 H HIS 111 8.321 0.515 -8.380
796 HA HIS 111 HA HIS 111 10.957 -0.142 -7.265
797 1HB HIS 111 1HB HIS 111 8.723 -2.144 -7.813
798 2HB HIS 111 2HB HIS 111 9.274 -1.662 -6.215
799 HD1 HIS 111 1HD HIS 111 10.249 -3.804 -9.141
800 HD2 HIS 111 2HD HIS 111 11.669 -2.858 -5.361
801 HE1 HIS 111 1HE HIS 111 12.073 -5.457 -8.668
802 HE2 HIS 111 2HE HIS 111 13.100 -4.627 -6.534
803 H SER 112 H SER 112 12.009 0.592 -9.057
804 HA SER 112 HA SER 112 11.922 -1.058 -11.379
805 1HB SER 112 1HB SER 112 11.578 0.862 -12.950
806 2HB SER 112 2HB SER 112 11.260 1.903 -11.558
807 HG SER 112 HG SER 112 9.747 -0.267 -11.411
Start of MODEL 10
1 1H MET 1 1HT MET 1 0.772 -16.550 -8.180
2 2H MET 1 2HT MET 1 1.419 -17.779 -7.237
3 3H MET 1 3HT MET 1 0.839 -16.341 -6.517
4 HA MET 1 HA MET 1 -0.825 -18.279 -7.979
5 1HB MET 1 1HB MET 1 -0.644 -17.656 -5.019
6 2HB MET 1 2HB MET 1 -0.095 -19.145 -5.780
7 1HG MET 1 1HG MET 1 -2.930 -18.166 -5.623
8 2HG MET 1 2HG MET 1 -2.218 -19.475 -4.676
9 1HE MET 1 1HE MET 1 -4.204 -21.052 -5.418
10 2HE MET 1 2HE MET 1 -4.646 -21.345 -7.100
11 3HE MET 1 3HE MET 1 -4.897 -19.751 -6.390
12 H SER 2 H SER 2 -2.827 -17.549 -8.443
13 HA SER 2 HA SER 2 -3.292 -14.764 -8.180
14 1HB SER 2 1HB SER 2 -5.181 -16.949 -9.057
15 2HB SER 2 2HB SER 2 -4.076 -16.090 -10.127
16 HG SER 2 HG SER 2 -6.487 -15.400 -9.435
17 H PHE 3 H PHE 3 -3.801 -13.969 -6.362
18 HA PHE 3 HA PHE 3 -4.752 -13.479 -4.472
19 1HB PHE 3 1HB PHE 3 -6.930 -14.577 -3.760
20 2HB PHE 3 2HB PHE 3 -6.773 -15.615 -5.170
21 HD1 PHE 3 1HD PHE 3 -7.058 -12.058 -4.172
22 HD2 PHE 3 2HD PHE 3 -7.534 -14.949 -7.257
23 HE1 PHE 3 1HE PHE 3 -8.171 -10.372 -5.577
24 HE2 PHE 3 2HE PHE 3 -8.646 -13.274 -8.662
25 HZ PHE 3 HZ PHE 3 -8.971 -10.984 -7.828
26 H GLU 4 H GLU 4 -3.163 -13.832 -3.301
27 HA GLU 4 HA GLU 4 -2.728 -16.463 -2.068
28 1HB GLU 4 1HB GLU 4 -1.009 -13.968 -2.172
29 2HB GLU 4 2HB GLU 4 -0.844 -15.332 -3.265
30 1HG GLU 4 1HG GLU 4 -0.477 -15.512 -0.293
31 2HG GLU 4 2HG GLU 4 0.835 -15.279 -1.447
32 H LYS 5 H LYS 5 -3.013 -16.578 0.164
33 HA LYS 5 HA LYS 5 -4.318 -14.317 1.385
34 1HB LYS 5 1HB LYS 5 -3.612 -16.997 2.589
35 2HB LYS 5 2HB LYS 5 -5.134 -16.609 1.785
36 1HG LYS 5 1HG LYS 5 -5.652 -16.561 4.072
37 2HG LYS 5 2HG LYS 5 -5.531 -14.880 3.585
38 1HD LYS 5 1HD LYS 5 -4.473 -15.116 5.724
39 2HD LYS 5 2HD LYS 5 -3.234 -14.792 4.514
40 1HE LYS 5 1HE LYS 5 -2.475 -16.529 6.044
41 2HE LYS 5 2HE LYS 5 -2.685 -17.197 4.433
42 1HZ LYS 5 1HZ LYS 5 -3.573 -18.646 6.165
43 2HZ LYS 5 2HZ LYS 5 -4.775 -18.170 5.114
44 3HZ LYS 5 3HZ LYS 5 -4.656 -17.454 6.640
45 H ILE 6 H ILE 6 -3.175 -12.850 1.899
46 HA ILE 6 HA ILE 6 -0.418 -13.248 2.661
47 HB ILE 6 HB ILE 6 -0.892 -11.472 1.080
48 1HG1 ILE 6 1HG1 ILE 6 0.151 -10.411 3.710
49 2HG1 ILE 6 2HG1 ILE 6 0.347 -9.596 2.162
50 1HG2 ILE 6 1HG2 ILE 6 -3.088 -10.784 1.709
51 2HG2 ILE 6 2HG2 ILE 6 -2.017 -9.383 1.677
52 3HG2 ILE 6 3HG2 ILE 6 -2.482 -10.100 3.219
53 1HD1 ILE 6 1HD1 ILE 6 1.455 -12.305 2.883
54 2HD1 ILE 6 2HD1 ILE 6 2.367 -10.804 2.750
55 3HD1 ILE 6 3HD1 ILE 6 1.619 -11.511 1.322
56 H CYS 7 H CYS 7 -3.276 -11.791 4.024
57 HA CYS 7 HA CYS 7 -2.315 -12.440 6.688
58 1HB CYS 7 1HB CYS 7 -2.954 -10.200 7.549
59 2HB CYS 7 2HB CYS 7 -3.135 -9.644 5.905
60 HG CYS 7 HG CYS 7 -0.642 -9.324 7.695
61 H SER 8 H SER 8 -4.001 -11.700 8.269
62 HA SER 8 HA SER 8 -6.658 -12.396 7.333
63 1HB SER 8 1HB SER 8 -5.924 -14.018 8.922
64 2HB SER 8 2HB SER 8 -6.994 -12.912 9.770
65 HG SER 8 HG SER 8 -5.236 -13.144 11.075
66 H LEU 9 H LEU 9 -8.327 -11.186 8.227
67 HA LEU 9 HA LEU 9 -7.896 -8.394 8.343
68 1HB LEU 9 1HB LEU 9 -10.208 -9.936 9.458
69 2HB LEU 9 2HB LEU 9 -10.014 -9.584 7.770
70 HG LEU 9 HG LEU 9 -10.408 -7.547 9.989
71 1HD1 LEU 9 1HD1 LEU 9 -10.665 -5.904 8.196
72 2HD1 LEU 9 2HD1 LEU 9 -10.240 -7.137 7.008
73 3HD1 LEU 9 3HD1 LEU 9 -9.053 -6.615 8.204
74 1HD2 LEU 9 1HD2 LEU 9 -12.409 -8.849 9.535
75 2HD2 LEU 9 2HD2 LEU 9 -12.267 -8.475 7.816
76 3HD2 LEU 9 3HD2 LEU 9 -12.597 -7.184 8.975
77 H ASP 10 H ASP 10 -7.702 -10.822 10.668
78 HA ASP 10 HA ASP 10 -7.793 -9.218 13.064
79 1HB ASP 10 1HB ASP 10 -6.727 -11.996 12.552
80 2HB ASP 10 2HB ASP 10 -8.291 -11.568 13.236
81 H ASP 11 H ASP 11 -5.384 -9.865 10.709
82 HA ASP 11 HA ASP 11 -3.222 -9.013 12.488
83 1HB ASP 11 1HB ASP 11 -3.118 -9.993 9.629
84 2HB ASP 11 2HB ASP 11 -2.803 -10.974 11.053
85 H ILE 12 H ILE 12 -5.088 -7.982 9.766
86 HA ILE 12 HA ILE 12 -3.757 -5.395 9.898
87 HB ILE 12 HB ILE 12 -2.981 -6.181 7.961
88 1HG1 ILE 12 1HG1 ILE 12 -5.394 -4.554 7.260
89 2HG1 ILE 12 2HG1 ILE 12 -4.177 -4.952 6.075
90 1HG2 ILE 12 1HG2 ILE 12 -4.245 -8.185 7.647
91 2HG2 ILE 12 2HG2 ILE 12 -4.344 -7.265 6.137
92 3HG2 ILE 12 3HG2 ILE 12 -5.690 -7.253 7.287
93 1HD1 ILE 12 1HD1 ILE 12 -2.479 -3.822 7.366
94 2HD1 ILE 12 2HD1 ILE 12 -3.652 -3.557 8.640
95 3HD1 ILE 12 3HD1 ILE 12 -3.845 -2.722 7.087
96 H TRP 13 H TRP 13 -4.961 -3.991 10.628
97 HA TRP 13 HA TRP 13 -7.891 -4.210 10.481
98 1HB TRP 13 1HB TRP 13 -7.875 -2.730 12.443
99 2HB TRP 13 2HB TRP 13 -6.117 -2.694 12.396
100 HD1 TRP 13 HD TRP 13 -4.966 -5.298 12.621
101 HE1 TRP 13 1HE TRP 13 -5.651 -7.136 14.291
102 HE3 TRP 13 3HE TRP 13 -9.654 -3.641 13.768
103 HZ2 TRP 13 2HZ TRP 13 -7.876 -7.785 15.885
104 HZ3 TRP 13 3HZ TRP 13 -10.995 -4.918 15.365
105 HH2 TRP 13 HH TRP 13 -10.124 -6.956 16.410
106 H VAL 14 H VAL 14 -9.067 -2.144 10.364
107 HA VAL 14 HA VAL 14 -8.243 -0.600 8.205
108 HB VAL 14 HB VAL 14 -10.612 -0.843 8.761
109 1HG1 VAL 14 1HG1 VAL 14 -11.652 0.365 10.612
110 2HG1 VAL 14 2HG1 VAL 14 -10.056 0.846 11.187
111 3HG1 VAL 14 3HG1 VAL 14 -10.511 -0.857 11.174
112 1HG2 VAL 14 1HG2 VAL 14 -9.986 1.088 7.426
113 2HG2 VAL 14 2HG2 VAL 14 -9.722 2.036 8.891
114 3HG2 VAL 14 3HG2 VAL 14 -11.345 1.490 8.475
115 H GLY 15 H GLY 15 -6.948 1.055 7.979
116 1HA GLY 15 1HA GLY 15 -6.426 2.756 10.272
117 2HA GLY 15 2HA GLY 15 -6.068 3.141 8.592
118 H GLU 16 H GLU 16 -5.113 0.037 9.042
119 HA GLU 16 HA GLU 16 -2.466 0.769 10.072
120 1HB GLU 16 1HB GLU 16 -3.568 -1.937 9.511
121 2HB GLU 16 2HB GLU 16 -3.831 -1.263 11.058
122 1HG GLU 16 1HG GLU 16 -1.224 -2.062 9.731
123 2HG GLU 16 2HG GLU 16 -1.940 -2.747 11.190
124 H MET 17 H MET 17 -0.612 0.121 8.894
125 HA MET 17 HA MET 17 -0.977 -1.011 6.266
126 1HB MET 17 1HB MET 17 -1.214 1.434 5.908
127 2HB MET 17 2HB MET 17 0.134 0.690 5.062
128 1HG MET 17 1HG MET 17 0.752 2.842 5.926
129 2HG MET 17 2HG MET 17 1.712 1.563 6.660
130 1HE MET 17 1HE MET 17 2.619 2.834 8.608
131 2HE MET 17 2HE MET 17 1.695 3.980 9.593
132 3HE MET 17 3HE MET 17 1.929 4.271 7.866
133 H GLU 18 H GLU 18 0.721 -2.154 5.669
134 HA GLU 18 HA GLU 18 3.295 -1.490 6.592
135 1HB GLU 18 1HB GLU 18 2.140 -4.128 7.584
136 2HB GLU 18 2HB GLU 18 2.655 -2.719 8.532
137 1HG GLU 18 1HG GLU 18 4.949 -3.055 7.897
138 2HG GLU 18 2HG GLU 18 4.497 -4.454 6.933
139 H THR 19 H THR 19 4.988 -2.733 5.416
140 HA THR 19 HA THR 19 3.845 -3.753 2.972
141 HB THR 19 HB THR 19 5.751 -2.158 2.756
142 HG1 THR 19 1HG THR 19 5.346 -4.230 1.390
143 1HG2 THR 19 1HG2 THR 19 7.059 -2.809 4.733
144 2HG2 THR 19 2HG2 THR 19 8.032 -2.935 3.250
145 3HG2 THR 19 3HG2 THR 19 7.348 -4.385 3.985
146 H PHE 20 H PHE 20 3.827 -5.764 2.391
147 HA PHE 20 HA PHE 20 5.040 -7.727 4.196
148 1HB PHE 20 1HB PHE 20 3.137 -9.207 3.742
149 2HB PHE 20 2HB PHE 20 2.379 -7.964 2.765
150 HD1 PHE 20 1HD PHE 20 3.109 -9.097 6.151
151 HD2 PHE 20 2HD PHE 20 1.360 -6.013 3.812
152 HE1 PHE 20 1HE PHE 20 1.948 -8.236 8.146
153 HE2 PHE 20 2HE PHE 20 0.201 -5.150 5.800
154 HZ PHE 20 HZ PHE 20 0.497 -6.261 7.968
155 H GLU 21 H GLU 21 5.713 -9.632 3.154
156 HA GLU 21 HA GLU 21 6.293 -9.219 0.316
157 1HB GLU 21 1HB GLU 21 7.601 -11.049 2.329
158 2HB GLU 21 2HB GLU 21 8.191 -9.468 1.838
159 1HG GLU 21 1HG GLU 21 8.548 -10.249 -0.416
160 2HG GLU 21 2HG GLU 21 7.898 -11.831 0.009
161 H THR 22 H THR 22 5.561 -10.577 -1.129
162 HA THR 22 HA THR 22 3.505 -12.457 -0.351
163 HB THR 22 HB THR 22 3.099 -12.689 -2.738
164 HG1 THR 22 1HG THR 22 4.481 -11.575 -4.203
165 1HG2 THR 22 1HG2 THR 22 2.626 -10.363 -3.339
166 2HG2 THR 22 2HG2 THR 22 3.748 -9.815 -2.112
167 3HG2 THR 22 3HG2 THR 22 2.244 -10.618 -1.627
168 H SER 23 H SER 23 3.585 -14.619 -1.818
169 HA SER 23 HA SER 23 5.770 -16.141 -0.883
170 1HB SER 23 1HB SER 23 4.698 -17.952 -2.050
171 2HB SER 23 2HB SER 23 3.765 -16.792 -3.001
172 HG SER 23 HG SER 23 2.387 -17.300 -1.427
173 H ASP 24 H ASP 24 5.194 -14.301 -3.728
174 HA ASP 24 HA ASP 24 7.165 -15.600 -5.400
175 1HB ASP 24 1HB ASP 24 5.735 -12.958 -5.664
176 2HB ASP 24 2HB ASP 24 5.255 -14.474 -6.411
177 H GLY 25 H GLY 25 7.264 -13.448 -2.842
178 1HA GLY 25 1HA GLY 25 10.015 -12.720 -3.442
179 2HA GLY 25 2HA GLY 25 9.171 -12.453 -1.915
180 H THR 26 H THR 26 6.853 -11.362 -3.537
181 HA THR 26 HA THR 26 7.948 -8.849 -4.521
182 HB THR 26 HB THR 26 5.038 -9.665 -4.321
183 HG1 THR 26 1HG THR 26 6.982 -10.710 -6.037
184 1HG2 THR 26 1HG2 THR 26 4.778 -8.108 -6.212
185 2HG2 THR 26 2HG2 THR 26 6.510 -7.778 -6.173
186 3HG2 THR 26 3HG2 THR 26 5.492 -7.306 -4.813
187 H GLU 27 H GLU 27 8.275 -7.291 -2.945
188 HA GLU 27 HA GLU 27 6.652 -7.452 -0.550
189 1HB GLU 27 1HB GLU 27 8.161 -5.692 0.328
190 2HB GLU 27 2HB GLU 27 8.976 -5.640 -1.236
191 1HG GLU 27 1HG GLU 27 9.636 -7.970 -0.965
192 2HG GLU 27 2HG GLU 27 8.789 -8.036 0.572
193 H VAL 28 H VAL 28 4.975 -6.281 -0.208
194 HA VAL 28 HA VAL 28 4.389 -4.058 -2.071
195 HB VAL 28 HB VAL 28 2.522 -6.173 -1.089
196 1HG1 VAL 28 1HG1 VAL 28 1.332 -4.154 -1.570
197 2HG1 VAL 28 2HG1 VAL 28 0.975 -5.332 -2.849
198 3HG1 VAL 28 3HG1 VAL 28 2.112 -4.026 -3.144
199 1HG2 VAL 28 1HG2 VAL 28 2.467 -7.077 -3.398
200 2HG2 VAL 28 2HG2 VAL 28 4.051 -7.213 -2.632
201 3HG2 VAL 28 3HG2 VAL 28 3.755 -5.953 -3.828
202 H LEU 29 H LEU 29 3.196 -2.380 -1.126
203 HA LEU 29 HA LEU 29 3.125 -2.269 1.814
204 1HB LEU 29 1HB LEU 29 2.515 -0.207 -0.318
205 2HB LEU 29 2HB LEU 29 4.033 -0.363 0.538
206 HG LEU 29 HG LEU 29 1.395 0.403 1.798
207 1HD1 LEU 29 1HD1 LEU 29 4.164 0.293 2.974
208 2HD1 LEU 29 2HD1 LEU 29 2.808 -0.766 3.374
209 3HD1 LEU 29 3HD1 LEU 29 2.733 0.949 3.765
210 1HD2 LEU 29 1HD2 LEU 29 2.395 2.625 2.023
211 2HD2 LEU 29 2HD2 LEU 29 2.249 2.153 0.333
212 3HD2 LEU 29 3HD2 LEU 29 3.819 2.074 1.139
213 H ILE 30 H ILE 30 1.344 -3.102 2.734
214 HA ILE 30 HA ILE 30 -1.157 -2.919 1.250
215 HB ILE 30 HB ILE 30 -0.447 -4.718 3.590
216 1HG1 ILE 30 1HG1 ILE 30 0.773 -5.305 1.572
217 2HG1 ILE 30 2HG1 ILE 30 -0.701 -5.236 0.636
218 1HG2 ILE 30 1HG2 ILE 30 -2.907 -4.653 1.820
219 2HG2 ILE 30 2HG2 ILE 30 -2.845 -4.161 3.514
220 3HG2 ILE 30 3HG2 ILE 30 -2.576 -5.851 3.074
221 1HD1 ILE 30 1HD1 ILE 30 -1.575 -7.169 1.853
222 2HD1 ILE 30 2HD1 ILE 30 -0.103 -7.233 2.819
223 3HD1 ILE 30 3HD1 ILE 30 -0.035 -7.542 1.081
224 H VAL 31 H VAL 31 -2.518 -1.473 1.828
225 HA VAL 31 HA VAL 31 -2.384 -0.320 4.541
226 HB VAL 31 HB VAL 31 -3.290 1.031 1.992
227 1HG1 VAL 31 1HG1 VAL 31 -4.348 1.934 3.947
228 2HG1 VAL 31 2HG1 VAL 31 -3.198 3.103 3.303
229 3HG1 VAL 31 3HG1 VAL 31 -2.789 2.158 4.735
230 1HG2 VAL 31 1HG2 VAL 31 -0.657 1.399 3.428
231 2HG2 VAL 31 2HG2 VAL 31 -1.219 2.339 2.047
232 3HG2 VAL 31 3HG2 VAL 31 -0.889 0.616 1.867
233 H ASN 32 H ASN 32 -4.255 -0.737 5.648
234 HA ASN 32 HA ASN 32 -6.642 -1.395 4.095
235 1HB ASN 32 1HB ASN 32 -6.216 -1.361 7.102
236 2HB ASN 32 2HB ASN 32 -6.059 -2.785 6.088
237 1HD2 ASN 32 1HD2 ASN 32 -7.638 -3.896 7.255
238 2HD2 ASN 32 2HD2 ASN 32 -9.312 -3.521 7.114
239 H SER 33 H SER 33 -7.651 0.322 3.331
240 HA SER 33 HA SER 33 -7.694 2.773 4.899
241 1HB SER 33 1HB SER 33 -8.397 3.813 2.785
242 2HB SER 33 2HB SER 33 -8.431 2.217 2.034
243 HG SER 33 HG SER 33 -6.163 2.098 2.711
244 H GLU 34 H GLU 34 -9.714 3.865 5.176
245 HA GLU 34 HA GLU 34 -11.806 2.056 5.859
246 1HB GLU 34 1HB GLU 34 -11.631 5.062 5.966
247 2HB GLU 34 2HB GLU 34 -11.259 3.951 7.272
248 1HG GLU 34 1HG GLU 34 -13.602 3.227 7.294
249 2HG GLU 34 2HG GLU 34 -13.957 4.426 6.049
250 H GLU 35 H GLU 35 -11.485 4.723 3.558
251 HA GLU 35 HA GLU 35 -14.089 4.048 2.403
252 1HB GLU 35 1HB GLU 35 -13.879 6.070 1.144
253 2HB GLU 35 2HB GLU 35 -12.203 6.246 1.614
254 1HG GLU 35 1HG GLU 35 -12.893 6.561 3.935
255 2HG GLU 35 2HG GLU 35 -14.582 6.401 3.441
256 H HIS 36 H HIS 36 -10.754 3.616 1.787
257 HA HIS 36 HA HIS 36 -11.287 3.034 -1.044
258 1HB HIS 36 1HB HIS 36 -8.815 2.991 -1.370
259 2HB HIS 36 2HB HIS 36 -8.595 3.343 0.334
260 HD1 HIS 36 1HD HIS 36 -7.212 5.466 -0.782
261 HD2 HIS 36 2HD HIS 36 -11.370 5.534 -1.060
262 HE1 HIS 36 1HE HIS 36 -7.825 7.841 -1.192
263 HE2 HIS 36 2HE HIS 36 -10.347 7.855 -1.416
264 H GLY 37 H GLY 37 -11.238 1.415 1.807
265 1HA GLY 37 1HA GLY 37 -11.192 -1.133 0.547
266 2HA GLY 37 2HA GLY 37 -11.351 -0.806 2.270
267 H VAL 38 H VAL 38 -9.885 -2.930 1.613
268 HA VAL 38 HA VAL 38 -7.243 -2.151 2.443
269 HB VAL 38 HB VAL 38 -8.243 -4.915 1.690
270 1HG1 VAL 38 1HG1 VAL 38 -5.839 -4.067 3.308
271 2HG1 VAL 38 2HG1 VAL 38 -5.807 -4.697 1.667
272 3HG1 VAL 38 3HG1 VAL 38 -6.335 -5.731 2.996
273 1HG2 VAL 38 1HG2 VAL 38 -8.098 -3.617 4.411
274 2HG2 VAL 38 2HG2 VAL 38 -8.509 -5.302 4.101
275 3HG2 VAL 38 3HG2 VAL 38 -9.569 -4.014 3.525
276 H LYS 39 H LYS 39 -5.683 -1.644 1.109
277 HA LYS 39 HA LYS 39 -5.765 -2.709 -1.615
278 1HB LYS 39 1HB LYS 39 -4.825 -0.527 -2.357
279 2HB LYS 39 2HB LYS 39 -5.161 0.112 -0.762
280 1HG LYS 39 1HG LYS 39 -6.860 0.807 -2.311
281 2HG LYS 39 2HG LYS 39 -7.551 -0.275 -1.100
282 1HD LYS 39 1HD LYS 39 -7.535 -2.113 -2.642
283 2HD LYS 39 2HD LYS 39 -6.659 -1.158 -3.838
284 1HE LYS 39 1HE LYS 39 -9.426 -0.562 -2.815
285 2HE LYS 39 2HE LYS 39 -9.050 -1.324 -4.360
286 1HZ LYS 39 1HZ LYS 39 -9.439 1.004 -4.686
287 2HZ LYS 39 2HZ LYS 39 -7.806 0.686 -4.969
288 3HZ LYS 39 3HZ LYS 39 -8.281 1.432 -3.535
289 H ALA 40 H ALA 40 -3.790 -2.981 -2.586
290 HA ALA 40 HA ALA 40 -1.460 -2.758 -0.845
291 1HB ALA 40 1HB ALA 40 -2.157 -4.995 -2.762
292 2HB ALA 40 2HB ALA 40 -2.184 -5.085 -1.010
293 3HB ALA 40 3HB ALA 40 -0.652 -4.865 -1.846
294 H TYR 41 H TYR 41 0.239 -1.734 -1.784
295 HA TYR 41 HA TYR 41 0.063 -1.131 -4.678
296 1HB TYR 41 1HB TYR 41 0.803 1.140 -4.234
297 2HB TYR 41 2HB TYR 41 0.902 0.806 -2.514
298 HD1 TYR 41 1HD TYR 41 -0.838 1.408 -1.144
299 HD2 TYR 41 2HD TYR 41 -1.596 0.801 -5.280
300 HE1 TYR 41 1HE TYR 41 -3.142 2.191 -0.828
301 HE2 TYR 41 2HE TYR 41 -3.904 1.590 -4.977
302 HH TYR 41 HH TYR 41 -4.970 3.168 -2.154
303 H GLN 42 H GLN 42 2.158 -0.536 -5.639
304 HA GLN 42 HA GLN 42 4.374 -2.106 -5.024
305 1HB GLN 42 1HB GLN 42 4.441 0.707 -6.289
306 2HB GLN 42 2HB GLN 42 4.284 -0.706 -7.227
307 1HG GLN 42 1HG GLN 42 6.691 -0.110 -5.596
308 2HG GLN 42 2HG GLN 42 6.473 0.331 -7.280
309 1HE2 GLN 42 1HE2 GLN 42 5.273 -2.817 -6.147
310 2HE2 GLN 42 2HE2 GLN 42 6.495 -3.702 -6.947
311 H ALA 43 H ALA 43 6.088 -1.947 -3.550
312 HA ALA 43 HA ALA 43 5.852 0.267 -1.622
313 1HB ALA 43 1HB ALA 43 6.716 -2.557 -1.088
314 2HB ALA 43 2HB ALA 43 5.129 -1.881 -0.731
315 3HB ALA 43 3HB ALA 43 6.558 -1.266 0.102
316 H MET 44 H MET 44 7.896 -1.214 -3.828
317 HA MET 44 HA MET 44 10.353 -0.782 -2.491
318 1HB MET 44 1HB MET 44 9.796 -0.998 -5.451
319 2HB MET 44 2HB MET 44 10.181 -2.334 -4.376
320 1HG MET 44 1HG MET 44 12.000 -0.039 -5.089
321 2HG MET 44 2HG MET 44 12.117 -1.687 -5.702
322 1HE MET 44 1HE MET 44 13.069 -3.677 -2.444
323 2HE MET 44 2HE MET 44 12.710 -3.803 -4.166
324 3HE MET 44 3HE MET 44 11.435 -3.366 -3.027
325 H CYS 45 H CYS 45 10.914 1.180 -1.792
326 HA CYS 45 HA CYS 45 10.558 3.332 -3.696
327 1HB CYS 45 1HB CYS 45 10.794 3.449 -0.690
328 2HB CYS 45 2HB CYS 45 9.428 3.944 -1.699
329 HA PRO 46 HA PRO 46 15.040 3.331 -3.704
330 1HB PRO 46 1HB PRO 46 14.821 2.220 -5.756
331 2HB PRO 46 2HB PRO 46 15.354 3.810 -6.303
332 1HG PRO 46 1HG PRO 46 13.030 2.626 -7.118
333 2HG PRO 46 2HG PRO 46 13.266 4.377 -7.064
334 1HD PRO 46 1HD PRO 46 11.510 2.743 -5.452
335 2HD PRO 46 2HD PRO 46 11.667 4.513 -5.460
336 H HIS 47 H HIS 47 12.870 5.472 -3.414
337 HA HIS 47 HA HIS 47 14.092 7.888 -4.535
338 1HB HIS 47 1HB HIS 47 11.508 7.548 -2.960
339 2HB HIS 47 2HB HIS 47 11.589 7.336 -4.692
340 HD2 HIS 47 2HD HIS 47 13.454 10.130 -5.100
341 HE1 HIS 47 1HE HIS 47 9.784 11.919 -4.019
342 HE2 HIS 47 2HE HIS 47 11.936 12.197 -5.274
343 H GLN 48 H GLN 48 13.247 6.308 -1.509
344 HA GLN 48 HA GLN 48 15.256 7.279 0.139
345 1HB GLN 48 1HB GLN 48 12.603 8.703 0.234
346 2HB GLN 48 2HB GLN 48 14.191 9.435 0.083
347 1HG GLN 48 1HG GLN 48 14.716 8.866 2.356
348 2HG GLN 48 2HG GLN 48 13.166 8.040 2.531
349 1HE2 GLN 48 1HE2 GLN 48 11.271 9.309 2.350
350 2HE2 GLN 48 2HE2 GLN 48 11.253 10.961 2.810
351 H GLU 49 H GLU 49 15.345 5.349 1.309
352 HA GLU 49 HA GLU 49 12.884 4.451 2.535
353 1HB GLU 49 1HB GLU 49 14.286 2.731 0.522
354 2HB GLU 49 2HB GLU 49 12.735 3.517 0.297
355 1HG GLU 49 1HG GLU 49 11.717 2.147 1.968
356 2HG GLU 49 2HG GLU 49 13.279 1.475 2.433
357 H ILE 50 H ILE 50 13.283 3.655 4.380
358 HA ILE 50 HA ILE 50 15.611 1.917 4.835
359 HB ILE 50 HB ILE 50 13.779 3.354 6.822
360 1HG1 ILE 50 1HG1 ILE 50 15.784 4.569 7.563
361 2HG1 ILE 50 2HG1 ILE 50 15.465 4.842 5.854
362 1HG2 ILE 50 1HG2 ILE 50 16.062 1.492 7.426
363 2HG2 ILE 50 2HG2 ILE 50 14.347 1.148 7.662
364 3HG2 ILE 50 3HG2 ILE 50 15.135 2.405 8.618
365 1HD1 ILE 50 1HD1 ILE 50 17.223 3.277 5.249
366 2HD1 ILE 50 2HD1 ILE 50 17.542 2.969 6.956
367 3HD1 ILE 50 3HD1 ILE 50 17.838 4.570 6.279
368 H LEU 51 H LEU 51 12.352 2.444 6.031
369 HA LEU 51 HA LEU 51 11.214 0.395 4.438
370 1HB LEU 51 1HB LEU 51 9.878 -0.474 6.426
371 2HB LEU 51 2HB LEU 51 11.022 0.332 7.467
372 HG LEU 51 HG LEU 51 12.811 -1.162 6.692
373 1HD1 LEU 51 1HD1 LEU 51 11.439 -1.735 8.650
374 2HD1 LEU 51 2HD1 LEU 51 11.978 -3.173 7.783
375 3HD1 LEU 51 3HD1 LEU 51 10.320 -2.609 7.605
376 1HD2 LEU 51 1HD2 LEU 51 12.232 -3.119 5.329
377 2HD2 LEU 51 2HD2 LEU 51 11.968 -1.623 4.440
378 3HD2 LEU 51 3HD2 LEU 51 10.596 -2.494 5.124
379 H LEU 52 H LEU 52 9.708 1.506 3.511
380 HA LEU 52 HA LEU 52 8.957 4.086 4.431
381 1HB LEU 52 1HB LEU 52 9.043 3.476 2.032
382 2HB LEU 52 2HB LEU 52 7.566 4.268 2.511
383 HG LEU 52 HG LEU 52 6.377 2.096 2.461
384 1HD1 LEU 52 1HD1 LEU 52 6.325 3.537 0.533
385 2HD1 LEU 52 2HD1 LEU 52 6.342 1.846 0.039
386 3HD1 LEU 52 3HD1 LEU 52 7.812 2.813 -0.080
387 1HD2 LEU 52 1HD2 LEU 52 8.246 0.570 2.888
388 2HD2 LEU 52 2HD2 LEU 52 8.969 1.011 1.341
389 3HD2 LEU 52 3HD2 LEU 52 7.428 0.153 1.382
390 H SER 53 H SER 53 7.682 0.970 4.977
391 HA SER 53 HA SER 53 4.963 1.538 5.093
392 1HB SER 53 1HB SER 53 5.790 -0.550 4.561
393 2HB SER 53 2HB SER 53 4.827 -0.786 5.960
394 HG SER 53 HG SER 53 7.143 -0.554 7.072
395 H GLU 54 H GLU 54 7.333 2.116 7.512
396 HA GLU 54 HA GLU 54 5.358 2.255 9.631
397 1HB GLU 54 1HB GLU 54 7.171 3.178 11.053
398 2HB GLU 54 2HB GLU 54 8.232 3.222 9.664
399 1HG GLU 54 1HG GLU 54 7.061 0.684 10.755
400 2HG GLU 54 2HG GLU 54 8.625 1.329 11.238
401 H GLY 55 H GLY 55 6.215 4.239 7.124
402 1HA GLY 55 1HA GLY 55 6.438 6.765 7.556
403 2HA GLY 55 2HA GLY 55 4.911 6.529 8.407
404 H SER 56 H SER 56 3.118 5.819 7.206
405 HA SER 56 HA SER 56 3.286 6.360 4.349
406 1HB SER 56 1HB SER 56 2.032 4.262 3.916
407 2HB SER 56 2HB SER 56 2.383 3.880 5.602
408 HG SER 56 HG SER 56 4.671 4.537 4.591
409 H TYR 57 H TYR 57 1.341 5.824 7.088
410 HA TYR 57 HA TYR 57 -0.902 7.015 5.564
411 1HB TYR 57 1HB TYR 57 -1.079 4.710 7.487
412 2HB TYR 57 2HB TYR 57 -1.145 4.585 5.746
413 HD1 TYR 57 1HD TYR 57 -3.030 5.285 8.741
414 HD2 TYR 57 2HD TYR 57 -3.110 5.384 4.498
415 HE1 TYR 57 1HE TYR 57 -5.477 5.393 8.797
416 HE2 TYR 57 2HE TYR 57 -5.560 5.498 4.537
417 HH TYR 57 HH TYR 57 -7.366 4.943 5.987
418 H GLU 58 H GLU 58 -1.258 8.927 6.405
419 HA GLU 58 HA GLU 58 -1.619 9.154 9.318
420 1HB GLU 58 1HB GLU 58 -1.428 11.660 8.933
421 2HB GLU 58 2HB GLU 58 -0.847 11.284 7.334
422 1HG GLU 58 1HG GLU 58 0.503 10.488 9.891
423 2HG GLU 58 2HG GLU 58 0.965 11.850 8.881
424 H GLY 59 H GLY 59 -3.698 9.042 9.765
425 1HA GLY 59 1HA GLY 59 -5.542 10.923 8.669
426 2HA GLY 59 2HA GLY 59 -5.903 9.671 9.848
427 H GLY 60 H GLY 60 -5.258 10.227 6.531
428 1HA GLY 60 1HA GLY 60 -7.354 9.009 5.295
429 2HA GLY 60 2HA GLY 60 -6.271 7.669 5.650
430 H VAL 61 H VAL 61 -4.035 9.862 5.327
431 HA VAL 61 HA VAL 61 -4.064 9.847 2.398
432 HB VAL 61 HB VAL 61 -2.633 11.821 4.206
433 1HG1 VAL 61 1HG1 VAL 61 -2.238 13.087 2.151
434 2HG1 VAL 61 2HG1 VAL 61 -3.028 11.812 1.222
435 3HG1 VAL 61 3HG1 VAL 61 -1.520 11.475 2.072
436 1HG2 VAL 61 1HG2 VAL 61 -4.292 13.457 3.464
437 2HG2 VAL 61 2HG2 VAL 61 -5.064 12.102 4.301
438 3HG2 VAL 61 3HG2 VAL 61 -5.116 12.199 2.545
439 H ILE 62 H ILE 62 -2.189 9.270 1.300
440 HA ILE 62 HA ILE 62 -0.448 7.500 2.798
441 HB ILE 62 HB ILE 62 -0.798 7.876 -0.187
442 1HG1 ILE 62 1HG1 ILE 62 -1.847 5.651 -0.106
443 2HG1 ILE 62 2HG1 ILE 62 -2.755 6.836 0.828
444 1HG2 ILE 62 1HG2 ILE 62 0.864 5.813 1.263
445 2HG2 ILE 62 2HG2 ILE 62 1.472 7.136 0.270
446 3HG2 ILE 62 3HG2 ILE 62 0.543 5.834 -0.472
447 1HD1 ILE 62 1HD1 ILE 62 -0.899 4.744 1.940
448 2HD1 ILE 62 2HD1 ILE 62 -2.661 4.704 1.955
449 3HD1 ILE 62 3HD1 ILE 62 -1.803 5.928 2.890
450 H THR 63 H THR 63 1.578 7.803 3.159
451 HA THR 63 HA THR 63 3.051 10.030 1.926
452 HB THR 63 HB THR 63 3.251 8.950 4.741
453 HG1 THR 63 1HG THR 63 1.847 10.375 5.313
454 1HG2 THR 63 1HG2 THR 63 4.564 10.995 5.165
455 2HG2 THR 63 2HG2 THR 63 4.378 11.456 3.473
456 3HG2 THR 63 3HG2 THR 63 5.297 10.013 3.895
457 H CYS 64 H CYS 64 5.323 9.433 1.493
458 HA CYS 64 HA CYS 64 5.984 6.707 2.320
459 1HB CYS 64 1HB CYS 64 7.104 8.106 -0.126
460 2HB CYS 64 2HB CYS 64 5.929 6.786 -0.144
461 H ARG 65 H ARG 65 6.757 7.344 4.254
462 HA ARG 65 HA ARG 65 8.326 7.959 5.782
463 1HB ARG 65 1HB ARG 65 10.222 7.816 3.427
464 2HB ARG 65 2HB ARG 65 9.612 6.404 4.259
465 1HG ARG 65 1HG ARG 65 11.290 8.536 5.564
466 2HG ARG 65 2HG ARG 65 11.916 7.034 4.897
467 1HD ARG 65 1HD ARG 65 11.687 6.750 7.280
468 2HD ARG 65 2HD ARG 65 10.474 5.764 6.484
469 HE ARG 65 HE ARG 65 9.412 8.293 7.205
470 1HH1 ARG 65 1HH1 ARG 65 10.248 5.085 8.596
471 2HH1 ARG 65 2HH1 ARG 65 9.160 5.261 9.888
472 1HH2 ARG 65 1HH2 ARG 65 7.929 8.440 9.021
473 2HH2 ARG 65 2HH2 ARG 65 7.832 7.159 10.143
474 H ALA 66 H ALA 66 7.044 9.992 4.088
475 HA ALA 66 HA ALA 66 6.889 12.176 3.699
476 1HB ALA 66 1HB ALA 66 9.063 12.524 5.770
477 2HB ALA 66 2HB ALA 66 7.337 12.404 6.113
478 3HB ALA 66 3HB ALA 66 7.963 13.777 5.201
479 H HIS 67 H HIS 67 7.445 12.555 1.672
480 HA HIS 67 HA HIS 67 10.295 12.919 1.202
481 1HB HIS 67 1HB HIS 67 9.708 11.089 -0.184
482 2HB HIS 67 2HB HIS 67 10.018 12.440 -1.243
483 HD2 HIS 67 2HD HIS 67 6.995 13.699 -1.474
484 HE1 HIS 67 1HE HIS 67 6.054 9.838 -2.929
485 HE2 HIS 67 2HE HIS 67 5.930 12.235 -3.326
486 H LEU 68 H LEU 68 7.533 14.679 1.389
487 HA LEU 68 HA LEU 68 8.667 17.155 1.092
488 1HB LEU 68 1HB LEU 68 7.101 16.445 -1.410
489 2HB LEU 68 2HB LEU 68 8.846 16.363 -1.394
490 HG LEU 68 HG LEU 68 8.106 18.371 -2.528
491 1HD1 LEU 68 1HD1 LEU 68 6.982 20.205 -1.395
492 2HD1 LEU 68 2HD1 LEU 68 6.770 19.187 0.031
493 3HD1 LEU 68 3HD1 LEU 68 5.975 18.760 -1.485
494 1HD2 LEU 68 1HD2 LEU 68 9.404 20.032 -1.298
495 2HD2 LEU 68 2HD2 LEU 68 10.208 18.462 -1.325
496 3HD2 LEU 68 3HD2 LEU 68 9.367 18.999 0.129
497 H TRP 69 H TRP 69 5.812 15.625 -0.296
498 HA TRP 69 HA TRP 69 4.180 16.572 1.876
499 1HB TRP 69 1HB TRP 69 3.577 16.922 -1.062
500 2HB TRP 69 2HB TRP 69 4.093 18.248 -0.034
501 HD1 TRP 69 HD TRP 69 1.133 17.405 -1.660
502 HE1 TRP 69 1HE TRP 69 -1.004 18.040 -0.360
503 HE3 TRP 69 3HE TRP 69 3.142 18.013 3.009
504 HZ2 TRP 69 2HZ TRP 69 -1.740 18.692 2.264
505 HZ3 TRP 69 3HZ TRP 69 1.648 18.635 4.847
506 HH2 TRP 69 HH TRP 69 -0.741 18.968 4.486
507 H THR 70 H THR 70 1.864 15.544 0.339
508 HA THR 70 HA THR 70 2.326 12.768 1.040
509 HB THR 70 HB THR 70 -0.172 12.742 1.206
510 HG1 THR 70 1HG THR 70 -0.045 15.033 -0.044
511 1HG2 THR 70 1HG2 THR 70 1.308 12.965 3.152
512 2HG2 THR 70 2HG2 THR 70 -0.163 13.911 3.362
513 3HG2 THR 70 3HG2 THR 70 1.348 14.712 2.922
514 H PHE 71 H PHE 71 1.001 11.137 -0.084
515 HA PHE 71 HA PHE 71 1.020 11.534 -2.990
516 1HB PHE 71 1HB PHE 71 1.222 8.987 -1.349
517 2HB PHE 71 2HB PHE 71 2.630 9.893 -1.854
518 HD1 PHE 71 1HD PHE 71 3.611 9.578 -3.912
519 HD2 PHE 71 2HD PHE 71 -0.271 8.019 -3.176
520 HE1 PHE 71 1HE PHE 71 3.711 8.338 -6.029
521 HE2 PHE 71 2HE PHE 71 -0.174 6.785 -5.287
522 HZ PHE 71 HZ PHE 71 1.819 6.937 -6.714
523 H ASN 72 H ASN 72 -0.928 10.664 -4.110
524 HA ASN 72 HA ASN 72 -3.204 10.273 -2.280
525 1HB ASN 72 1HB ASN 72 -3.223 11.348 -5.122
526 2HB ASN 72 2HB ASN 72 -3.300 12.344 -3.680
527 1HD2 ASN 72 1HD2 ASN 72 -5.251 13.256 -4.278
528 2HD2 ASN 72 2HD2 ASN 72 -6.735 12.388 -4.200
529 H ASP 73 H ASP 73 -3.667 8.151 -2.145
530 HA ASP 73 HA ASP 73 -2.878 6.298 -4.193
531 1HB ASP 73 1HB ASP 73 -2.887 5.795 -1.723
532 2HB ASP 73 2HB ASP 73 -3.632 4.565 -2.737
533 H GLY 74 H GLY 74 -5.803 7.916 -3.264
534 1HA GLY 74 1HA GLY 74 -7.969 7.841 -4.066
535 2HA GLY 74 2HA GLY 74 -7.649 6.184 -4.560
536 H THR 75 H THR 75 -5.775 8.890 -5.562
537 HA THR 75 HA THR 75 -7.025 8.913 -8.165
538 HB THR 75 HB THR 75 -4.741 10.571 -7.063
539 HG1 THR 75 1HG THR 75 -7.241 10.614 -6.438
540 1HG2 THR 75 1HG2 THR 75 -4.722 10.477 -9.519
541 2HG2 THR 75 2HG2 THR 75 -5.216 12.074 -8.957
542 3HG2 THR 75 3HG2 THR 75 -6.425 10.935 -9.555
543 H GLY 76 H GLY 76 -3.719 8.365 -6.800
544 1HA GLY 76 1HA GLY 76 -3.116 6.878 -9.263
545 2HA GLY 76 2HA GLY 76 -2.754 6.234 -7.670
546 H HIS 77 H HIS 77 -2.382 9.521 -8.862
547 HA HIS 77 HA HIS 77 0.523 9.247 -8.929
548 1HB HIS 77 1HB HIS 77 0.523 11.644 -9.640
549 2HB HIS 77 2HB HIS 77 -1.225 11.648 -9.525
550 HD1 HIS 77 1HD HIS 77 -2.382 11.300 -11.663
551 HD2 HIS 77 2HD HIS 77 1.383 9.563 -11.637
552 HE1 HIS 77 1HE HIS 77 -2.041 10.397 -13.977
553 HE2 HIS 77 2HE HIS 77 0.152 9.191 -13.877
554 H GLY 78 H GLY 78 1.940 10.658 -7.756
555 1HA GLY 78 1HA GLY 78 2.660 11.696 -5.835
556 2HA GLY 78 2HA GLY 78 1.212 11.060 -5.048
557 H ILE 79 H ILE 79 1.099 13.161 -3.914
558 HA ILE 79 HA ILE 79 -0.475 14.998 -5.490
559 HB ILE 79 HB ILE 79 0.222 15.105 -2.537
560 1HG1 ILE 79 1HG1 ILE 79 -1.187 13.177 -3.161
561 2HG1 ILE 79 2HG1 ILE 79 -2.341 14.274 -3.910
562 1HG2 ILE 79 1HG2 ILE 79 -0.264 17.325 -3.442
563 2HG2 ILE 79 2HG2 ILE 79 -1.545 16.781 -2.360
564 3HG2 ILE 79 3HG2 ILE 79 -1.787 16.724 -4.103
565 1HD1 ILE 79 1HD1 ILE 79 -1.637 14.189 -0.987
566 2HD1 ILE 79 2HD1 ILE 79 -3.114 13.566 -1.722
567 3HD1 ILE 79 3HD1 ILE 79 -2.780 15.299 -1.740
568 H ASN 80 H ASN 80 2.476 15.119 -3.479
569 HA ASN 80 HA ASN 80 3.631 16.904 -5.343
570 1HB ASN 80 1HB ASN 80 3.220 17.937 -2.589
571 2HB ASN 80 2HB ASN 80 2.173 18.427 -3.884
572 1HD2 ASN 80 1HD2 ASN 80 3.803 20.116 -2.279
573 2HD2 ASN 80 2HD2 ASN 80 5.016 20.835 -3.271
574 HA PRO 81 HA PRO 81 5.229 16.829 -6.262
575 1HB PRO 81 1HB PRO 81 7.255 16.409 -7.230
576 2HB PRO 81 2HB PRO 81 7.034 14.677 -7.006
577 1HG PRO 81 1HG PRO 81 8.314 16.678 -5.198
578 2HG PRO 81 2HG PRO 81 8.729 14.974 -5.448
579 1HD PRO 81 1HD PRO 81 7.444 15.788 -3.260
580 2HD PRO 81 2HD PRO 81 7.060 14.230 -4.020
581 H ASP 82 H ASP 82 4.972 15.259 -8.305
582 HA ASP 82 HA ASP 82 2.930 13.375 -7.689
583 1HB ASP 82 1HB ASP 82 3.032 12.858 -10.113
584 2HB ASP 82 2HB ASP 82 4.458 13.875 -10.268
585 H ASP 83 H ASP 83 6.267 13.457 -8.719
586 HA ASP 83 HA ASP 83 7.772 11.936 -9.183
587 1HB ASP 83 1HB ASP 83 8.395 12.688 -6.983
588 2HB ASP 83 2HB ASP 83 8.843 11.021 -7.183
589 H CYS 84 H CYS 84 5.500 11.076 -9.934
590 HA CYS 84 HA CYS 84 4.731 9.361 -11.218
591 1HB CYS 84 1HB CYS 84 5.782 7.161 -11.314
592 2HB CYS 84 2HB CYS 84 6.818 7.606 -9.983
593 HG CYS 84 HG CYS 84 8.395 7.661 -12.113
594 H CYS 85 H CYS 85 3.339 7.777 -11.147
595 HA CYS 85 HA CYS 85 1.789 7.512 -8.786
596 1HB CYS 85 1HB CYS 85 0.620 7.645 -10.835
597 2HB CYS 85 2HB CYS 85 0.366 6.038 -10.177
598 HG CYS 85 HG CYS 85 2.762 5.285 -11.901
599 H LEU 86 H LEU 86 0.852 5.392 -8.300
600 HA LEU 86 HA LEU 86 2.983 3.508 -7.575
601 1HB LEU 86 1HB LEU 86 1.824 4.239 -5.667
602 2HB LEU 86 2HB LEU 86 1.219 2.631 -5.985
603 HG LEU 86 HG LEU 86 -0.270 5.173 -6.680
604 1HD1 LEU 86 1HD1 LEU 86 -2.233 3.760 -6.973
605 2HD1 LEU 86 2HD1 LEU 86 -1.236 2.325 -6.722
606 3HD1 LEU 86 3HD1 LEU 86 -0.951 3.364 -8.116
607 1HD2 LEU 86 1HD2 LEU 86 -0.051 4.947 -4.275
608 2HD2 LEU 86 2HD2 LEU 86 -0.665 3.295 -4.364
609 3HD2 LEU 86 3HD2 LEU 86 -1.713 4.647 -4.783
610 H ALA 87 H ALA 87 1.747 1.218 -7.172
611 HA ALA 87 HA ALA 87 0.304 0.480 -9.611
612 1HB ALA 87 1HB ALA 87 2.464 -1.129 -8.224
613 2HB ALA 87 2HB ALA 87 2.622 -0.325 -9.784
614 3HB ALA 87 3HB ALA 87 1.506 -1.676 -9.600
615 H GLU 88 H GLU 88 -1.644 -0.304 -9.027
616 HA GLU 88 HA GLU 88 -2.050 -1.084 -6.241
617 1HB GLU 88 1HB GLU 88 -4.062 -0.508 -8.425
618 2HB GLU 88 2HB GLU 88 -3.563 0.626 -7.178
619 1HG GLU 88 1HG GLU 88 -4.534 -0.792 -5.463
620 2HG GLU 88 2HG GLU 88 -4.966 -1.996 -6.670
621 H TYR 89 H TYR 89 -2.518 -3.051 -5.638
622 HA TYR 89 HA TYR 89 -2.688 -5.187 -7.627
623 1HB TYR 89 1HB TYR 89 -2.245 -6.655 -5.613
624 2HB TYR 89 2HB TYR 89 -2.063 -5.182 -4.674
625 HD1 TYR 89 1HD TYR 89 -0.322 -7.635 -6.411
626 HD2 TYR 89 2HD TYR 89 -0.276 -3.452 -5.660
627 HE1 TYR 89 1HE TYR 89 2.059 -7.565 -6.976
628 HE2 TYR 89 2HE TYR 89 2.112 -3.367 -6.226
629 HH TYR 89 HH TYR 89 3.668 -6.028 -7.706
630 HA PRO 90 HA PRO 90 -7.015 -5.751 -6.432
631 1HB PRO 90 1HB PRO 90 -7.729 -7.231 -8.020
632 2HB PRO 90 2HB PRO 90 -6.838 -8.549 -7.255
633 1HG PRO 90 1HG PRO 90 -5.977 -6.655 -9.379
634 2HG PRO 90 2HG PRO 90 -5.552 -8.362 -9.154
635 1HD PRO 90 1HD PRO 90 -3.832 -6.423 -8.578
636 2HD PRO 90 2HD PRO 90 -3.937 -7.868 -7.545
637 H VAL 91 H VAL 91 -7.588 -6.016 -4.400
638 HA VAL 91 HA VAL 91 -6.505 -8.280 -2.874
639 HB VAL 91 HB VAL 91 -7.261 -5.525 -1.837
640 1HG1 VAL 91 1HG1 VAL 91 -6.276 -6.255 0.281
641 2HG1 VAL 91 2HG1 VAL 91 -6.010 -7.857 -0.403
642 3HG1 VAL 91 3HG1 VAL 91 -7.653 -7.258 -0.179
643 1HG2 VAL 91 1HG2 VAL 91 -4.532 -6.759 -2.185
644 2HG2 VAL 91 2HG2 VAL 91 -4.863 -5.210 -1.410
645 3HG2 VAL 91 3HG2 VAL 91 -5.203 -5.431 -3.127
646 H GLU 92 H GLU 92 -7.964 -9.431 -1.713
647 HA GLU 92 HA GLU 92 -10.771 -8.533 -1.753
648 1HB GLU 92 1HB GLU 92 -11.407 -10.927 -1.765
649 2HB GLU 92 2HB GLU 92 -9.726 -11.323 -1.958
650 1HG GLU 92 1HG GLU 92 -9.628 -10.452 -4.116
651 2HG GLU 92 2HG GLU 92 -11.257 -9.766 -3.972
652 H VAL 93 H VAL 93 -11.786 -8.665 0.139
653 HA VAL 93 HA VAL 93 -10.375 -9.913 2.386
654 HB VAL 93 HB VAL 93 -12.331 -7.604 2.483
655 1HG1 VAL 93 1HG1 VAL 93 -10.598 -8.796 4.651
656 2HG1 VAL 93 2HG1 VAL 93 -12.345 -8.948 4.507
657 3HG1 VAL 93 3HG1 VAL 93 -11.623 -7.371 4.827
658 1HG2 VAL 93 1HG2 VAL 93 -10.286 -6.867 1.432
659 2HG2 VAL 93 2HG2 VAL 93 -9.325 -7.550 2.740
660 3HG2 VAL 93 3HG2 VAL 93 -10.403 -6.188 3.054
661 H LYS 94 H LYS 94 -11.371 -11.745 2.819
662 HA LYS 94 HA LYS 94 -14.223 -11.706 2.686
663 1HB LYS 94 1HB LYS 94 -13.633 -12.935 0.684
664 2HB LYS 94 2HB LYS 94 -14.395 -14.020 1.821
665 1HG LYS 94 1HG LYS 94 -12.608 -15.154 0.738
666 2HG LYS 94 2HG LYS 94 -12.219 -14.934 2.441
667 1HD LYS 94 1HD LYS 94 -10.275 -14.480 1.243
668 2HD LYS 94 2HD LYS 94 -10.872 -12.956 1.827
669 1HE LYS 94 1HE LYS 94 -10.106 -12.672 -0.426
670 2HE LYS 94 2HE LYS 94 -11.845 -12.452 -0.359
671 1HZ LYS 94 1HZ LYS 94 -12.150 -14.659 -1.305
672 2HZ LYS 94 2HZ LYS 94 -10.515 -14.953 -1.273
673 3HZ LYS 94 3HZ LYS 94 -11.122 -13.772 -2.310
674 H GLY 95 H GLY 95 -14.759 -11.654 4.674
675 1HA GLY 95 1HA GLY 95 -14.366 -13.891 6.349
676 2HA GLY 95 2HA GLY 95 -15.100 -12.361 6.813
677 H ASP 96 H ASP 96 -12.611 -14.355 7.249
678 HA ASP 96 HA ASP 96 -11.188 -12.368 8.843
679 1HB ASP 96 1HB ASP 96 -10.039 -14.354 9.790
680 2HB ASP 96 2HB ASP 96 -11.001 -15.369 8.730
681 H ASP 97 H ASP 97 -10.951 -13.698 5.792
682 HA ASP 97 HA ASP 97 -8.014 -13.664 5.869
683 1HB ASP 97 1HB ASP 97 -8.139 -15.051 3.835
684 2HB ASP 97 2HB ASP 97 -9.875 -15.174 4.061
685 H ILE 98 H ILE 98 -6.846 -12.609 4.452
686 HA ILE 98 HA ILE 98 -8.251 -10.953 2.512
687 HB ILE 98 HB ILE 98 -5.881 -10.265 4.241
688 1HG1 ILE 98 1HG1 ILE 98 -8.036 -9.973 5.344
689 2HG1 ILE 98 2HG1 ILE 98 -8.617 -8.983 3.997
690 1HG2 ILE 98 1HG2 ILE 98 -5.468 -9.426 1.971
691 2HG2 ILE 98 2HG2 ILE 98 -5.813 -8.079 3.056
692 3HG2 ILE 98 3HG2 ILE 98 -7.057 -8.662 1.949
693 1HD1 ILE 98 1HD1 ILE 98 -6.415 -8.268 5.808
694 2HD1 ILE 98 2HD1 ILE 98 -8.085 -7.661 5.861
695 3HD1 ILE 98 3HD1 ILE 98 -7.048 -7.299 4.472
696 H TYR 99 H TYR 99 -7.718 -11.336 0.563
697 HA TYR 99 HA TYR 99 -5.241 -12.789 -0.046
698 1HB TYR 99 1HB TYR 99 -6.604 -13.424 -2.171
699 2HB TYR 99 2HB TYR 99 -7.972 -12.935 -1.223
700 HD1 TYR 99 1HD TYR 99 -8.235 -14.142 1.142
701 HD2 TYR 99 2HD TYR 99 -5.870 -15.605 -2.059
702 HE1 TYR 99 1HE TYR 99 -8.324 -16.429 2.102
703 HE2 TYR 99 2HE TYR 99 -5.947 -17.854 -1.130
704 HH TYR 99 HH TYR 99 -6.246 -18.881 1.069
705 H VAL 100 H VAL 100 -4.131 -12.222 -1.861
706 HA VAL 100 HA VAL 100 -4.987 -9.845 -3.334
707 HB VAL 100 HB VAL 100 -3.497 -8.987 -1.705
708 1HG1 VAL 100 1HG1 VAL 100 -2.202 -10.983 -1.130
709 2HG1 VAL 100 2HG1 VAL 100 -1.096 -9.678 -1.553
710 3HG1 VAL 100 3HG1 VAL 100 -1.429 -10.961 -2.716
711 1HG2 VAL 100 1HG2 VAL 100 -3.348 -7.921 -3.856
712 2HG2 VAL 100 2HG2 VAL 100 -2.137 -9.084 -4.392
713 3HG2 VAL 100 3HG2 VAL 100 -1.748 -7.931 -3.114
714 H SER 101 H SER 101 -4.482 -9.792 -5.379
715 HA SER 101 HA SER 101 -3.510 -12.339 -6.493
716 1HB SER 101 1HB SER 101 -5.084 -10.173 -7.908
717 2HB SER 101 2HB SER 101 -5.754 -11.660 -7.241
718 HG SER 101 HG SER 101 -5.285 -12.561 -9.074
719 H THR 102 H THR 102 -1.697 -12.560 -7.626
720 HA THR 102 HA THR 102 -0.342 -10.156 -8.554
721 HB THR 102 HB THR 102 1.745 -11.583 -8.239
722 HG1 THR 102 1HG THR 102 1.428 -13.571 -7.616
723 1HG2 THR 102 1HG2 THR 102 1.158 -9.791 -6.649
724 2HG2 THR 102 2HG2 THR 102 1.877 -11.166 -5.810
725 3HG2 THR 102 3HG2 THR 102 0.132 -10.919 -5.762
726 H LYS 103 H LYS 103 -2.303 -12.193 -9.778
727 HA LYS 103 HA LYS 103 -0.977 -13.920 -11.607
728 1HB LYS 103 1HB LYS 103 -3.755 -12.745 -11.819
729 2HB LYS 103 2HB LYS 103 -3.339 -14.253 -11.037
730 1HG LYS 103 1HG LYS 103 -2.802 -15.296 -13.100
731 2HG LYS 103 2HG LYS 103 -2.819 -13.763 -13.967
732 1HD LYS 103 1HD LYS 103 -4.845 -15.006 -14.474
733 2HD LYS 103 2HD LYS 103 -5.250 -13.570 -13.546
734 1HE LYS 103 1HE LYS 103 -5.347 -14.941 -11.506
735 2HE LYS 103 2HE LYS 103 -5.052 -16.375 -12.483
736 1HZ LYS 103 1HZ LYS 103 -7.404 -16.063 -12.046
737 2HZ LYS 103 2HZ LYS 103 -7.085 -15.936 -13.690
738 3HZ LYS 103 3HZ LYS 103 -7.362 -14.542 -12.779
739 H GLY 104 H GLY 104 -2.771 -11.312 -12.620
740 1HA GLY 104 1HA GLY 104 -2.549 -10.407 -14.881
741 2HA GLY 104 2HA GLY 104 -0.898 -11.023 -14.896
742 H ILE 105 H ILE 105 -0.634 -10.048 -12.133
743 HA ILE 105 HA ILE 105 -0.815 -7.166 -12.520
744 HB ILE 105 HB ILE 105 -0.190 -8.676 -9.983
745 1HG1 ILE 105 1HG1 ILE 105 -2.464 -7.993 -9.321
746 2HG1 ILE 105 2HG1 ILE 105 -2.458 -9.054 -10.723
747 1HG2 ILE 105 1HG2 ILE 105 0.815 -6.439 -9.984
748 2HG2 ILE 105 2HG2 ILE 105 -0.534 -6.514 -8.854
749 3HG2 ILE 105 3HG2 ILE 105 -0.740 -5.732 -10.421
750 1HD1 ILE 105 1HD1 ILE 105 -2.795 -6.059 -10.818
751 2HD1 ILE 105 2HD1 ILE 105 -4.086 -7.247 -10.944
752 3HD1 ILE 105 3HD1 ILE 105 -2.850 -7.160 -12.200
753 H LEU 106 H LEU 106 0.766 -6.049 -13.123
754 HA LEU 106 HA LEU 106 3.492 -7.024 -12.726
755 1HB LEU 106 1HB LEU 106 2.384 -5.015 -14.691
756 2HB LEU 106 2HB LEU 106 2.766 -6.679 -15.071
757 HG LEU 106 HG LEU 106 4.795 -4.644 -14.152
758 1HD1 LEU 106 1HD1 LEU 106 6.436 -6.244 -14.969
759 2HD1 LEU 106 2HD1 LEU 106 5.145 -7.375 -15.359
760 3HD1 LEU 106 3HD1 LEU 106 5.447 -6.931 -13.683
761 1HD2 LEU 106 1HD2 LEU 106 3.882 -3.967 -16.297
762 2HD2 LEU 106 2HD2 LEU 106 4.162 -5.581 -16.946
763 3HD2 LEU 106 3HD2 LEU 106 5.530 -4.561 -16.496
764 HA PRO 107 HA PRO 107 3.673 -3.413 -9.889
765 1HB PRO 107 1HB PRO 107 5.430 -4.018 -8.574
766 2HB PRO 107 2HB PRO 107 6.538 -3.928 -9.932
767 1HG PRO 107 1HG PRO 107 5.060 -6.261 -8.830
768 2HG PRO 107 2HG PRO 107 6.619 -6.194 -9.669
769 1HD PRO 107 1HD PRO 107 4.340 -7.097 -10.842
770 2HD PRO 107 2HD PRO 107 5.675 -6.336 -11.732
771 H ASN 108 H ASN 108 4.007 -1.390 -10.510
772 HA ASN 108 HA ASN 108 5.089 -0.912 -13.103
773 1HB ASN 108 1HB ASN 108 4.563 1.476 -12.490
774 2HB ASN 108 2HB ASN 108 4.006 0.889 -10.941
775 1HD2 ASN 108 1HD2 ASN 108 1.924 1.690 -11.310
776 2HD2 ASN 108 2HD2 ASN 108 0.851 0.898 -12.395
777 H LYS 109 H LYS 109 6.621 1.090 -13.152
778 HA LYS 109 HA LYS 109 9.046 0.380 -11.977
779 1HB LYS 109 1HB LYS 109 8.099 3.073 -12.953
780 2HB LYS 109 2HB LYS 109 8.927 1.836 -13.903
781 1HG LYS 109 1HG LYS 109 10.937 2.127 -12.551
782 2HG LYS 109 2HG LYS 109 10.122 3.359 -11.600
783 1HD LYS 109 1HD LYS 109 11.442 4.567 -13.123
784 2HD LYS 109 2HD LYS 109 9.816 4.653 -13.774
785 1HE LYS 109 1HE LYS 109 11.985 2.792 -14.758
786 2HE LYS 109 2HE LYS 109 11.484 4.278 -15.542
787 1HZ LYS 109 1HZ LYS 109 10.514 2.471 -16.655
788 2HZ LYS 109 2HZ LYS 109 9.250 3.257 -15.877
789 3HZ LYS 109 3HZ LYS 109 9.876 1.810 -15.270
790 H ALA 110 H ALA 110 9.969 0.925 -10.149
791 HA ALA 110 HA ALA 110 8.322 1.779 -7.995
792 1HB ALA 110 1HB ALA 110 11.319 1.365 -8.047
793 2HB ALA 110 2HB ALA 110 10.118 0.136 -7.669
794 3HB ALA 110 3HB ALA 110 10.318 1.525 -6.602
795 H HIS 111 H HIS 111 7.625 3.686 -8.636
796 HA HIS 111 HA HIS 111 7.487 5.897 -9.101
797 1HB HIS 111 1HB HIS 111 9.042 7.480 -7.874
798 2HB HIS 111 2HB HIS 111 9.787 6.050 -7.173
799 HD1 HIS 111 1HD HIS 111 6.792 8.192 -6.941
800 HD2 HIS 111 2HD HIS 111 8.264 4.696 -5.293
801 HE1 HIS 111 1HE HIS 111 5.404 7.775 -4.930
802 HE2 HIS 111 2HE HIS 111 7.069 6.345 -3.844
803 H SER 112 H SER 112 10.923 6.214 -8.834
804 HA SER 112 HA SER 112 11.110 6.574 -11.721
805 1HB SER 112 1HB SER 112 12.534 8.550 -11.370
806 2HB SER 112 2HB SER 112 12.352 8.398 -9.625
807 HG SER 112 HG SER 112 9.986 8.514 -10.224
Start of MODEL 11
1 1H MET 1 1HT MET 1 -9.524 -14.090 -11.096
2 2H MET 1 2HT MET 1 -8.459 -14.982 -12.025
3 3H MET 1 3HT MET 1 -8.912 -13.424 -12.525
4 HA MET 1 HA MET 1 -6.714 -13.428 -11.610
5 1HB MET 1 1HB MET 1 -7.021 -11.764 -9.782
6 2HB MET 1 2HB MET 1 -8.731 -12.135 -9.758
7 1HG MET 1 1HG MET 1 -7.280 -10.954 -12.105
8 2HG MET 1 2HG MET 1 -8.212 -10.038 -10.926
9 1HE MET 1 1HE MET 1 -10.456 -9.848 -14.098
10 2HE MET 1 2HE MET 1 -8.693 -9.829 -14.042
11 3HE MET 1 3HE MET 1 -9.625 -8.931 -12.843
12 H SER 2 H SER 2 -5.386 -14.727 -10.462
13 HA SER 2 HA SER 2 -6.505 -16.408 -8.464
14 1HB SER 2 1HB SER 2 -4.870 -17.346 -9.926
15 2HB SER 2 2HB SER 2 -4.129 -17.225 -8.328
16 HG SER 2 HG SER 2 -2.659 -16.134 -9.257
17 H PHE 3 H PHE 3 -6.976 -15.530 -6.599
18 HA PHE 3 HA PHE 3 -5.299 -13.470 -5.407
19 1HB PHE 3 1HB PHE 3 -7.051 -13.369 -3.675
20 2HB PHE 3 2HB PHE 3 -7.922 -14.675 -4.460
21 HD1 PHE 3 1HD PHE 3 -6.904 -11.181 -4.697
22 HD2 PHE 3 2HD PHE 3 -9.277 -14.272 -6.386
23 HE1 PHE 3 1HE PHE 3 -8.105 -9.518 -6.012
24 HE2 PHE 3 2HE PHE 3 -10.497 -12.611 -7.726
25 HZ PHE 3 HZ PHE 3 -9.916 -10.224 -7.547
26 H GLU 4 H GLU 4 -3.799 -13.912 -3.977
27 HA GLU 4 HA GLU 4 -3.854 -16.540 -2.661
28 1HB GLU 4 1HB GLU 4 -1.459 -14.794 -3.310
29 2HB GLU 4 2HB GLU 4 -1.927 -16.241 -4.190
30 1HG GLU 4 1HG GLU 4 -1.012 -16.113 -1.322
31 2HG GLU 4 2HG GLU 4 -0.094 -16.736 -2.694
32 H LYS 5 H LYS 5 -3.376 -16.597 -0.445
33 HA LYS 5 HA LYS 5 -4.134 -14.094 0.875
34 1HB LYS 5 1HB LYS 5 -3.710 -16.773 2.177
35 2HB LYS 5 2HB LYS 5 -5.249 -16.273 1.480
36 1HG LYS 5 1HG LYS 5 -5.306 -14.358 3.013
37 2HG LYS 5 2HG LYS 5 -3.775 -14.872 3.712
38 1HD LYS 5 1HD LYS 5 -6.251 -16.565 3.710
39 2HD LYS 5 2HD LYS 5 -5.782 -15.497 5.035
40 1HE LYS 5 1HE LYS 5 -3.724 -16.685 5.317
41 2HE LYS 5 2HE LYS 5 -4.093 -17.723 3.958
42 1HZ LYS 5 1HZ LYS 5 -4.629 -18.674 6.242
43 2HZ LYS 5 2HZ LYS 5 -5.879 -18.682 5.141
44 3HZ LYS 5 3HZ LYS 5 -5.875 -17.513 6.344
45 H ILE 6 H ILE 6 -2.873 -12.869 1.880
46 HA ILE 6 HA ILE 6 -0.113 -13.777 2.282
47 HB ILE 6 HB ILE 6 -0.201 -12.104 0.586
48 1HG1 ILE 6 1HG1 ILE 6 0.834 -10.933 3.166
49 2HG1 ILE 6 2HG1 ILE 6 1.229 -10.320 1.566
50 1HG2 ILE 6 1HG2 ILE 6 -1.674 -10.336 2.481
51 2HG2 ILE 6 2HG2 ILE 6 -2.307 -11.119 1.045
52 3HG2 ILE 6 3HG2 ILE 6 -1.072 -9.854 0.885
53 1HD1 ILE 6 1HD1 ILE 6 1.924 -13.057 2.623
54 2HD1 ILE 6 2HD1 ILE 6 3.024 -11.691 2.432
55 3HD1 ILE 6 3HD1 ILE 6 2.304 -12.447 1.011
56 H CYS 7 H CYS 7 -2.646 -11.750 3.541
57 HA CYS 7 HA CYS 7 -1.498 -12.093 6.201
58 1HB CYS 7 1HB CYS 7 -0.578 -9.991 5.558
59 2HB CYS 7 2HB CYS 7 -1.857 -9.692 6.711
60 HG CYS 7 HG CYS 7 -2.077 -7.645 4.943
61 H SER 8 H SER 8 -3.045 -10.619 7.659
62 HA SER 8 HA SER 8 -5.750 -11.616 7.171
63 1HB SER 8 1HB SER 8 -5.876 -12.364 9.393
64 2HB SER 8 2HB SER 8 -4.405 -11.555 9.879
65 HG SER 8 HG SER 8 -4.751 -14.027 8.870
66 H LEU 9 H LEU 9 -7.373 -10.251 8.022
67 HA LEU 9 HA LEU 9 -6.768 -7.461 8.455
68 1HB LEU 9 1HB LEU 9 -9.345 -8.924 9.025
69 2HB LEU 9 2HB LEU 9 -8.916 -8.449 7.405
70 HG LEU 9 HG LEU 9 -8.993 -6.023 8.222
71 1HD1 LEU 9 1HD1 LEU 9 -10.736 -7.009 6.862
72 2HD1 LEU 9 2HD1 LEU 9 -11.426 -5.919 8.064
73 3HD1 LEU 9 3HD1 LEU 9 -11.514 -7.665 8.304
74 1HD2 LEU 9 1HD2 LEU 9 -10.464 -7.295 10.535
75 2HD2 LEU 9 2HD2 LEU 9 -10.363 -5.566 10.192
76 3HD2 LEU 9 3HD2 LEU 9 -8.912 -6.466 10.639
77 H ASP 10 H ASP 10 -7.172 -10.267 10.304
78 HA ASP 10 HA ASP 10 -7.391 -9.184 12.937
79 1HB ASP 10 1HB ASP 10 -6.260 -11.801 11.908
80 2HB ASP 10 2HB ASP 10 -7.890 -11.521 12.505
81 H ASP 11 H ASP 11 -4.869 -9.402 10.666
82 HA ASP 11 HA ASP 11 -2.762 -8.977 12.637
83 1HB ASP 11 1HB ASP 11 -2.579 -9.253 9.631
84 2HB ASP 11 2HB ASP 11 -2.406 -10.583 10.768
85 H ILE 12 H ILE 12 -4.093 -7.443 9.672
86 HA ILE 12 HA ILE 12 -3.114 -4.933 10.793
87 HB ILE 12 HB ILE 12 -3.198 -3.896 8.624
88 1HG1 ILE 12 1HG1 ILE 12 -4.975 -5.330 7.587
89 2HG1 ILE 12 2HG1 ILE 12 -3.808 -6.628 7.435
90 1HG2 ILE 12 1HG2 ILE 12 -1.262 -5.057 7.581
91 2HG2 ILE 12 2HG2 ILE 12 -1.564 -6.430 8.642
92 3HG2 ILE 12 3HG2 ILE 12 -1.097 -4.873 9.330
93 1HD1 ILE 12 1HD1 ILE 12 -4.098 -5.446 5.343
94 2HD1 ILE 12 2HD1 ILE 12 -2.456 -5.274 5.987
95 3HD1 ILE 12 3HD1 ILE 12 -3.598 -3.945 6.139
96 H TRP 13 H TRP 13 -4.450 -3.700 11.581
97 HA TRP 13 HA TRP 13 -7.288 -4.100 11.259
98 1HB TRP 13 1HB TRP 13 -7.376 -2.577 13.223
99 2HB TRP 13 2HB TRP 13 -5.624 -2.459 13.136
100 HD1 TRP 13 HD TRP 13 -4.225 -4.740 13.585
101 HE1 TRP 13 1HE TRP 13 -4.777 -6.770 15.062
102 HE3 TRP 13 3HE TRP 13 -9.232 -4.000 14.110
103 HZ2 TRP 13 2HZ TRP 13 -7.044 -7.914 16.278
104 HZ3 TRP 13 3HZ TRP 13 -10.528 -5.605 15.435
105 HH2 TRP 13 HH TRP 13 -9.461 -7.522 16.497
106 H VAL 14 H VAL 14 -8.625 -2.070 11.261
107 HA VAL 14 HA VAL 14 -8.100 -0.569 8.984
108 HB VAL 14 HB VAL 14 -10.377 -0.847 9.817
109 1HG1 VAL 14 1HG1 VAL 14 -9.611 0.946 12.111
110 2HG1 VAL 14 2HG1 VAL 14 -9.949 -0.775 12.218
111 3HG1 VAL 14 3HG1 VAL 14 -11.234 0.343 11.776
112 1HG2 VAL 14 1HG2 VAL 14 -11.199 1.450 9.573
113 2HG2 VAL 14 2HG2 VAL 14 -9.965 1.055 8.373
114 3HG2 VAL 14 3HG2 VAL 14 -9.552 2.050 9.769
115 H GLY 15 H GLY 15 -6.721 0.981 8.603
116 1HA GLY 15 1HA GLY 15 -5.933 2.816 10.752
117 2HA GLY 15 2HA GLY 15 -5.665 3.068 9.028
118 H GLU 16 H GLU 16 -4.992 -0.090 9.896
119 HA GLU 16 HA GLU 16 -2.171 0.447 10.334
120 1HB GLU 16 1HB GLU 16 -2.381 -2.259 10.726
121 2HB GLU 16 2HB GLU 16 -4.002 -1.754 11.056
122 1HG GLU 16 1HG GLU 16 -1.617 -0.659 12.436
123 2HG GLU 16 2HG GLU 16 -2.619 -1.963 13.060
124 H MET 17 H MET 17 -0.640 -0.349 8.989
125 HA MET 17 HA MET 17 -1.382 -1.978 6.752
126 1HB MET 17 1HB MET 17 -1.881 0.290 6.013
127 2HB MET 17 2HB MET 17 -0.548 -0.416 5.108
128 1HG MET 17 1HG MET 17 1.027 0.854 6.461
129 2HG MET 17 2HG MET 17 -0.322 1.568 7.344
130 1HE MET 17 1HE MET 17 1.069 4.428 5.100
131 2HE MET 17 2HE MET 17 2.016 3.104 5.796
132 3HE MET 17 3HE MET 17 0.772 3.899 6.755
133 H GLU 18 H GLU 18 0.514 -2.739 5.671
134 HA GLU 18 HA GLU 18 3.092 -2.170 6.778
135 1HB GLU 18 1HB GLU 18 1.669 -4.763 7.288
136 2HB GLU 18 2HB GLU 18 2.343 -3.576 8.439
137 1HG GLU 18 1HG GLU 18 4.047 -5.254 6.645
138 2HG GLU 18 2HG GLU 18 3.680 -5.645 8.323
139 H THR 19 H THR 19 4.765 -3.270 5.554
140 HA THR 19 HA THR 19 3.855 -3.795 2.852
141 HB THR 19 HB THR 19 5.756 -2.254 3.045
142 HG1 THR 19 1HG THR 19 7.184 -4.368 2.019
143 1HG2 THR 19 1HG2 THR 19 7.937 -3.012 3.836
144 2HG2 THR 19 2HG2 THR 19 7.226 -4.576 4.233
145 3HG2 THR 19 3HG2 THR 19 6.726 -3.131 5.130
146 H PHE 20 H PHE 20 3.941 -5.692 1.887
147 HA PHE 20 HA PHE 20 5.179 -7.899 3.351
148 1HB PHE 20 1HB PHE 20 2.706 -8.242 3.317
149 2HB PHE 20 2HB PHE 20 3.574 -9.443 2.406
150 HD1 PHE 20 1HD PHE 20 3.342 -9.708 0.057
151 HD2 PHE 20 2HD PHE 20 1.302 -6.593 2.106
152 HE1 PHE 20 1HE PHE 20 1.898 -9.383 -1.895
153 HE2 PHE 20 2HE PHE 20 -0.153 -6.266 0.116
154 HZ PHE 20 HZ PHE 20 0.152 -7.659 -1.854
155 H GLU 21 H GLU 21 6.020 -9.521 2.031
156 HA GLU 21 HA GLU 21 7.135 -8.402 -0.414
157 1HB GLU 21 1HB GLU 21 7.958 -10.729 1.308
158 2HB GLU 21 2HB GLU 21 8.701 -9.133 1.264
159 1HG GLU 21 1HG GLU 21 9.428 -9.511 -1.020
160 2HG GLU 21 2HG GLU 21 8.716 -11.125 -0.970
161 H THR 22 H THR 22 6.670 -9.273 -2.296
162 HA THR 22 HA THR 22 4.692 -11.388 -2.437
163 HB THR 22 HB THR 22 4.800 -11.068 -4.890
164 HG1 THR 22 1HG THR 22 6.240 -9.416 -5.670
165 1HG2 THR 22 1HG2 THR 22 4.145 -8.718 -5.032
166 2HG2 THR 22 2HG2 THR 22 4.897 -8.412 -3.477
167 3HG2 THR 22 3HG2 THR 22 3.458 -9.447 -3.572
168 H SER 23 H SER 23 5.254 -13.286 -4.087
169 HA SER 23 HA SER 23 7.590 -14.547 -3.078
170 1HB SER 23 1HB SER 23 6.896 -16.386 -4.479
171 2HB SER 23 2HB SER 23 5.868 -15.285 -5.399
172 HG SER 23 HG SER 23 5.574 -16.151 -2.709
173 H ASP 24 H ASP 24 6.897 -12.399 -5.557
174 HA ASP 24 HA ASP 24 9.037 -13.092 -7.349
175 1HB ASP 24 1HB ASP 24 7.163 -10.731 -7.257
176 2HB ASP 24 2HB ASP 24 6.896 -12.217 -8.156
177 H GLY 25 H GLY 25 8.723 -11.322 -4.460
178 1HA GLY 25 1HA GLY 25 11.434 -10.248 -4.809
179 2HA GLY 25 2HA GLY 25 10.624 -10.548 -3.280
180 H THR 26 H THR 26 8.218 -9.110 -4.662
181 HA THR 26 HA THR 26 9.264 -6.410 -4.532
182 HB THR 26 HB THR 26 6.603 -7.451 -5.482
183 HG1 THR 26 1HG THR 26 7.748 -6.684 -7.594
184 1HG2 THR 26 1HG2 THR 26 7.815 -4.675 -5.723
185 2HG2 THR 26 2HG2 THR 26 6.467 -5.106 -4.674
186 3HG2 THR 26 3HG2 THR 26 6.281 -5.191 -6.427
187 H GLU 27 H GLU 27 8.736 -4.965 -3.004
188 HA GLU 27 HA GLU 27 7.205 -5.876 -0.742
189 1HB GLU 27 1HB GLU 27 7.833 -3.641 0.203
190 2HB GLU 27 2HB GLU 27 8.724 -3.327 -1.275
191 1HG GLU 27 1HG GLU 27 10.235 -4.031 0.438
192 2HG GLU 27 2HG GLU 27 10.131 -5.262 -0.820
193 H VAL 28 H VAL 28 5.201 -5.366 -0.427
194 HA VAL 28 HA VAL 28 3.968 -3.184 -1.969
195 HB VAL 28 HB VAL 28 2.817 -5.875 -1.345
196 1HG1 VAL 28 1HG1 VAL 28 1.635 -3.619 -2.975
197 2HG1 VAL 28 2HG1 VAL 28 1.058 -4.205 -1.416
198 3HG1 VAL 28 3HG1 VAL 28 0.932 -5.232 -2.846
199 1HG2 VAL 28 1HG2 VAL 28 4.465 -6.102 -3.061
200 2HG2 VAL 28 2HG2 VAL 28 3.717 -4.793 -3.998
201 3HG2 VAL 28 3HG2 VAL 28 2.854 -6.316 -3.752
202 H LEU 29 H LEU 29 2.573 -2.032 -0.835
203 HA LEU 29 HA LEU 29 2.507 -2.321 2.042
204 1HB LEU 29 1HB LEU 29 1.460 -0.218 0.150
205 2HB LEU 29 2HB LEU 29 2.946 -0.159 1.090
206 HG LEU 29 HG LEU 29 0.268 -0.308 2.374
207 1HD1 LEU 29 1HD1 LEU 29 2.095 -0.968 3.775
208 2HD1 LEU 29 2HD1 LEU 29 1.468 0.596 4.296
209 3HD1 LEU 29 3HD1 LEU 29 2.973 0.512 3.379
210 1HD2 LEU 29 1HD2 LEU 29 0.275 1.667 0.983
211 2HD2 LEU 29 2HD2 LEU 29 1.844 2.147 1.623
212 3HD2 LEU 29 3HD2 LEU 29 0.428 2.131 2.679
213 H ILE 30 H ILE 30 0.918 -3.609 2.782
214 HA ILE 30 HA ILE 30 -1.611 -3.568 1.364
215 HB ILE 30 HB ILE 30 -0.663 -5.806 1.892
216 1HG1 ILE 30 1HG1 ILE 30 -3.188 -5.113 3.319
217 2HG1 ILE 30 2HG1 ILE 30 -2.675 -6.783 3.064
218 1HG2 ILE 30 1HG2 ILE 30 -0.893 -5.057 4.777
219 2HG2 ILE 30 2HG2 ILE 30 0.576 -5.405 3.873
220 3HG2 ILE 30 3HG2 ILE 30 -0.599 -6.688 4.174
221 1HD1 ILE 30 1HD1 ILE 30 -2.725 -6.375 0.633
222 2HD1 ILE 30 2HD1 ILE 30 -3.337 -4.746 0.937
223 3HD1 ILE 30 3HD1 ILE 30 -4.292 -6.152 1.400
224 H VAL 31 H VAL 31 -3.015 -2.119 2.022
225 HA VAL 31 HA VAL 31 -2.778 -1.091 4.763
226 HB VAL 31 HB VAL 31 -2.108 0.609 3.052
227 1HG1 VAL 31 1HG1 VAL 31 -3.666 1.560 1.503
228 2HG1 VAL 31 2HG1 VAL 31 -4.858 0.345 1.969
229 3HG1 VAL 31 3HG1 VAL 31 -3.361 -0.151 1.176
230 1HG2 VAL 31 1HG2 VAL 31 -4.735 1.272 4.387
231 2HG2 VAL 31 2HG2 VAL 31 -3.590 2.444 3.745
232 3HG2 VAL 31 3HG2 VAL 31 -3.145 1.452 5.123
233 H ASN 32 H ASN 32 -4.505 -1.315 6.071
234 HA ASN 32 HA ASN 32 -7.041 -2.105 4.831
235 1HB ASN 32 1HB ASN 32 -6.231 -1.883 7.749
236 2HB ASN 32 2HB ASN 32 -6.117 -3.355 6.805
237 1HD2 ASN 32 1HD2 ASN 32 -7.432 -4.392 8.331
238 2HD2 ASN 32 2HD2 ASN 32 -9.142 -4.145 8.332
239 H SER 33 H SER 33 -8.012 -0.291 4.071
240 HA SER 33 HA SER 33 -8.178 2.075 5.771
241 1HB SER 33 1HB SER 33 -8.891 3.202 3.739
242 2HB SER 33 2HB SER 33 -8.912 1.643 2.905
243 HG SER 33 HG SER 33 -6.587 1.704 3.872
244 H GLU 34 H GLU 34 -10.243 2.951 6.249
245 HA GLU 34 HA GLU 34 -12.363 1.028 6.392
246 1HB GLU 34 1HB GLU 34 -12.326 3.971 7.012
247 2HB GLU 34 2HB GLU 34 -12.032 2.681 8.163
248 1HG GLU 34 1HG GLU 34 -14.331 1.895 7.833
249 2HG GLU 34 2HG GLU 34 -14.612 3.252 6.741
250 H GLU 35 H GLU 35 -11.877 4.057 4.655
251 HA GLU 35 HA GLU 35 -14.329 3.854 3.163
252 1HB GLU 35 1HB GLU 35 -11.965 5.724 2.921
253 2HB GLU 35 2HB GLU 35 -13.359 6.026 3.926
254 1HG GLU 35 1HG GLU 35 -13.584 7.422 2.053
255 2HG GLU 35 2HG GLU 35 -14.752 6.129 1.838
256 H HIS 36 H HIS 36 -10.884 3.559 2.480
257 HA HIS 36 HA HIS 36 -11.334 2.945 -0.313
258 1HB HIS 36 1HB HIS 36 -8.904 2.500 -0.424
259 2HB HIS 36 2HB HIS 36 -8.779 2.710 1.308
260 HD1 HIS 36 1HD HIS 36 -8.197 5.021 2.131
261 HD2 HIS 36 2HD HIS 36 -9.685 4.975 -1.759
262 HE1 HIS 36 1HE HIS 36 -7.909 7.314 1.285
263 HE2 HIS 36 2HE HIS 36 -8.325 7.059 -1.156
264 H GLY 37 H GLY 37 -11.181 1.140 2.593
265 1HA GLY 37 1HA GLY 37 -11.493 -1.329 1.140
266 2HA GLY 37 2HA GLY 37 -11.580 -1.109 2.892
267 H VAL 38 H VAL 38 -10.146 -3.224 1.978
268 HA VAL 38 HA VAL 38 -7.497 -2.409 2.742
269 HB VAL 38 HB VAL 38 -8.455 -5.181 1.946
270 1HG1 VAL 38 1HG1 VAL 38 -6.015 -4.826 1.776
271 2HG1 VAL 38 2HG1 VAL 38 -6.439 -5.978 3.034
272 3HG1 VAL 38 3HG1 VAL 38 -5.984 -4.328 3.469
273 1HG2 VAL 38 1HG2 VAL 38 -8.130 -3.963 4.693
274 2HG2 VAL 38 2HG2 VAL 38 -8.562 -5.638 4.357
275 3HG2 VAL 38 3HG2 VAL 38 -9.660 -4.335 3.904
276 H LYS 39 H LYS 39 -6.018 -1.819 1.423
277 HA LYS 39 HA LYS 39 -6.257 -2.401 -1.460
278 1HB LYS 39 1HB LYS 39 -4.972 -0.149 -1.655
279 2HB LYS 39 2HB LYS 39 -5.413 0.048 0.012
280 1HG LYS 39 1HG LYS 39 -6.964 1.268 -1.343
281 2HG LYS 39 2HG LYS 39 -7.783 -0.067 -0.532
282 1HD LYS 39 1HD LYS 39 -7.661 -1.400 -2.575
283 2HD LYS 39 2HD LYS 39 -6.828 -0.083 -3.395
284 1HE LYS 39 1HE LYS 39 -8.793 1.357 -3.021
285 2HE LYS 39 2HE LYS 39 -9.615 0.004 -2.261
286 1HZ LYS 39 1HZ LYS 39 -10.307 0.202 -4.530
287 2HZ LYS 39 2HZ LYS 39 -9.410 -1.215 -4.408
288 3HZ LYS 39 3HZ LYS 39 -8.740 0.155 -5.099
289 H ALA 40 H ALA 40 -4.375 -2.791 -2.594
290 HA ALA 40 HA ALA 40 -1.929 -3.036 -1.012
291 1HB ALA 40 1HB ALA 40 -2.832 -5.267 -1.510
292 2HB ALA 40 2HB ALA 40 -1.317 -4.980 -2.368
293 3HB ALA 40 3HB ALA 40 -2.850 -4.874 -3.230
294 H TYR 41 H TYR 41 -0.614 -1.537 -1.668
295 HA TYR 41 HA TYR 41 -0.386 -0.981 -4.541
296 1HB TYR 41 1HB TYR 41 0.510 1.331 -3.726
297 2HB TYR 41 2HB TYR 41 -0.278 0.946 -2.211
298 HD1 TYR 41 1HD TYR 41 -2.799 0.616 -2.176
299 HD2 TYR 41 2HD TYR 41 -0.691 2.229 -5.497
300 HE1 TYR 41 1HE TYR 41 -4.891 1.604 -3.035
301 HE2 TYR 41 2HE TYR 41 -2.748 3.204 -6.358
302 HH TYR 41 HH TYR 41 -5.083 2.801 -6.207
303 H GLN 42 H GLN 42 1.881 -0.338 -5.120
304 HA GLN 42 HA GLN 42 3.898 -1.856 -3.923
305 1HB GLN 42 1HB GLN 42 4.147 0.693 -5.618
306 2HB GLN 42 2HB GLN 42 4.184 -0.954 -6.152
307 1HG GLN 42 1HG GLN 42 6.262 -1.336 -5.091
308 2HG GLN 42 2HG GLN 42 6.242 0.304 -4.412
309 1HE2 GLN 42 1HE2 GLN 42 6.671 -1.609 -7.302
310 2HE2 GLN 42 2HE2 GLN 42 7.199 -0.265 -8.258
311 H ALA 43 H ALA 43 5.480 -1.413 -2.309
312 HA ALA 43 HA ALA 43 4.280 0.169 -0.244
313 1HB ALA 43 1HB ALA 43 5.108 -2.073 0.169
314 2HB ALA 43 2HB ALA 43 5.793 -0.865 1.258
315 3HB ALA 43 3HB ALA 43 6.752 -1.490 -0.086
316 H MET 44 H MET 44 6.666 0.938 -2.434
317 HA MET 44 HA MET 44 7.379 3.204 -0.746
318 1HB MET 44 1HB MET 44 8.915 1.544 0.064
319 2HB MET 44 2HB MET 44 9.769 2.866 -0.711
320 1HG MET 44 1HG MET 44 10.860 0.806 -1.286
321 2HG MET 44 2HG MET 44 10.091 1.463 -2.723
322 1HE MET 44 1HE MET 44 10.463 -0.876 -3.918
323 2HE MET 44 2HE MET 44 9.873 -2.409 -3.263
324 3HE MET 44 3HE MET 44 11.171 -1.538 -2.441
325 H CYS 45 H CYS 45 8.907 4.692 -1.669
326 HA CYS 45 HA CYS 45 8.390 5.173 -4.477
327 1HB CYS 45 1HB CYS 45 9.361 7.312 -4.021
328 2HB CYS 45 2HB CYS 45 10.119 6.726 -2.556
329 HA PRO 46 HA PRO 46 12.570 3.729 -5.442
330 1HB PRO 46 1HB PRO 46 11.948 4.094 -7.653
331 2HB PRO 46 2HB PRO 46 13.302 5.225 -7.535
332 1HG PRO 46 1HG PRO 46 10.913 6.070 -8.326
333 2HG PRO 46 2HG PRO 46 11.895 7.060 -7.230
334 1HD PRO 46 1HD PRO 46 9.459 5.448 -6.664
335 2HD PRO 46 2HD PRO 46 10.045 6.935 -5.893
336 H HIS 47 H HIS 47 12.429 5.960 -3.282
337 HA HIS 47 HA HIS 47 15.092 7.080 -3.880
338 1HB HIS 47 1HB HIS 47 14.650 9.046 -2.650
339 2HB HIS 47 2HB HIS 47 13.147 8.421 -2.017
340 HD2 HIS 47 2HD HIS 47 14.107 9.072 -5.813
341 HE1 HIS 47 1HE HIS 47 10.458 10.940 -4.734
342 HE2 HIS 47 2HE HIS 47 12.337 10.835 -6.416
343 H GLN 48 H GLN 48 13.025 6.909 -0.894
344 HA GLN 48 HA GLN 48 15.469 6.207 0.534
345 1HB GLN 48 1HB GLN 48 14.106 6.692 2.561
346 2HB GLN 48 2HB GLN 48 12.770 7.109 1.508
347 1HG GLN 48 1HG GLN 48 13.883 9.094 2.281
348 2HG GLN 48 2HG GLN 48 14.074 8.910 0.538
349 1HE2 GLN 48 1HE2 GLN 48 15.679 8.789 3.615
350 2HE2 GLN 48 2HE2 GLN 48 17.281 8.850 2.997
351 H GLU 49 H GLU 49 14.810 4.934 2.633
352 HA GLU 49 HA GLU 49 14.208 2.294 1.794
353 1HB GLU 49 1HB GLU 49 14.596 3.471 4.551
354 2HB GLU 49 2HB GLU 49 15.883 2.846 3.537
355 1HG GLU 49 1HG GLU 49 14.880 0.626 3.641
356 2HG GLU 49 2HG GLU 49 13.621 1.269 4.697
357 H ILE 50 H ILE 50 12.501 0.988 2.992
358 HA ILE 50 HA ILE 50 9.994 2.287 2.625
359 HB ILE 50 HB ILE 50 10.461 -0.461 3.799
360 1HG1 ILE 50 1HG1 ILE 50 11.654 -0.208 1.670
361 2HG1 ILE 50 2HG1 ILE 50 10.181 0.346 0.893
362 1HG2 ILE 50 1HG2 ILE 50 8.182 0.412 4.046
363 2HG2 ILE 50 2HG2 ILE 50 8.216 -0.913 2.879
364 3HG2 ILE 50 3HG2 ILE 50 8.116 0.754 2.316
365 1HD1 ILE 50 1HD1 ILE 50 9.147 -1.811 1.328
366 2HD1 ILE 50 2HD1 ILE 50 10.649 -2.365 2.075
367 3HD1 ILE 50 3HD1 ILE 50 10.614 -1.944 0.359
368 H LEU 51 H LEU 51 10.039 3.879 4.182
369 HA LEU 51 HA LEU 51 9.767 3.013 6.984
370 1HB LEU 51 1HB LEU 51 10.031 5.409 7.521
371 2HB LEU 51 2HB LEU 51 10.152 5.768 5.813
372 HG LEU 51 HG LEU 51 12.259 4.571 5.673
373 1HD1 LEU 51 1HD1 LEU 51 12.301 6.930 6.236
374 2HD1 LEU 51 2HD1 LEU 51 13.604 6.079 7.072
375 3HD1 LEU 51 3HD1 LEU 51 12.150 6.543 7.948
376 1HD2 LEU 51 1HD2 LEU 51 11.884 4.082 8.627
377 2HD2 LEU 51 2HD2 LEU 51 13.346 3.732 7.713
378 3HD2 LEU 51 3HD2 LEU 51 11.859 2.857 7.361
379 H LEU 52 H LEU 52 7.974 3.398 4.427
380 HA LEU 52 HA LEU 52 5.870 5.148 5.257
381 1HB LEU 52 1HB LEU 52 6.015 3.100 3.029
382 2HB LEU 52 2HB LEU 52 6.638 4.718 2.904
383 HG LEU 52 HG LEU 52 4.316 5.617 3.074
384 1HD1 LEU 52 1HD1 LEU 52 5.420 5.268 0.917
385 2HD1 LEU 52 2HD1 LEU 52 3.680 4.941 0.819
386 3HD1 LEU 52 3HD1 LEU 52 4.824 3.603 0.905
387 1HD2 LEU 52 1HD2 LEU 52 3.568 2.724 2.765
388 2HD2 LEU 52 2HD2 LEU 52 2.457 4.095 2.690
389 3HD2 LEU 52 3HD2 LEU 52 3.282 3.698 4.203
390 H SER 53 H SER 53 6.407 1.637 5.162
391 HA SER 53 HA SER 53 3.769 0.861 5.720
392 1HB SER 53 1HB SER 53 5.273 -0.516 4.525
393 2HB SER 53 2HB SER 53 4.827 -1.378 5.976
394 HG SER 53 HG SER 53 6.850 -1.301 6.568
395 H GLU 54 H GLU 54 5.974 2.222 7.730
396 HA GLU 54 HA GLU 54 5.159 0.868 10.188
397 1HB GLU 54 1HB GLU 54 6.662 2.452 11.324
398 2HB GLU 54 2HB GLU 54 6.980 3.233 9.786
399 1HG GLU 54 1HG GLU 54 7.993 1.197 8.937
400 2HG GLU 54 2HG GLU 54 7.654 0.393 10.474
401 H GLY 55 H GLY 55 3.982 3.372 8.309
402 1HA GLY 55 1HA GLY 55 2.826 4.772 10.621
403 2HA GLY 55 2HA GLY 55 1.753 4.093 9.398
404 H SER 56 H SER 56 1.133 5.505 7.902
405 HA SER 56 HA SER 56 2.502 7.959 7.433
406 1HB SER 56 1HB SER 56 2.759 7.419 5.025
407 2HB SER 56 2HB SER 56 2.460 5.743 5.449
408 HG SER 56 HG SER 56 4.254 6.453 7.115
409 H TYR 57 H TYR 57 0.100 5.715 6.872
410 HA TYR 57 HA TYR 57 -1.564 7.455 5.242
411 1HB TYR 57 1HB TYR 57 -2.032 4.671 6.331
412 2HB TYR 57 2HB TYR 57 -1.509 5.075 4.707
413 HD1 TYR 57 1HD TYR 57 -4.334 4.512 6.835
414 HD2 TYR 57 2HD TYR 57 -3.091 6.342 3.214
415 HE1 TYR 57 1HE TYR 57 -6.665 4.548 6.057
416 HE2 TYR 57 2HE TYR 57 -5.412 6.382 2.425
417 HH TYR 57 HH TYR 57 -7.992 5.880 4.476
418 H GLU 58 H GLU 58 -2.672 8.914 6.155
419 HA GLU 58 HA GLU 58 -3.769 8.512 8.858
420 1HB GLU 58 1HB GLU 58 -3.688 10.940 9.067
421 2HB GLU 58 2HB GLU 58 -3.026 11.066 7.445
422 1HG GLU 58 1HG GLU 58 -1.062 9.768 8.194
423 2HG GLU 58 2HG GLU 58 -1.715 9.804 9.833
424 H GLY 59 H GLY 59 -5.782 7.836 8.465
425 1HA GLY 59 1HA GLY 59 -7.721 9.705 7.571
426 2HA GLY 59 2HA GLY 59 -8.021 8.041 8.053
427 H GLY 60 H GLY 60 -6.763 9.939 5.455
428 1HA GLY 60 1HA GLY 60 -8.306 9.369 3.375
429 2HA GLY 60 2HA GLY 60 -7.418 7.855 3.505
430 H VAL 61 H VAL 61 -5.101 9.663 4.520
431 HA VAL 61 HA VAL 61 -4.156 10.409 1.832
432 HB VAL 61 HB VAL 61 -3.446 11.770 4.462
433 1HG1 VAL 61 1HG1 VAL 61 -2.584 12.437 1.643
434 2HG1 VAL 61 2HG1 VAL 61 -1.559 11.767 2.911
435 3HG1 VAL 61 3HG1 VAL 61 -2.220 13.394 3.079
436 1HG2 VAL 61 1HG2 VAL 61 -5.687 12.351 3.727
437 2HG2 VAL 61 2HG2 VAL 61 -5.068 12.787 2.131
438 3HG2 VAL 61 3HG2 VAL 61 -4.602 13.729 3.546
439 H ILE 62 H ILE 62 -2.247 9.493 1.232
440 HA ILE 62 HA ILE 62 -0.920 7.755 3.182
441 HB ILE 62 HB ILE 62 -0.544 7.937 0.185
442 1HG1 ILE 62 1HG1 ILE 62 -1.994 5.762 1.747
443 2HG1 ILE 62 2HG1 ILE 62 -1.527 5.616 0.069
444 1HG2 ILE 62 1HG2 ILE 62 1.490 7.202 1.235
445 2HG2 ILE 62 2HG2 ILE 62 0.768 5.842 0.372
446 3HG2 ILE 62 3HG2 ILE 62 0.624 5.950 2.127
447 1HD1 ILE 62 1HD1 ILE 62 -2.977 7.445 -0.554
448 2HD1 ILE 62 2HD1 ILE 62 -3.461 7.647 1.129
449 3HD1 ILE 62 3HD1 ILE 62 -3.871 6.164 0.264
450 H THR 63 H THR 63 1.039 8.354 3.972
451 HA THR 63 HA THR 63 2.332 10.664 2.707
452 HB THR 63 HB THR 63 2.683 9.489 5.495
453 HG1 THR 63 1HG THR 63 0.782 10.340 5.607
454 1HG2 THR 63 1HG2 THR 63 3.773 11.623 6.033
455 2HG2 THR 63 2HG2 THR 63 3.577 12.150 4.360
456 3HG2 THR 63 3HG2 THR 63 4.635 10.791 4.739
457 H CYS 64 H CYS 64 4.625 10.473 2.230
458 HA CYS 64 HA CYS 64 5.556 7.778 1.893
459 1HB CYS 64 1HB CYS 64 6.985 10.427 1.506
460 2HB CYS 64 2HB CYS 64 6.467 9.287 0.262
461 H ARG 65 H ARG 65 6.178 10.408 4.137
462 HA ARG 65 HA ARG 65 6.831 10.487 6.247
463 1HB ARG 65 1HB ARG 65 6.778 7.447 6.145
464 2HB ARG 65 2HB ARG 65 5.462 8.471 6.643
465 1HG ARG 65 1HG ARG 65 6.188 7.648 8.648
466 2HG ARG 65 2HG ARG 65 7.008 9.203 8.583
467 1HD ARG 65 1HD ARG 65 9.060 8.145 7.863
468 2HD ARG 65 2HD ARG 65 8.257 6.579 7.827
469 HE ARG 65 HE ARG 65 8.536 8.134 10.319
470 1HH1 ARG 65 1HH1 ARG 65 8.704 5.043 8.634
471 2HH1 ARG 65 2HH1 ARG 65 9.433 4.171 9.886
472 1HH2 ARG 65 1HH2 ARG 65 9.460 6.962 12.123
473 2HH2 ARG 65 2HH2 ARG 65 9.856 5.318 11.978
474 H ALA 66 H ALA 66 8.658 8.811 3.948
475 HA ALA 66 HA ALA 66 11.135 9.409 5.355
476 1HB ALA 66 1HB ALA 66 10.681 8.063 2.691
477 2HB ALA 66 2HB ALA 66 10.942 7.238 4.229
478 3HB ALA 66 3HB ALA 66 12.229 8.214 3.522
479 H HIS 67 H HIS 67 9.068 10.637 2.856
480 HA HIS 67 HA HIS 67 10.704 13.009 2.654
481 1HB HIS 67 1HB HIS 67 10.214 13.117 0.146
482 2HB HIS 67 2HB HIS 67 9.959 11.389 0.239
483 HD2 HIS 67 2HD HIS 67 13.004 13.397 1.716
484 HE1 HIS 67 1HE HIS 67 14.386 10.544 -1.071
485 HE2 HIS 67 2HE HIS 67 15.040 12.358 0.553
486 H LEU 68 H LEU 68 9.715 14.765 1.969
487 HA LEU 68 HA LEU 68 8.155 16.271 2.285
488 1HB LEU 68 1HB LEU 68 7.006 14.927 -0.173
489 2HB LEU 68 2HB LEU 68 8.498 15.815 -0.179
490 HG LEU 68 HG LEU 68 6.889 17.212 -1.197
491 1HD1 LEU 68 1HD1 LEU 68 4.830 16.268 -0.497
492 2HD1 LEU 68 2HD1 LEU 68 4.827 17.993 -0.099
493 3HD1 LEU 68 3HD1 LEU 68 5.106 16.785 1.158
494 1HD2 LEU 68 1HD2 LEU 68 8.423 18.375 0.257
495 2HD2 LEU 68 2HD2 LEU 68 7.320 18.181 1.620
496 3HD2 LEU 68 3HD2 LEU 68 6.856 19.180 0.244
497 H TRP 69 H TRP 69 5.456 14.466 1.012
498 HA TRP 69 HA TRP 69 4.332 13.978 3.633
499 1HB TRP 69 1HB TRP 69 2.388 15.561 3.376
500 2HB TRP 69 2HB TRP 69 3.234 16.343 2.068
501 HD1 TRP 69 HD TRP 69 5.211 18.051 2.662
502 HE1 TRP 69 1HE TRP 69 5.871 19.219 4.830
503 HE3 TRP 69 3HE TRP 69 2.482 15.237 5.957
504 HZ2 TRP 69 2HZ TRP 69 5.301 19.012 7.590
505 HZ3 TRP 69 3HZ TRP 69 2.596 15.806 8.347
506 HH2 TRP 69 HH TRP 69 3.977 17.653 9.143
507 H THR 70 H THR 70 3.525 14.553 0.198
508 HA THR 70 HA THR 70 1.024 13.136 0.741
509 HB THR 70 HB THR 70 0.186 14.402 -1.226
510 HG1 THR 70 1HG THR 70 2.688 14.967 -1.574
511 1HG2 THR 70 1HG2 THR 70 1.177 15.929 1.202
512 2HG2 THR 70 2HG2 THR 70 -0.313 14.991 1.124
513 3HG2 THR 70 3HG2 THR 70 -0.135 16.440 0.138
514 H PHE 71 H PHE 71 0.514 11.319 -0.151
515 HA PHE 71 HA PHE 71 1.078 10.903 -2.970
516 1HB PHE 71 1HB PHE 71 1.126 8.792 -0.758
517 2HB PHE 71 2HB PHE 71 2.480 9.266 -1.773
518 HD1 PHE 71 1HD PHE 71 2.557 8.600 -4.131
519 HD2 PHE 71 2HD PHE 71 -0.585 7.267 -1.593
520 HE1 PHE 71 1HE PHE 71 1.923 6.899 -5.783
521 HE2 PHE 71 2HE PHE 71 -1.211 5.575 -3.231
522 HZ PHE 71 HZ PHE 71 0.034 5.386 -5.334
523 H ASN 72 H ASN 72 -0.807 10.325 -4.086
524 HA ASN 72 HA ASN 72 -3.146 9.899 -2.396
525 1HB ASN 72 1HB ASN 72 -3.078 11.529 -4.943
526 2HB ASN 72 2HB ASN 72 -3.293 12.150 -3.305
527 1HD2 ASN 72 1HD2 ASN 72 -5.068 12.329 -5.625
528 2HD2 ASN 72 2HD2 ASN 72 -6.554 11.622 -5.113
529 H ASP 73 H ASP 73 -3.925 8.015 -2.629
530 HA ASP 73 HA ASP 73 -3.154 6.198 -4.642
531 1HB ASP 73 1HB ASP 73 -3.803 5.495 -2.384
532 2HB ASP 73 2HB ASP 73 -4.767 4.683 -3.608
533 H GLY 74 H GLY 74 -5.838 8.402 -4.320
534 1HA GLY 74 1HA GLY 74 -7.732 8.737 -5.594
535 2HA GLY 74 2HA GLY 74 -7.486 7.150 -6.302
536 H THR 75 H THR 75 -4.685 8.869 -6.601
537 HA THR 75 HA THR 75 -5.417 9.569 -9.346
538 HB THR 75 HB THR 75 -3.449 11.084 -7.573
539 HG1 THR 75 1HG THR 75 -6.136 11.159 -7.944
540 1HG2 THR 75 1HG2 THR 75 -2.932 11.239 -9.997
541 2HG2 THR 75 2HG2 THR 75 -3.504 12.778 -9.358
542 3HG2 THR 75 3HG2 THR 75 -4.587 11.760 -10.306
543 H GLY 76 H GLY 76 -3.794 7.456 -7.505
544 1HA GLY 76 1HA GLY 76 -2.267 6.244 -9.617
545 2HA GLY 76 2HA GLY 76 -2.351 5.773 -7.950
546 H HIS 77 H HIS 77 -1.157 8.751 -9.347
547 HA HIS 77 HA HIS 77 1.496 7.894 -8.611
548 1HB HIS 77 1HB HIS 77 1.282 8.986 -10.801
549 2HB HIS 77 2HB HIS 77 2.425 9.816 -9.765
550 HD1 HIS 77 1HD HIS 77 1.879 12.202 -9.008
551 HD2 HIS 77 2HD HIS 77 -0.981 10.443 -11.436
552 HE1 HIS 77 1HE HIS 77 0.422 14.080 -9.764
553 HE2 HIS 77 2HE HIS 77 -1.059 13.032 -11.494
554 H GLY 78 H GLY 78 2.976 9.293 -7.531
555 1HA GLY 78 1HA GLY 78 3.380 10.118 -5.379
556 2HA GLY 78 2HA GLY 78 1.653 10.418 -5.191
557 H ILE 79 H ILE 79 2.563 12.455 -4.322
558 HA ILE 79 HA ILE 79 2.865 14.383 -6.475
559 HB ILE 79 HB ILE 79 2.567 14.786 -3.458
560 1HG1 ILE 79 1HG1 ILE 79 0.643 15.412 -5.724
561 2HG1 ILE 79 2HG1 ILE 79 0.413 15.955 -4.074
562 1HG2 ILE 79 1HG2 ILE 79 2.421 17.200 -3.881
563 2HG2 ILE 79 2HG2 ILE 79 2.825 16.911 -5.575
564 3HG2 ILE 79 3HG2 ILE 79 3.996 16.530 -4.313
565 1HD1 ILE 79 1HD1 ILE 79 0.458 13.085 -4.961
566 2HD1 ILE 79 2HD1 ILE 79 -0.974 14.035 -4.553
567 3HD1 ILE 79 3HD1 ILE 79 0.219 13.657 -3.309
568 H ASN 80 H ASN 80 4.482 12.802 -3.897
569 HA ASN 80 HA ASN 80 6.969 13.704 -5.014
570 1HB ASN 80 1HB ASN 80 6.795 14.816 -2.863
571 2HB ASN 80 2HB ASN 80 7.998 13.561 -2.704
572 1HD2 ASN 80 1HD2 ASN 80 7.615 11.734 -1.373
573 2HD2 ASN 80 2HD2 ASN 80 6.362 11.781 -0.211
574 HA PRO 81 HA PRO 81 7.870 13.109 -6.445
575 1HB PRO 81 1HB PRO 81 9.719 11.949 -7.136
576 2HB PRO 81 2HB PRO 81 8.643 11.449 -8.437
577 1HG PRO 81 1HG PRO 81 9.832 9.797 -6.461
578 2HG PRO 81 2HG PRO 81 8.641 9.321 -7.666
579 1HD PRO 81 1HD PRO 81 8.239 9.444 -4.878
580 2HD PRO 81 2HD PRO 81 6.973 9.271 -6.107
581 H ASP 82 H ASP 82 6.965 13.817 -8.417
582 HA ASP 82 HA ASP 82 4.247 12.965 -8.682
583 1HB ASP 82 1HB ASP 82 4.771 15.336 -8.820
584 2HB ASP 82 2HB ASP 82 3.912 14.797 -10.256
585 H ASP 83 H ASP 83 7.078 12.066 -10.385
586 HA ASP 83 HA ASP 83 5.560 11.263 -12.747
587 1HB ASP 83 1HB ASP 83 7.980 12.039 -12.921
588 2HB ASP 83 2HB ASP 83 7.612 10.517 -13.720
589 H CYS 84 H CYS 84 6.497 9.913 -9.715
590 HA CYS 84 HA CYS 84 6.284 7.252 -10.775
591 1HB CYS 84 1HB CYS 84 7.138 6.519 -8.632
592 2HB CYS 84 2HB CYS 84 7.115 8.162 -8.037
593 HG CYS 84 HG CYS 84 8.900 8.540 -10.636
594 H CYS 85 H CYS 85 5.019 5.816 -9.807
595 HA CYS 85 HA CYS 85 2.786 6.735 -8.250
596 1HB CYS 85 1HB CYS 85 1.991 7.046 -10.466
597 2HB CYS 85 2HB CYS 85 1.234 5.629 -9.805
598 HG CYS 85 HG CYS 85 2.659 5.851 -12.649
599 H LEU 86 H LEU 86 1.449 4.957 -7.743
600 HA LEU 86 HA LEU 86 3.061 2.517 -7.380
601 1HB LEU 86 1HB LEU 86 1.981 2.167 -5.224
602 2HB LEU 86 2HB LEU 86 1.055 3.625 -5.407
603 HG LEU 86 HG LEU 86 3.086 4.985 -5.210
604 1HD1 LEU 86 1HD1 LEU 86 1.872 4.467 -3.192
605 2HD1 LEU 86 2HD1 LEU 86 3.606 4.534 -2.866
606 3HD1 LEU 86 3HD1 LEU 86 2.792 2.976 -2.992
607 1HD2 LEU 86 1HD2 LEU 86 4.549 2.387 -4.739
608 2HD2 LEU 86 2HD2 LEU 86 5.230 4.005 -4.622
609 3HD2 LEU 86 3HD2 LEU 86 4.689 3.391 -6.182
610 H ALA 87 H ALA 87 2.133 0.769 -8.064
611 HA ALA 87 HA ALA 87 -0.507 1.025 -9.275
612 1HB ALA 87 1HB ALA 87 1.433 -1.263 -9.324
613 2HB ALA 87 2HB ALA 87 1.293 -0.021 -10.570
614 3HB ALA 87 3HB ALA 87 -0.039 -1.148 -10.283
615 H GLU 88 H GLU 88 -2.330 0.072 -8.498
616 HA GLU 88 HA GLU 88 -1.942 -1.578 -6.136
617 1HB GLU 88 1HB GLU 88 -3.466 0.353 -5.812
618 2HB GLU 88 2HB GLU 88 -4.242 -1.189 -5.540
619 1HG GLU 88 1HG GLU 88 -5.812 0.160 -6.649
620 2HG GLU 88 2HG GLU 88 -5.254 -1.023 -7.817
621 H TYR 89 H TYR 89 -3.169 -3.393 -5.945
622 HA TYR 89 HA TYR 89 -4.483 -4.300 -8.340
623 1HB TYR 89 1HB TYR 89 -2.450 -5.429 -8.660
624 2HB TYR 89 2HB TYR 89 -3.504 -6.652 -7.979
625 HD1 TYR 89 1HD TYR 89 -3.294 -7.260 -5.536
626 HD2 TYR 89 2HD TYR 89 -0.391 -5.011 -7.674
627 HE1 TYR 89 1HE TYR 89 -1.565 -7.914 -3.902
628 HE2 TYR 89 2HE TYR 89 1.319 -5.656 -6.040
629 HH TYR 89 HH TYR 89 0.810 -8.149 -3.811
630 HA PRO 90 HA PRO 90 -7.897 -5.355 -6.009
631 1HB PRO 90 1HB PRO 90 -8.907 -6.397 -7.760
632 2HB PRO 90 2HB PRO 90 -8.700 -7.850 -6.791
633 1HG PRO 90 1HG PRO 90 -7.674 -7.722 -9.235
634 2HG PRO 90 2HG PRO 90 -6.733 -8.444 -7.916
635 1HD PRO 90 1HD PRO 90 -6.501 -5.718 -9.137
636 2HD PRO 90 2HD PRO 90 -5.231 -6.869 -8.698
637 H VAL 91 H VAL 91 -8.463 -6.006 -4.073
638 HA VAL 91 HA VAL 91 -6.963 -8.159 -2.759
639 HB VAL 91 HB VAL 91 -7.850 -5.554 -1.527
640 1HG1 VAL 91 1HG1 VAL 91 -6.522 -6.272 0.417
641 2HG1 VAL 91 2HG1 VAL 91 -6.271 -7.834 -0.369
642 3HG1 VAL 91 3HG1 VAL 91 -7.893 -7.320 0.072
643 1HG2 VAL 91 1HG2 VAL 91 -5.452 -5.004 -1.344
644 2HG2 VAL 91 2HG2 VAL 91 -5.995 -5.133 -3.014
645 3HG2 VAL 91 3HG2 VAL 91 -5.068 -6.444 -2.290
646 H GLU 92 H GLU 92 -8.224 -9.571 -1.814
647 HA GLU 92 HA GLU 92 -11.094 -9.015 -1.518
648 1HB GLU 92 1HB GLU 92 -11.331 -11.481 -1.577
649 2HB GLU 92 2HB GLU 92 -9.615 -11.581 -1.872
650 1HG GLU 92 1HG GLU 92 -10.823 -11.842 -3.953
651 2HG GLU 92 2HG GLU 92 -9.928 -10.324 -3.971
652 H VAL 93 H VAL 93 -11.943 -9.187 0.410
653 HA VAL 93 HA VAL 93 -10.227 -10.017 2.669
654 HB VAL 93 HB VAL 93 -12.464 -7.988 2.723
655 1HG1 VAL 93 1HG1 VAL 93 -12.120 -9.083 4.856
656 2HG1 VAL 93 2HG1 VAL 93 -11.609 -7.399 4.931
657 3HG1 VAL 93 3HG1 VAL 93 -10.403 -8.681 4.811
658 1HG2 VAL 93 1HG2 VAL 93 -9.484 -7.510 2.685
659 2HG2 VAL 93 2HG2 VAL 93 -10.718 -6.276 2.925
660 3HG2 VAL 93 3HG2 VAL 93 -10.620 -7.138 1.390
661 H LYS 94 H LYS 94 -10.933 -11.776 3.697
662 HA LYS 94 HA LYS 94 -13.817 -12.423 3.672
663 1HB LYS 94 1HB LYS 94 -13.186 -14.798 3.799
664 2HB LYS 94 2HB LYS 94 -11.493 -14.385 3.758
665 1HG LYS 94 1HG LYS 94 -13.404 -14.033 1.469
666 2HG LYS 94 2HG LYS 94 -12.215 -15.325 1.643
667 1HD LYS 94 1HD LYS 94 -10.453 -13.535 1.749
668 2HD LYS 94 2HD LYS 94 -11.698 -12.392 1.258
669 1HE LYS 94 1HE LYS 94 -10.674 -14.734 -0.196
670 2HE LYS 94 2HE LYS 94 -10.490 -13.047 -0.636
671 1HZ LYS 94 1HZ LYS 94 -12.247 -13.993 -2.012
672 2HZ LYS 94 2HZ LYS 94 -12.988 -12.943 -0.925
673 3HZ LYS 94 3HZ LYS 94 -13.038 -14.590 -0.672
674 H GLY 95 H GLY 95 -14.120 -11.439 5.711
675 1HA GLY 95 1HA GLY 95 -13.424 -12.996 7.943
676 2HA GLY 95 2HA GLY 95 -14.074 -11.367 8.023
677 H ASP 96 H ASP 96 -11.520 -13.273 8.660
678 HA ASP 96 HA ASP 96 -9.845 -10.931 9.202
679 1HB ASP 96 1HB ASP 96 -8.579 -12.349 10.670
680 2HB ASP 96 2HB ASP 96 -9.476 -13.762 10.188
681 H ASP 97 H ASP 97 -10.176 -13.205 6.819
682 HA ASP 97 HA ASP 97 -7.267 -13.445 6.408
683 1HB ASP 97 1HB ASP 97 -7.883 -15.231 4.779
684 2HB ASP 97 2HB ASP 97 -9.558 -15.014 5.221
685 H ILE 98 H ILE 98 -6.292 -12.661 4.606
686 HA ILE 98 HA ILE 98 -7.997 -11.237 2.704
687 HB ILE 98 HB ILE 98 -5.617 -10.160 4.189
688 1HG1 ILE 98 1HG1 ILE 98 -8.044 -10.046 4.972
689 2HG1 ILE 98 2HG1 ILE 98 -8.271 -8.981 3.599
690 1HG2 ILE 98 1HG2 ILE 98 -5.245 -9.636 1.803
691 2HG2 ILE 98 2HG2 ILE 98 -5.663 -8.189 2.711
692 3HG2 ILE 98 3HG2 ILE 98 -6.873 -8.974 1.697
693 1HD1 ILE 98 1HD1 ILE 98 -7.951 -7.665 5.625
694 2HD1 ILE 98 2HD1 ILE 98 -6.692 -7.376 4.426
695 3HD1 ILE 98 3HD1 ILE 98 -6.359 -8.390 5.827
696 H TYR 99 H TYR 99 -7.686 -11.635 0.724
697 HA TYR 99 HA TYR 99 -5.205 -12.950 -0.147
698 1HB TYR 99 1HB TYR 99 -6.516 -13.881 -1.971
699 2HB TYR 99 2HB TYR 99 -7.979 -13.134 -1.370
700 HD1 TYR 99 1HD TYR 99 -8.393 -13.845 1.275
701 HD2 TYR 99 2HD TYR 99 -6.360 -16.131 -1.671
702 HE1 TYR 99 1HE TYR 99 -8.939 -15.892 2.501
703 HE2 TYR 99 2HE TYR 99 -6.891 -18.193 -0.447
704 HH TYR 99 HH TYR 99 -9.194 -18.216 2.032
705 H VAL 100 H VAL 100 -4.232 -12.149 -1.956
706 HA VAL 100 HA VAL 100 -5.394 -9.735 -3.171
707 HB VAL 100 HB VAL 100 -3.203 -8.678 -3.247
708 1HG1 VAL 100 1HG1 VAL 100 -2.842 -8.184 -0.874
709 2HG1 VAL 100 2HG1 VAL 100 -3.895 -9.537 -0.452
710 3HG1 VAL 100 3HG1 VAL 100 -4.542 -8.153 -1.334
711 1HG2 VAL 100 1HG2 VAL 100 -1.774 -10.652 -3.366
712 2HG2 VAL 100 2HG2 VAL 100 -2.182 -11.065 -1.701
713 3HG2 VAL 100 3HG2 VAL 100 -1.254 -9.604 -2.044
714 H SER 101 H SER 101 -4.677 -9.379 -5.423
715 HA SER 101 HA SER 101 -3.358 -11.759 -6.507
716 1HB SER 101 1HB SER 101 -5.629 -10.254 -7.828
717 2HB SER 101 2HB SER 101 -5.784 -11.811 -7.020
718 HG SER 101 HG SER 101 -4.431 -12.711 -8.523
719 H THR 102 H THR 102 -1.465 -11.168 -7.278
720 HA THR 102 HA THR 102 -1.188 -8.518 -8.511
721 HB THR 102 HB THR 102 0.321 -8.822 -6.599
722 HG1 THR 102 1HG THR 102 1.120 -8.140 -9.024
723 1HG2 THR 102 1HG2 THR 102 1.409 -11.210 -8.106
724 2HG2 THR 102 2HG2 THR 102 0.489 -11.265 -6.604
725 3HG2 THR 102 3HG2 THR 102 2.098 -10.541 -6.627
726 H LYS 103 H LYS 103 -1.522 -11.735 -9.180
727 HA LYS 103 HA LYS 103 0.223 -11.910 -11.426
728 1HB LYS 103 1HB LYS 103 -2.147 -13.610 -10.638
729 2HB LYS 103 2HB LYS 103 -0.487 -13.882 -10.135
730 1HG LYS 103 1HG LYS 103 0.156 -14.288 -12.456
731 2HG LYS 103 2HG LYS 103 -1.525 -14.054 -12.948
732 1HD LYS 103 1HD LYS 103 -2.197 -15.896 -11.491
733 2HD LYS 103 2HD LYS 103 -0.523 -16.122 -11.003
734 1HE LYS 103 1HE LYS 103 0.089 -16.658 -13.289
735 2HE LYS 103 2HE LYS 103 -1.584 -16.424 -13.798
736 1HZ LYS 103 1HZ LYS 103 -0.636 -18.455 -11.852
737 2HZ LYS 103 2HZ LYS 103 -1.107 -18.778 -13.426
738 3HZ LYS 103 3HZ LYS 103 -2.229 -18.230 -12.308
739 H GLY 104 H GLY 104 -0.115 -10.514 -12.975
740 1HA GLY 104 1HA GLY 104 -2.858 -10.082 -13.946
741 2HA GLY 104 2HA GLY 104 -1.481 -10.292 -15.030
742 H ILE 105 H ILE 105 -1.209 -8.595 -12.019
743 HA ILE 105 HA ILE 105 -0.943 -6.081 -13.497
744 HB ILE 105 HB ILE 105 -2.028 -6.440 -10.695
745 1HG1 ILE 105 1HG1 ILE 105 -3.648 -6.997 -12.459
746 2HG1 ILE 105 2HG1 ILE 105 -3.364 -5.442 -13.227
747 1HG2 ILE 105 1HG2 ILE 105 -2.365 -3.990 -10.694
748 2HG2 ILE 105 2HG2 ILE 105 -1.551 -3.886 -12.253
749 3HG2 ILE 105 3HG2 ILE 105 -0.657 -4.415 -10.828
750 1HD1 ILE 105 1HD1 ILE 105 -4.287 -4.300 -11.285
751 2HD1 ILE 105 2HD1 ILE 105 -4.580 -5.855 -10.512
752 3HD1 ILE 105 3HD1 ILE 105 -5.443 -5.430 -11.991
753 H LEU 106 H LEU 106 1.125 -5.673 -13.633
754 HA LEU 106 HA LEU 106 2.894 -6.432 -11.551
755 1HB LEU 106 1HB LEU 106 3.689 -7.007 -13.689
756 2HB LEU 106 2HB LEU 106 4.570 -5.571 -13.204
757 HG LEU 106 HG LEU 106 2.229 -5.355 -15.042
758 1HD1 LEU 106 1HD1 LEU 106 4.605 -3.578 -14.619
759 2HD1 LEU 106 2HD1 LEU 106 2.961 -3.288 -14.056
760 3HD1 LEU 106 3HD1 LEU 106 3.311 -3.307 -15.787
761 1HD2 LEU 106 1HD2 LEU 106 3.723 -6.934 -16.089
762 2HD2 LEU 106 2HD2 LEU 106 5.089 -5.853 -15.838
763 3HD2 LEU 106 3HD2 LEU 106 3.788 -5.390 -16.936
764 HA PRO 107 HA PRO 107 2.971 -2.387 -9.746
765 1HB PRO 107 1HB PRO 107 4.419 -2.617 -8.010
766 2HB PRO 107 2HB PRO 107 5.808 -2.680 -9.090
767 1HG PRO 107 1HG PRO 107 4.098 -4.898 -8.066
768 2HG PRO 107 2HG PRO 107 5.833 -4.870 -8.438
769 1HD PRO 107 1HD PRO 107 4.072 -6.064 -10.050
770 2HD PRO 107 2HD PRO 107 5.501 -5.218 -10.690
771 H ASN 108 H ASN 108 3.412 -0.291 -10.358
772 HA ASN 108 HA ASN 108 4.936 0.090 -12.756
773 1HB ASN 108 1HB ASN 108 4.031 2.296 -12.688
774 2HB ASN 108 2HB ASN 108 3.430 2.061 -11.074
775 1HD2 ASN 108 1HD2 ASN 108 1.274 2.528 -11.688
776 2HD2 ASN 108 2HD2 ASN 108 0.334 1.458 -12.639
777 H LYS 109 H LYS 109 6.875 1.084 -12.778
778 HA LYS 109 HA LYS 109 8.834 1.644 -12.134
779 1HB LYS 109 1HB LYS 109 8.969 3.685 -10.951
780 2HB LYS 109 2HB LYS 109 7.227 3.696 -10.634
781 1HG LYS 109 1HG LYS 109 6.873 3.650 -13.077
782 2HG LYS 109 2HG LYS 109 8.617 3.729 -13.326
783 1HD LYS 109 1HD LYS 109 8.622 5.907 -12.095
784 2HD LYS 109 2HD LYS 109 6.856 5.808 -12.064
785 1HE LYS 109 1HE LYS 109 6.791 5.761 -14.491
786 2HE LYS 109 2HE LYS 109 8.549 5.822 -14.562
787 1HZ LYS 109 1HZ LYS 109 8.438 8.027 -13.456
788 2HZ LYS 109 2HZ LYS 109 6.759 7.933 -13.502
789 3HZ LYS 109 3HZ LYS 109 7.615 8.000 -14.930
790 H ALA 110 H ALA 110 10.171 2.589 -10.144
791 HA ALA 110 HA ALA 110 11.441 2.030 -8.395
792 1HB ALA 110 1HB ALA 110 9.480 2.889 -7.156
793 2HB ALA 110 2HB ALA 110 10.397 1.690 -6.250
794 3HB ALA 110 3HB ALA 110 8.878 1.238 -7.023
795 H HIS 111 H HIS 111 9.185 -0.534 -7.773
796 HA HIS 111 HA HIS 111 11.226 -2.417 -8.730
797 1HB HIS 111 1HB HIS 111 9.813 -2.877 -6.096
798 2HB HIS 111 2HB HIS 111 11.428 -2.188 -6.197
799 HD1 HIS 111 1HD HIS 111 9.586 -5.501 -6.708
800 HD2 HIS 111 2HD HIS 111 13.466 -3.984 -6.765
801 HE1 HIS 111 1HE HIS 111 11.079 -7.470 -6.696
802 HE2 HIS 111 2HE HIS 111 13.355 -6.530 -6.360
803 H SER 112 H SER 112 10.097 -3.201 -10.392
804 HA SER 112 HA SER 112 7.309 -3.775 -10.152
805 1HB SER 112 1HB SER 112 7.536 -4.482 -12.503
806 2HB SER 112 2HB SER 112 9.291 -4.334 -12.373
807 HG SER 112 HG SER 112 7.454 -2.230 -11.913
Start of MODEL 12
1 1H MET 1 1HT MET 1 -3.783 -16.045 -13.132
2 2H MET 1 2HT MET 1 -4.402 -14.822 -14.119
3 3H MET 1 3HT MET 1 -5.454 -15.890 -13.315
4 HA MET 1 HA MET 1 -3.646 -13.967 -12.004
5 1HB MET 1 1HB MET 1 -6.665 -14.037 -12.166
6 2HB MET 1 2HB MET 1 -5.685 -13.084 -13.257
7 1HG MET 1 1HG MET 1 -4.812 -11.830 -11.340
8 2HG MET 1 2HG MET 1 -5.888 -12.752 -10.287
9 1HE MET 1 1HE MET 1 -6.811 -10.349 -9.452
10 2HE MET 1 2HE MET 1 -7.514 -9.158 -10.545
11 3HE MET 1 3HE MET 1 -5.785 -9.509 -10.619
12 H SER 2 H SER 2 -3.170 -14.657 -9.931
13 HA SER 2 HA SER 2 -4.438 -17.138 -9.201
14 1HB SER 2 1HB SER 2 -2.069 -17.207 -9.358
15 2HB SER 2 2HB SER 2 -2.508 -17.367 -7.658
16 HG SER 2 HG SER 2 -1.234 -15.817 -7.357
17 H PHE 3 H PHE 3 -3.658 -14.050 -7.606
18 HA PHE 3 HA PHE 3 -4.288 -13.105 -5.669
19 1HB PHE 3 1HB PHE 3 -6.374 -14.033 -4.410
20 2HB PHE 3 2HB PHE 3 -6.596 -15.054 -5.812
21 HD1 PHE 3 1HD PHE 3 -7.451 -14.219 -7.851
22 HD2 PHE 3 2HD PHE 3 -6.625 -11.591 -4.623
23 HE1 PHE 3 1HE PHE 3 -8.718 -12.432 -8.979
24 HE2 PHE 3 2HE PHE 3 -7.886 -9.804 -5.737
25 HZ PHE 3 HZ PHE 3 -8.937 -10.224 -7.920
26 H GLU 4 H GLU 4 -2.881 -13.262 -4.220
27 HA GLU 4 HA GLU 4 -2.194 -15.880 -3.064
28 1HB GLU 4 1HB GLU 4 -0.101 -14.797 -2.473
29 2HB GLU 4 2HB GLU 4 -0.694 -13.251 -3.040
30 1HG GLU 4 1HG GLU 4 0.865 -14.116 -4.624
31 2HG GLU 4 2HG GLU 4 -0.744 -14.113 -5.338
32 H LYS 5 H LYS 5 -2.554 -16.092 -0.825
33 HA LYS 5 HA LYS 5 -3.797 -13.921 0.529
34 1HB LYS 5 1HB LYS 5 -2.712 -16.527 1.600
35 2HB LYS 5 2HB LYS 5 -4.403 -16.165 1.245
36 1HG LYS 5 1HG LYS 5 -4.292 -14.378 2.982
37 2HG LYS 5 2HG LYS 5 -2.672 -14.928 3.383
38 1HD LYS 5 1HD LYS 5 -3.570 -17.144 3.932
39 2HD LYS 5 2HD LYS 5 -5.196 -16.525 3.596
40 1HE LYS 5 1HE LYS 5 -4.753 -14.742 5.297
41 2HE LYS 5 2HE LYS 5 -3.308 -15.643 5.752
42 1HZ LYS 5 1HZ LYS 5 -4.734 -17.559 6.245
43 2HZ LYS 5 2HZ LYS 5 -6.078 -16.607 5.796
44 3HZ LYS 5 3HZ LYS 5 -5.167 -16.192 7.159
45 H ILE 6 H ILE 6 -2.877 -12.348 1.381
46 HA ILE 6 HA ILE 6 -0.007 -12.522 1.746
47 HB ILE 6 HB ILE 6 -0.826 -10.675 0.373
48 1HG1 ILE 6 1HG1 ILE 6 0.429 -9.774 2.962
49 2HG1 ILE 6 2HG1 ILE 6 0.374 -8.810 1.488
50 1HG2 ILE 6 1HG2 ILE 6 -2.026 -8.755 1.313
51 2HG2 ILE 6 2HG2 ILE 6 -2.242 -9.654 2.813
52 3HG2 ILE 6 3HG2 ILE 6 -2.980 -10.239 1.324
53 1HD1 ILE 6 1HD1 ILE 6 2.521 -9.872 1.725
54 2HD1 ILE 6 2HD1 ILE 6 1.670 -10.523 0.324
55 3HD1 ILE 6 3HD1 ILE 6 1.756 -11.455 1.818
56 H CYS 7 H CYS 7 -2.911 -11.543 3.411
57 HA CYS 7 HA CYS 7 -1.851 -12.340 5.970
58 1HB CYS 7 1HB CYS 7 -2.181 -10.123 7.046
59 2HB CYS 7 2HB CYS 7 -2.451 -9.413 5.463
60 HG CYS 7 HG CYS 7 0.335 -10.934 5.218
61 H SER 8 H SER 8 -3.507 -11.361 7.677
62 HA SER 8 HA SER 8 -6.238 -11.485 6.670
63 1HB SER 8 1HB SER 8 -6.874 -12.841 8.356
64 2HB SER 8 2HB SER 8 -5.577 -12.585 9.421
65 HG SER 8 HG SER 8 -4.317 -13.908 8.000
66 H LEU 9 H LEU 9 -7.623 -10.230 7.994
67 HA LEU 9 HA LEU 9 -6.749 -7.629 8.580
68 1HB LEU 9 1HB LEU 9 -9.178 -9.006 9.665
69 2HB LEU 9 2HB LEU 9 -9.070 -8.451 8.020
70 HG LEU 9 HG LEU 9 -8.886 -6.645 10.440
71 1HD1 LEU 9 1HD1 LEU 9 -9.287 -4.838 8.854
72 2HD1 LEU 9 2HD1 LEU 9 -9.236 -5.996 7.528
73 3HD1 LEU 9 3HD1 LEU 9 -7.796 -5.710 8.504
74 1HD2 LEU 9 1HD2 LEU 9 -11.088 -7.658 10.346
75 2HD2 LEU 9 2HD2 LEU 9 -11.248 -7.195 8.651
76 3HD2 LEU 9 3HD2 LEU 9 -11.176 -5.955 9.905
77 H ASP 10 H ASP 10 -6.906 -10.458 10.536
78 HA ASP 10 HA ASP 10 -6.647 -9.395 13.129
79 1HB ASP 10 1HB ASP 10 -5.469 -11.941 11.997
80 2HB ASP 10 2HB ASP 10 -7.062 -11.775 12.713
81 H ASP 11 H ASP 11 -4.290 -9.745 10.591
82 HA ASP 11 HA ASP 11 -2.162 -8.789 12.379
83 1HB ASP 11 1HB ASP 11 -0.579 -9.287 10.500
84 2HB ASP 11 2HB ASP 11 -1.931 -9.895 9.560
85 H ILE 12 H ILE 12 -3.831 -8.030 9.394
86 HA ILE 12 HA ILE 12 -2.610 -5.375 9.442
87 HB ILE 12 HB ILE 12 -2.151 -6.257 7.405
88 1HG1 ILE 12 1HG1 ILE 12 -4.613 -4.580 6.939
89 2HG1 ILE 12 2HG1 ILE 12 -3.462 -4.998 5.704
90 1HG2 ILE 12 1HG2 ILE 12 -3.582 -8.197 7.354
91 2HG2 ILE 12 2HG2 ILE 12 -3.785 -7.310 5.840
92 3HG2 ILE 12 3HG2 ILE 12 -5.002 -7.178 7.111
93 1HD1 ILE 12 1HD1 ILE 12 -1.681 -3.825 6.901
94 2HD1 ILE 12 2HD1 ILE 12 -2.823 -3.403 8.181
95 3HD1 ILE 12 3HD1 ILE 12 -3.036 -2.750 6.557
96 H TRP 13 H TRP 13 -3.684 -3.820 10.154
97 HA TRP 13 HA TRP 13 -6.545 -4.180 10.649
98 1HB TRP 13 1HB TRP 13 -6.198 -2.468 12.424
99 2HB TRP 13 2HB TRP 13 -4.484 -2.490 12.033
100 HD1 TRP 13 HD TRP 13 -3.333 -5.112 12.259
101 HE1 TRP 13 1HE TRP 13 -3.710 -6.795 14.179
102 HE3 TRP 13 3HE TRP 13 -7.683 -3.238 14.144
103 HZ2 TRP 13 2HZ TRP 13 -5.586 -7.246 16.219
104 HZ3 TRP 13 3HZ TRP 13 -8.707 -4.347 16.081
105 HH2 TRP 13 HH TRP 13 -7.680 -6.306 17.094
106 H VAL 14 H VAL 14 -7.855 -2.210 10.733
107 HA VAL 14 HA VAL 14 -7.670 -0.783 8.292
108 HB VAL 14 HB VAL 14 -9.861 -1.341 9.248
109 1HG1 VAL 14 1HG1 VAL 14 -9.398 -1.108 11.613
110 2HG1 VAL 14 2HG1 VAL 14 -10.795 -0.133 11.161
111 3HG1 VAL 14 3HG1 VAL 14 -9.230 0.639 11.426
112 1HG2 VAL 14 1HG2 VAL 14 -9.767 0.520 7.692
113 2HG2 VAL 14 2HG2 VAL 14 -9.430 1.638 9.013
114 3HG2 VAL 14 3HG2 VAL 14 -10.995 0.828 8.922
115 H GLY 15 H GLY 15 -6.747 1.070 7.786
116 1HA GLY 15 1HA GLY 15 -6.169 3.021 9.875
117 2HA GLY 15 2HA GLY 15 -6.102 3.286 8.135
118 H GLU 16 H GLU 16 -4.725 0.388 8.628
119 HA GLU 16 HA GLU 16 -2.098 1.540 9.107
120 1HB GLU 16 1HB GLU 16 -1.559 -0.893 9.881
121 2HB GLU 16 2HB GLU 16 -3.298 -1.034 9.906
122 1HG GLU 16 1HG GLU 16 -3.541 0.749 11.451
123 2HG GLU 16 2HG GLU 16 -1.818 1.108 11.378
124 H MET 17 H MET 17 -0.334 0.659 8.111
125 HA MET 17 HA MET 17 -0.749 -1.064 5.839
126 1HB MET 17 1HB MET 17 -1.056 1.097 4.836
127 2HB MET 17 2HB MET 17 0.482 0.411 4.333
128 1HG MET 17 1HG MET 17 1.668 1.845 5.895
129 2HG MET 17 2HG MET 17 0.141 2.573 6.388
130 1HE MET 17 1HE MET 17 2.714 4.191 5.323
131 2HE MET 17 2HE MET 17 1.230 4.972 5.861
132 3HE MET 17 3HE MET 17 1.932 5.394 4.299
133 H GLU 18 H GLU 18 0.863 -2.392 5.623
134 HA GLU 18 HA GLU 18 3.461 -1.625 6.597
135 1HB GLU 18 1HB GLU 18 3.795 -3.806 7.827
136 2HB GLU 18 2HB GLU 18 2.089 -4.123 7.574
137 1HG GLU 18 1HG GLU 18 1.489 -2.188 8.945
138 2HG GLU 18 2HG GLU 18 3.186 -1.762 9.126
139 H THR 19 H THR 19 5.193 -2.851 5.649
140 HA THR 19 HA THR 19 4.639 -3.892 3.068
141 HB THR 19 HB THR 19 7.149 -3.931 4.711
142 HG1 THR 19 1HG THR 19 7.710 -2.126 3.354
143 1HG2 THR 19 1HG2 THR 19 8.319 -4.232 2.516
144 2HG2 THR 19 2HG2 THR 19 6.727 -4.495 1.773
145 3HG2 THR 19 3HG2 THR 19 7.319 -5.599 2.996
146 H PHE 20 H PHE 20 4.301 -5.911 2.480
147 HA PHE 20 HA PHE 20 5.331 -8.116 4.065
148 1HB PHE 20 1HB PHE 20 3.272 -9.376 3.728
149 2HB PHE 20 2HB PHE 20 2.524 -8.010 2.940
150 HD1 PHE 20 1HD PHE 20 3.772 -9.270 6.177
151 HD2 PHE 20 2HD PHE 20 1.456 -6.312 4.200
152 HE1 PHE 20 1HE PHE 20 2.858 -8.536 8.344
153 HE2 PHE 20 2HE PHE 20 0.543 -5.570 6.357
154 HZ PHE 20 HZ PHE 20 1.242 -6.681 8.431
155 H GLU 21 H GLU 21 5.783 -9.922 2.712
156 HA GLU 21 HA GLU 21 5.696 -9.259 -0.108
157 1HB GLU 21 1HB GLU 21 7.991 -9.416 0.608
158 2HB GLU 21 2HB GLU 21 7.586 -10.809 -0.380
159 1HG GLU 21 1HG GLU 21 8.967 -11.555 1.362
160 2HG GLU 21 2HG GLU 21 7.341 -12.170 1.645
161 H THR 22 H THR 22 5.145 -10.840 -1.567
162 HA THR 22 HA THR 22 3.168 -12.674 -0.530
163 HB THR 22 HB THR 22 2.602 -13.103 -2.872
164 HG1 THR 22 1HG THR 22 3.889 -11.850 -4.475
165 1HG2 THR 22 1HG2 THR 22 1.752 -11.000 -1.868
166 2HG2 THR 22 2HG2 THR 22 2.046 -10.849 -3.605
167 3HG2 THR 22 3HG2 THR 22 3.204 -10.177 -2.463
168 H SER 23 H SER 23 3.132 -14.952 -1.282
169 HA SER 23 HA SER 23 5.499 -16.333 -0.836
170 1HB SER 23 1HB SER 23 4.183 -18.288 -1.493
171 2HB SER 23 2HB SER 23 2.969 -17.190 -2.170
172 HG SER 23 HG SER 23 3.605 -17.725 0.499
173 H ASP 24 H ASP 24 4.385 -14.734 -3.614
174 HA ASP 24 HA ASP 24 5.885 -16.356 -5.510
175 1HB ASP 24 1HB ASP 24 4.337 -13.791 -5.913
176 2HB ASP 24 2HB ASP 24 3.703 -15.408 -6.190
177 H GLY 25 H GLY 25 6.457 -13.798 -3.406
178 1HA GLY 25 1HA GLY 25 9.067 -13.341 -4.662
179 2HA GLY 25 2HA GLY 25 8.649 -12.998 -2.992
180 H THR 26 H THR 26 6.104 -11.686 -3.989
181 HA THR 26 HA THR 26 7.197 -9.286 -5.231
182 HB THR 26 HB THR 26 4.317 -9.867 -4.503
183 HG1 THR 26 1HG THR 26 5.929 -10.841 -6.539
184 1HG2 THR 26 1HG2 THR 26 5.569 -8.067 -6.594
185 2HG2 THR 26 2HG2 THR 26 4.881 -7.529 -5.064
186 3HG2 THR 26 3HG2 THR 26 3.842 -8.252 -6.292
187 H GLU 27 H GLU 27 7.662 -7.543 -3.954
188 HA GLU 27 HA GLU 27 6.900 -7.565 -1.151
189 1HB GLU 27 1HB GLU 27 8.195 -5.474 -1.016
190 2HB GLU 27 2HB GLU 27 8.413 -5.467 -2.749
191 1HG GLU 27 1HG GLU 27 9.580 -7.511 -0.884
192 2HG GLU 27 2HG GLU 27 10.432 -6.123 -1.539
193 H VAL 28 H VAL 28 5.050 -6.561 -0.475
194 HA VAL 28 HA VAL 28 3.944 -4.468 -2.191
195 HB VAL 28 HB VAL 28 2.336 -6.688 -0.902
196 1HG1 VAL 28 1HG1 VAL 28 1.435 -4.514 -2.764
197 2HG1 VAL 28 2HG1 VAL 28 1.051 -4.676 -1.054
198 3HG1 VAL 28 3HG1 VAL 28 0.443 -5.861 -2.210
199 1HG2 VAL 28 1HG2 VAL 28 3.009 -6.335 -3.819
200 2HG2 VAL 28 2HG2 VAL 28 1.882 -7.526 -3.171
201 3HG2 VAL 28 3HG2 VAL 28 3.595 -7.613 -2.754
202 H LEU 29 H LEU 29 2.922 -2.865 -1.092
203 HA LEU 29 HA LEU 29 3.136 -2.813 1.809
204 1HB LEU 29 1HB LEU 29 2.354 -0.707 -0.232
205 2HB LEU 29 2HB LEU 29 3.922 -0.837 0.540
206 HG LEU 29 HG LEU 29 1.357 -0.140 1.942
207 1HD1 LEU 29 1HD1 LEU 29 4.184 -0.278 2.954
208 2HD1 LEU 29 2HD1 LEU 29 2.857 -1.352 3.400
209 3HD1 LEU 29 3HD1 LEU 29 2.801 0.352 3.844
210 1HD2 LEU 29 1HD2 LEU 29 3.749 1.538 1.206
211 2HD2 LEU 29 2HD2 LEU 29 2.374 2.069 2.172
212 3HD2 LEU 29 3HD2 LEU 29 2.145 1.630 0.478
213 H ILE 30 H ILE 30 1.430 -3.671 2.805
214 HA ILE 30 HA ILE 30 -1.109 -3.693 1.381
215 HB ILE 30 HB ILE 30 -0.313 -5.069 3.970
216 1HG1 ILE 30 1HG1 ILE 30 -0.329 -7.143 2.658
217 2HG1 ILE 30 2HG1 ILE 30 0.857 -6.005 2.027
218 1HG2 ILE 30 1HG2 ILE 30 -2.424 -6.310 3.748
219 2HG2 ILE 30 2HG2 ILE 30 -2.811 -5.387 2.300
220 3HG2 ILE 30 3HG2 ILE 30 -2.716 -4.569 3.856
221 1HD1 ILE 30 1HD1 ILE 30 -0.650 -5.402 0.217
222 2HD1 ILE 30 2HD1 ILE 30 -1.866 -6.500 0.856
223 3HD1 ILE 30 3HD1 ILE 30 -0.343 -7.139 0.233
224 H VAL 31 H VAL 31 -2.313 -2.044 1.674
225 HA VAL 31 HA VAL 31 -2.195 -0.570 4.207
226 HB VAL 31 HB VAL 31 -3.218 0.335 1.518
227 1HG1 VAL 31 1HG1 VAL 31 -4.174 1.566 3.326
228 2HG1 VAL 31 2HG1 VAL 31 -3.065 2.598 2.431
229 3HG1 VAL 31 3HG1 VAL 31 -2.585 1.939 3.989
230 1HG2 VAL 31 1HG2 VAL 31 -1.159 1.636 1.232
231 2HG2 VAL 31 2HG2 VAL 31 -0.828 -0.095 1.293
232 3HG2 VAL 31 3HG2 VAL 31 -0.502 0.920 2.697
233 H ASN 32 H ASN 32 -4.039 -0.923 5.379
234 HA ASN 32 HA ASN 32 -6.426 -1.449 3.752
235 1HB ASN 32 1HB ASN 32 -6.104 -1.731 6.764
236 2HB ASN 32 2HB ASN 32 -5.988 -3.075 5.632
237 1HD2 ASN 32 1HD2 ASN 32 -7.848 -2.769 7.796
238 2HD2 ASN 32 2HD2 ASN 32 -9.429 -2.785 7.098
239 H SER 33 H SER 33 -7.232 0.411 3.142
240 HA SER 33 HA SER 33 -6.582 2.739 4.633
241 1HB SER 33 1HB SER 33 -7.429 3.903 2.718
242 2HB SER 33 2HB SER 33 -8.201 2.432 2.116
243 HG SER 33 HG SER 33 -5.652 3.278 1.767
244 H GLU 34 H GLU 34 -7.997 4.095 5.549
245 HA GLU 34 HA GLU 34 -10.297 2.861 6.725
246 1HB GLU 34 1HB GLU 34 -9.500 5.775 6.872
247 2HB GLU 34 2HB GLU 34 -8.631 4.554 7.772
248 1HG GLU 34 1HG GLU 34 -10.214 5.704 9.197
249 2HG GLU 34 2HG GLU 34 -10.631 4.007 9.044
250 H GLU 35 H GLU 35 -9.625 5.504 4.457
251 HA GLU 35 HA GLU 35 -12.433 5.980 4.054
252 1HB GLU 35 1HB GLU 35 -10.059 7.183 2.636
253 2HB GLU 35 2HB GLU 35 -10.819 7.841 4.074
254 1HG GLU 35 1HG GLU 35 -12.893 8.185 2.829
255 2HG GLU 35 2HG GLU 35 -12.145 7.505 1.388
256 H HIS 36 H HIS 36 -9.793 4.519 2.153
257 HA HIS 36 HA HIS 36 -11.675 4.280 -0.096
258 1HB HIS 36 1HB HIS 36 -9.714 3.963 -1.538
259 2HB HIS 36 2HB HIS 36 -8.669 4.066 -0.128
260 HD1 HIS 36 1HD HIS 36 -7.750 6.278 0.329
261 HD2 HIS 36 2HD HIS 36 -11.288 6.516 -1.823
262 HE1 HIS 36 1HE HIS 36 -8.064 8.715 -0.189
263 HE2 HIS 36 2HE HIS 36 -10.436 8.758 -0.909
264 H GLY 37 H GLY 37 -10.822 2.273 2.320
265 1HA GLY 37 1HA GLY 37 -11.406 -0.042 0.663
266 2HA GLY 37 2HA GLY 37 -11.346 -0.008 2.418
267 H VAL 38 H VAL 38 -10.083 -2.115 1.406
268 HA VAL 38 HA VAL 38 -7.397 -1.556 2.122
269 HB VAL 38 HB VAL 38 -8.448 -3.666 2.801
270 1HG1 VAL 38 1HG1 VAL 38 -8.806 -5.490 1.210
271 2HG1 VAL 38 2HG1 VAL 38 -8.471 -4.366 -0.112
272 3HG1 VAL 38 3HG1 VAL 38 -9.862 -4.106 0.940
273 1HG2 VAL 38 1HG2 VAL 38 -6.075 -4.102 0.987
274 2HG2 VAL 38 2HG2 VAL 38 -6.628 -5.231 2.224
275 3HG2 VAL 38 3HG2 VAL 38 -6.021 -3.641 2.687
276 H LYS 39 H LYS 39 -5.599 -1.378 0.963
277 HA LYS 39 HA LYS 39 -5.772 -1.550 -1.959
278 1HB LYS 39 1HB LYS 39 -4.136 0.333 -2.003
279 2HB LYS 39 2HB LYS 39 -4.386 0.539 -0.289
280 1HG LYS 39 1HG LYS 39 -5.660 2.184 -1.518
281 2HG LYS 39 2HG LYS 39 -6.758 1.059 -0.709
282 1HD LYS 39 1HD LYS 39 -7.107 -0.149 -2.758
283 2HD LYS 39 2HD LYS 39 -5.898 0.822 -3.592
284 1HE LYS 39 1HE LYS 39 -7.278 2.811 -3.279
285 2HE LYS 39 2HE LYS 39 -8.486 1.838 -2.444
286 1HZ LYS 39 1HZ LYS 39 -7.599 1.332 -5.233
287 2HZ LYS 39 2HZ LYS 39 -8.948 2.257 -4.827
288 3HZ LYS 39 3HZ LYS 39 -8.915 0.624 -4.441
289 H ALA 40 H ALA 40 -4.108 -2.483 -2.926
290 HA ALA 40 HA ALA 40 -1.784 -3.231 -1.304
291 1HB ALA 40 1HB ALA 40 -3.152 -4.876 -3.435
292 2HB ALA 40 2HB ALA 40 -3.194 -5.195 -1.699
293 3HB ALA 40 3HB ALA 40 -1.676 -5.325 -2.584
294 H TYR 41 H TYR 41 -0.093 -2.131 -2.085
295 HA TYR 41 HA TYR 41 0.353 -2.219 -4.895
296 1HB TYR 41 1HB TYR 41 -0.674 -0.126 -5.047
297 2HB TYR 41 2HB TYR 41 1.020 0.275 -4.964
298 HD1 TYR 41 1HD TYR 41 -2.192 0.652 -3.404
299 HD2 TYR 41 2HD TYR 41 1.977 1.244 -2.871
300 HE1 TYR 41 1HE TYR 41 -2.666 2.259 -1.609
301 HE2 TYR 41 2HE TYR 41 1.519 2.856 -1.067
302 HH TYR 41 HH TYR 41 -1.572 3.245 0.338
303 H GLN 42 H GLN 42 2.592 -1.291 -5.489
304 HA GLN 42 HA GLN 42 4.468 -2.999 -4.482
305 1HB GLN 42 1HB GLN 42 6.280 -1.403 -5.271
306 2HB GLN 42 2HB GLN 42 5.056 -0.199 -5.527
307 1HG GLN 42 1HG GLN 42 5.196 -2.799 -6.989
308 2HG GLN 42 2HG GLN 42 5.850 -1.282 -7.568
309 1HE2 GLN 42 1HE2 GLN 42 3.056 -3.165 -7.120
310 2HE2 GLN 42 2HE2 GLN 42 1.957 -2.084 -7.883
311 H ALA 43 H ALA 43 5.898 -3.145 -2.820
312 HA ALA 43 HA ALA 43 5.267 -1.756 -0.423
313 1HB ALA 43 1HB ALA 43 6.041 -4.045 -0.415
314 2HB ALA 43 2HB ALA 43 7.072 -2.991 0.573
315 3HB ALA 43 3HB ALA 43 7.607 -3.505 -1.024
316 H MET 44 H MET 44 7.979 -1.696 -2.543
317 HA MET 44 HA MET 44 9.151 0.435 -0.928
318 1HB MET 44 1HB MET 44 11.212 0.133 -2.297
319 2HB MET 44 2HB MET 44 10.395 -1.160 -3.169
320 1HG MET 44 1HG MET 44 10.180 -2.436 -1.109
321 2HG MET 44 2HG MET 44 10.937 -1.131 -0.202
322 1HE MET 44 1HE MET 44 11.496 -3.913 -2.927
323 2HE MET 44 2HE MET 44 13.194 -3.669 -3.323
324 3HE MET 44 3HE MET 44 12.004 -2.453 -3.783
325 H CYS 45 H CYS 45 9.795 2.394 -1.786
326 HA CYS 45 HA CYS 45 7.965 3.215 -3.866
327 1HB CYS 45 1HB CYS 45 7.832 4.365 -1.753
328 2HB CYS 45 2HB CYS 45 8.341 5.481 -2.997
329 HA PRO 46 HA PRO 46 11.083 4.009 -6.894
330 1HB PRO 46 1HB PRO 46 9.433 4.863 -8.283
331 2HB PRO 46 2HB PRO 46 10.332 6.363 -8.028
332 1HG PRO 46 1HG PRO 46 7.744 6.235 -7.444
333 2HG PRO 46 2HG PRO 46 8.866 7.109 -6.386
334 1HD PRO 46 1HD PRO 46 7.600 4.433 -6.012
335 2HD PRO 46 2HD PRO 46 7.944 5.705 -4.833
336 H HIS 47 H HIS 47 10.775 5.953 -4.229
337 HA HIS 47 HA HIS 47 12.982 7.653 -4.977
338 1HB HIS 47 1HB HIS 47 12.658 8.810 -2.761
339 2HB HIS 47 2HB HIS 47 11.266 7.764 -2.479
340 HD2 HIS 47 2HD HIS 47 12.236 9.866 -5.666
341 HE1 HIS 47 1HE HIS 47 8.257 10.786 -4.637
342 HE2 HIS 47 2HE HIS 47 10.164 11.225 -6.224
343 H GLN 48 H GLN 48 12.788 6.556 -1.618
344 HA GLN 48 HA GLN 48 14.626 4.443 -1.821
345 1HB GLN 48 1HB GLN 48 15.860 7.116 -1.124
346 2HB GLN 48 2HB GLN 48 16.155 6.216 -2.599
347 1HG GLN 48 1HG GLN 48 17.209 4.437 -1.359
348 2HG GLN 48 2HG GLN 48 16.852 5.258 0.162
349 1HE2 GLN 48 1HE2 GLN 48 17.937 7.108 0.664
350 2HE2 GLN 48 2HE2 GLN 48 19.422 7.566 -0.070
351 H GLU 49 H GLU 49 13.598 3.430 -0.134
352 HA GLU 49 HA GLU 49 14.327 4.216 2.462
353 1HB GLU 49 1HB GLU 49 11.382 4.523 1.874
354 2HB GLU 49 2HB GLU 49 12.496 5.854 2.068
355 1HG GLU 49 1HG GLU 49 11.767 3.795 4.169
356 2HG GLU 49 2HG GLU 49 11.226 5.474 4.133
357 H ILE 50 H ILE 50 14.018 2.666 3.929
358 HA ILE 50 HA ILE 50 12.605 0.229 3.104
359 HB ILE 50 HB ILE 50 14.177 -1.030 4.600
360 1HG1 ILE 50 1HG1 ILE 50 14.921 0.862 6.003
361 2HG1 ILE 50 2HG1 ILE 50 15.755 1.566 4.628
362 1HG2 ILE 50 1HG2 ILE 50 16.079 -1.061 3.047
363 2HG2 ILE 50 2HG2 ILE 50 15.460 0.410 2.291
364 3HG2 ILE 50 3HG2 ILE 50 14.524 -1.079 2.219
365 1HD1 ILE 50 1HD1 ILE 50 17.262 -0.351 4.547
366 2HD1 ILE 50 2HD1 ILE 50 16.436 -1.056 5.935
367 3HD1 ILE 50 3HD1 ILE 50 17.319 0.461 6.110
368 H LEU 51 H LEU 51 11.273 -0.723 4.657
369 HA LEU 51 HA LEU 51 9.810 -0.772 6.364
370 1HB LEU 51 1HB LEU 51 11.919 0.842 7.854
371 2HB LEU 51 2HB LEU 51 11.877 -0.903 7.769
372 HG LEU 51 HG LEU 51 9.795 0.808 9.128
373 1HD1 LEU 51 1HD1 LEU 51 10.126 -2.182 9.034
374 2HD1 LEU 51 2HD1 LEU 51 8.846 -1.250 8.259
375 3HD1 LEU 51 3HD1 LEU 51 8.957 -1.306 10.018
376 1HD2 LEU 51 1HD2 LEU 51 10.729 -0.087 11.198
377 2HD2 LEU 51 2HD2 LEU 51 11.931 0.846 10.305
378 3HD2 LEU 51 3HD2 LEU 51 11.985 -0.917 10.281
379 H LEU 52 H LEU 52 9.987 1.334 4.428
380 HA LEU 52 HA LEU 52 9.115 3.863 5.284
381 1HB LEU 52 1HB LEU 52 9.895 3.429 3.000
382 2HB LEU 52 2HB LEU 52 8.352 4.252 3.029
383 HG LEU 52 HG LEU 52 7.251 2.015 2.550
384 1HD1 LEU 52 1HD1 LEU 52 7.793 2.048 0.206
385 2HD1 LEU 52 2HD1 LEU 52 9.204 3.067 0.521
386 3HD1 LEU 52 3HD1 LEU 52 7.565 3.675 0.841
387 1HD2 LEU 52 1HD2 LEU 52 9.062 0.515 3.219
388 2HD2 LEU 52 2HD2 LEU 52 10.102 1.182 1.964
389 3HD2 LEU 52 3HD2 LEU 52 8.657 0.275 1.520
390 H SER 53 H SER 53 7.569 0.907 5.189
391 HA SER 53 HA SER 53 4.964 1.302 4.475
392 1HB SER 53 1HB SER 53 6.060 -0.737 4.582
393 2HB SER 53 2HB SER 53 4.712 -0.787 5.676
394 HG SER 53 HG SER 53 6.333 -1.463 7.017
395 H GLU 54 H GLU 54 6.546 1.914 7.558
396 HA GLU 54 HA GLU 54 3.912 2.279 8.772
397 1HB GLU 54 1HB GLU 54 6.547 2.218 10.234
398 2HB GLU 54 2HB GLU 54 5.672 0.753 9.806
399 1HG GLU 54 1HG GLU 54 3.774 1.472 11.107
400 2HG GLU 54 2HG GLU 54 4.563 2.993 11.480
401 H GLY 55 H GLY 55 5.291 4.236 6.950
402 1HA GLY 55 1HA GLY 55 5.496 6.492 6.724
403 2HA GLY 55 2HA GLY 55 6.337 6.450 8.269
404 H SER 56 H SER 56 3.153 6.878 6.699
405 HA SER 56 HA SER 56 1.689 7.002 9.039
406 1HB SER 56 1HB SER 56 2.784 8.870 9.626
407 2HB SER 56 2HB SER 56 1.226 9.414 8.947
408 HG SER 56 HG SER 56 3.789 9.535 7.741
409 H TYR 57 H TYR 57 -0.378 7.336 8.750
410 HA TYR 57 HA TYR 57 -1.371 7.859 6.028
411 1HB TYR 57 1HB TYR 57 -2.329 5.654 7.871
412 2HB TYR 57 2HB TYR 57 -1.483 5.439 6.349
413 HD1 TYR 57 1HD TYR 57 -2.911 7.215 4.521
414 HD2 TYR 57 2HD TYR 57 -4.432 4.714 7.593
415 HE1 TYR 57 1HE TYR 57 -5.035 7.037 3.312
416 HE2 TYR 57 2HE TYR 57 -6.567 4.533 6.398
417 HH TYR 57 HH TYR 57 -6.880 5.581 3.144
418 H GLU 58 H GLU 58 -2.593 9.621 6.075
419 HA GLU 58 HA GLU 58 -4.108 10.129 8.530
420 1HB GLU 58 1HB GLU 58 -2.930 12.168 6.641
421 2HB GLU 58 2HB GLU 58 -2.266 11.723 8.206
422 1HG GLU 58 1HG GLU 58 -4.265 12.559 9.305
423 2HG GLU 58 2HG GLU 58 -4.955 12.994 7.747
424 H GLY 59 H GLY 59 -6.121 9.501 8.091
425 1HA GLY 59 1HA GLY 59 -7.765 11.118 6.447
426 2HA GLY 59 2HA GLY 59 -8.278 9.715 7.362
427 H GLY 60 H GLY 60 -6.595 10.615 4.495
428 1HA GLY 60 1HA GLY 60 -8.043 9.535 2.508
429 2HA GLY 60 2HA GLY 60 -7.217 8.113 3.143
430 H VAL 61 H VAL 61 -4.977 10.128 3.857
431 HA VAL 61 HA VAL 61 -3.686 9.946 1.243
432 HB VAL 61 HB VAL 61 -3.381 12.169 3.297
433 1HG1 VAL 61 1HG1 VAL 61 -1.752 13.150 1.755
434 2HG1 VAL 61 2HG1 VAL 61 -1.853 11.717 0.734
435 3HG1 VAL 61 3HG1 VAL 61 -1.195 11.593 2.368
436 1HG2 VAL 61 1HG2 VAL 61 -4.298 12.206 0.427
437 2HG2 VAL 61 2HG2 VAL 61 -4.126 13.617 1.469
438 3HG2 VAL 61 3HG2 VAL 61 -5.329 12.377 1.846
439 H ILE 62 H ILE 62 -1.918 8.634 1.269
440 HA ILE 62 HA ILE 62 -0.831 7.996 3.861
441 HB ILE 62 HB ILE 62 0.359 6.156 2.850
442 1HG1 ILE 62 1HG1 ILE 62 -0.496 7.282 0.209
443 2HG1 ILE 62 2HG1 ILE 62 -0.256 5.545 0.353
444 1HG2 ILE 62 1HG2 ILE 62 -2.488 6.159 1.970
445 2HG2 ILE 62 2HG2 ILE 62 -1.829 5.623 3.517
446 3HG2 ILE 62 3HG2 ILE 62 -1.462 4.729 2.042
447 1HD1 ILE 62 1HD1 ILE 62 1.734 6.643 -0.520
448 2HD1 ILE 62 2HD1 ILE 62 2.050 5.899 1.046
449 3HD1 ILE 62 3HD1 ILE 62 1.830 7.645 0.931
450 H THR 63 H THR 63 1.222 8.420 4.454
451 HA THR 63 HA THR 63 2.706 10.185 2.654
452 HB THR 63 HB THR 63 2.641 10.103 5.680
453 HG1 THR 63 1HG THR 63 1.048 11.248 3.895
454 1HG2 THR 63 1HG2 THR 63 4.029 12.025 3.796
455 2HG2 THR 63 2HG2 THR 63 4.831 10.815 4.794
456 3HG2 THR 63 3HG2 THR 63 3.983 12.164 5.553
457 H CYS 64 H CYS 64 4.655 9.391 2.045
458 HA CYS 64 HA CYS 64 5.472 6.862 3.020
459 1HB CYS 64 1HB CYS 64 7.090 8.764 1.283
460 2HB CYS 64 2HB CYS 64 5.930 7.596 0.654
461 H ARG 65 H ARG 65 7.550 6.444 3.997
462 HA ARG 65 HA ARG 65 7.815 8.071 6.310
463 1HB ARG 65 1HB ARG 65 9.521 5.751 5.451
464 2HB ARG 65 2HB ARG 65 7.964 5.546 6.229
465 1HG ARG 65 1HG ARG 65 9.507 5.183 7.923
466 2HG ARG 65 2HG ARG 65 8.942 6.825 8.195
467 1HD ARG 65 1HD ARG 65 10.933 7.719 7.123
468 2HD ARG 65 2HD ARG 65 11.522 6.079 6.851
469 HE ARG 65 HE ARG 65 10.902 6.783 9.575
470 1HH1 ARG 65 1HH1 ARG 65 13.409 6.422 7.092
471 2HH1 ARG 65 2HH1 ARG 65 14.700 6.420 8.198
472 1HH2 ARG 65 1HH2 ARG 65 12.655 6.759 11.073
473 2HH2 ARG 65 2HH2 ARG 65 14.268 6.597 10.544
474 H ALA 66 H ALA 66 9.673 7.704 3.330
475 HA ALA 66 HA ALA 66 11.827 9.261 4.419
476 1HB ALA 66 1HB ALA 66 11.432 8.217 1.621
477 2HB ALA 66 2HB ALA 66 12.421 7.505 2.920
478 3HB ALA 66 3HB ALA 66 12.867 9.051 2.217
479 H HIS 67 H HIS 67 10.069 9.826 1.330
480 HA HIS 67 HA HIS 67 10.307 12.628 1.974
481 1HB HIS 67 1HB HIS 67 10.243 11.337 -0.465
482 2HB HIS 67 2HB HIS 67 9.970 13.053 -0.286
483 HD2 HIS 67 2HD HIS 67 7.454 13.982 -0.861
484 HE1 HIS 67 1HE HIS 67 5.758 10.336 -2.054
485 HE2 HIS 67 2HE HIS 67 5.554 12.859 -2.053
486 H LEU 68 H LEU 68 9.011 13.591 3.407
487 HA LEU 68 HA LEU 68 6.434 12.408 3.991
488 1HB LEU 68 1HB LEU 68 6.232 14.143 5.791
489 2HB LEU 68 2HB LEU 68 7.808 14.738 5.347
490 HG LEU 68 HG LEU 68 7.343 11.957 6.398
491 1HD1 LEU 68 1HD1 LEU 68 9.846 13.586 6.112
492 2HD1 LEU 68 2HD1 LEU 68 9.388 12.193 5.131
493 3HD1 LEU 68 3HD1 LEU 68 9.728 11.991 6.852
494 1HD2 LEU 68 1HD2 LEU 68 8.174 12.802 8.535
495 2HD2 LEU 68 2HD2 LEU 68 6.657 13.569 8.070
496 3HD2 LEU 68 3HD2 LEU 68 8.179 14.438 7.881
497 H TRP 69 H TRP 69 5.335 12.848 2.170
498 HA TRP 69 HA TRP 69 4.126 15.474 2.147
499 1HB TRP 69 1HB TRP 69 4.209 15.498 -0.405
500 2HB TRP 69 2HB TRP 69 5.410 14.225 -0.302
501 HD1 TRP 69 HD TRP 69 7.905 14.932 0.636
502 HE1 TRP 69 1HE TRP 69 9.067 17.191 0.679
503 HE3 TRP 69 3HE TRP 69 3.834 17.972 -0.036
504 HZ2 TRP 69 2HZ TRP 69 8.399 19.901 0.491
505 HZ3 TRP 69 3HZ TRP 69 4.207 20.397 -0.080
506 HH2 TRP 69 HH TRP 69 6.446 21.338 0.180
507 H THR 70 H THR 70 2.500 15.029 -0.141
508 HA THR 70 HA THR 70 0.788 13.056 1.077
509 HB THR 70 HB THR 70 -0.963 14.329 -0.247
510 HG1 THR 70 1HG THR 70 0.101 16.595 -0.577
511 1HG2 THR 70 1HG2 THR 70 0.681 15.898 1.757
512 2HG2 THR 70 2HG2 THR 70 -0.552 14.719 2.180
513 3HG2 THR 70 3HG2 THR 70 -1.004 16.209 1.343
514 H PHE 71 H PHE 71 0.014 11.359 -0.007
515 HA PHE 71 HA PHE 71 0.483 11.056 -2.876
516 1HB PHE 71 1HB PHE 71 0.914 8.975 -0.710
517 2HB PHE 71 2HB PHE 71 2.214 9.843 -1.504
518 HD1 PHE 71 1HD PHE 71 -0.391 7.292 -1.986
519 HD2 PHE 71 2HD PHE 71 3.013 9.233 -3.632
520 HE1 PHE 71 1HE PHE 71 -0.228 5.547 -3.685
521 HE2 PHE 71 2HE PHE 71 3.176 7.488 -5.348
522 HZ PHE 71 HZ PHE 71 1.553 5.642 -5.374
523 H ASN 72 H ASN 72 -1.280 9.868 -3.874
524 HA ASN 72 HA ASN 72 -3.697 10.161 -2.335
525 1HB ASN 72 1HB ASN 72 -3.400 9.247 -5.196
526 2HB ASN 72 2HB ASN 72 -3.477 10.933 -4.721
527 1HD2 ASN 72 1HD2 ASN 72 -5.320 11.218 -5.977
528 2HD2 ASN 72 2HD2 ASN 72 -6.853 10.650 -5.457
529 H ASP 73 H ASP 73 -4.338 8.648 -1.099
530 HA ASP 73 HA ASP 73 -3.586 5.904 -1.146
531 1HB ASP 73 1HB ASP 73 -5.536 7.576 0.418
532 2HB ASP 73 2HB ASP 73 -3.968 7.018 0.930
533 H GLY 74 H GLY 74 -5.948 7.596 -2.877
534 1HA GLY 74 1HA GLY 74 -8.084 6.932 -3.601
535 2HA GLY 74 2HA GLY 74 -7.769 5.320 -2.988
536 H THR 75 H THR 75 -5.536 7.089 -5.073
537 HA THR 75 HA THR 75 -6.379 5.389 -7.312
538 HB THR 75 HB THR 75 -5.180 7.047 -8.729
539 HG1 THR 75 1HG THR 75 -4.835 9.112 -7.486
540 1HG2 THR 75 1HG2 THR 75 -7.603 7.268 -8.347
541 2HG2 THR 75 2HG2 THR 75 -6.839 8.853 -8.468
542 3HG2 THR 75 3HG2 THR 75 -7.284 8.209 -6.889
543 H GLY 76 H GLY 76 -3.679 6.094 -5.213
544 1HA GLY 76 1HA GLY 76 -2.110 4.032 -6.526
545 2HA GLY 76 2HA GLY 76 -1.725 4.849 -5.014
546 H HIS 77 H HIS 77 -2.488 7.357 -6.692
547 HA HIS 77 HA HIS 77 0.023 7.692 -8.179
548 1HB HIS 77 1HB HIS 77 -2.558 9.284 -8.191
549 2HB HIS 77 2HB HIS 77 -2.184 8.017 -9.342
550 HD1 HIS 77 1HD HIS 77 -2.034 11.593 -9.026
551 HD2 HIS 77 2HD HIS 77 0.199 8.646 -10.869
552 HE1 HIS 77 1HE HIS 77 -0.795 12.762 -10.814
553 HE2 HIS 77 2HE HIS 77 0.801 11.048 -11.684
554 H GLY 78 H GLY 78 1.367 9.513 -7.605
555 1HA GLY 78 1HA GLY 78 2.342 10.832 -6.016
556 2HA GLY 78 2HA GLY 78 1.101 10.328 -4.881
557 H ILE 79 H ILE 79 0.864 12.453 -4.087
558 HA ILE 79 HA ILE 79 -0.645 14.220 -5.856
559 HB ILE 79 HB ILE 79 -0.056 14.459 -2.879
560 1HG1 ILE 79 1HG1 ILE 79 -2.415 13.879 -2.511
561 2HG1 ILE 79 2HG1 ILE 79 -1.574 12.582 -3.344
562 1HG2 ILE 79 1HG2 ILE 79 -1.892 16.114 -4.606
563 2HG2 ILE 79 2HG2 ILE 79 -0.372 16.642 -3.888
564 3HG2 ILE 79 3HG2 ILE 79 -1.745 16.235 -2.852
565 1HD1 ILE 79 1HD1 ILE 79 -3.381 14.594 -4.658
566 2HD1 ILE 79 2HD1 ILE 79 -3.815 12.946 -4.229
567 3HD1 ILE 79 3HD1 ILE 79 -2.577 13.236 -5.454
568 H ASN 80 H ASN 80 2.107 14.219 -3.638
569 HA ASN 80 HA ASN 80 3.526 15.816 -5.549
570 1HB ASN 80 1HB ASN 80 3.408 16.605 -2.651
571 2HB ASN 80 2HB ASN 80 2.566 17.474 -3.938
572 1HD2 ASN 80 1HD2 ASN 80 5.600 16.891 -2.368
573 2HD2 ASN 80 2HD2 ASN 80 6.505 18.069 -3.237
574 HA PRO 81 HA PRO 81 5.097 15.691 -6.497
575 1HB PRO 81 1HB PRO 81 7.089 15.215 -7.496
576 2HB PRO 81 2HB PRO 81 6.590 13.541 -7.738
577 1HG PRO 81 1HG PRO 81 8.131 14.750 -5.506
578 2HG PRO 81 2HG PRO 81 8.212 13.107 -6.164
579 1HD PRO 81 1HD PRO 81 7.035 13.589 -3.816
580 2HD PRO 81 2HD PRO 81 6.372 12.394 -4.950
581 H ASP 82 H ASP 82 3.595 15.337 -8.149
582 HA ASP 82 HA ASP 82 1.933 12.992 -7.997
583 1HB ASP 82 1HB ASP 82 0.963 15.215 -8.586
584 2HB ASP 82 2HB ASP 82 0.588 13.980 -9.777
585 H ASP 83 H ASP 83 4.740 13.773 -9.520
586 HA ASP 83 HA ASP 83 4.719 12.401 -11.958
587 1HB ASP 83 1HB ASP 83 6.951 12.729 -10.015
588 2HB ASP 83 2HB ASP 83 6.485 13.967 -11.172
589 H CYS 84 H CYS 84 4.929 11.241 -8.651
590 HA CYS 84 HA CYS 84 5.931 8.661 -9.406
591 1HB CYS 84 1HB CYS 84 6.120 8.305 -7.067
592 2HB CYS 84 2HB CYS 84 5.170 9.734 -6.715
593 HG CYS 84 HG CYS 84 8.069 10.021 -8.463
594 H CYS 85 H CYS 85 4.835 6.868 -8.923
595 HA CYS 85 HA CYS 85 2.288 6.738 -7.747
596 1HB CYS 85 1HB CYS 85 1.305 7.373 -9.738
597 2HB CYS 85 2HB CYS 85 1.279 5.612 -9.723
598 HG CYS 85 HG CYS 85 4.011 6.262 -11.224
599 H LEU 86 H LEU 86 1.487 4.706 -7.538
600 HA LEU 86 HA LEU 86 3.299 2.396 -7.953
601 1HB LEU 86 1HB LEU 86 2.468 1.545 -5.714
602 2HB LEU 86 2HB LEU 86 1.843 3.140 -5.386
603 HG LEU 86 HG LEU 86 4.760 2.520 -5.811
604 1HD1 LEU 86 1HD1 LEU 86 3.488 5.011 -4.720
605 2HD1 LEU 86 2HD1 LEU 86 4.269 4.829 -6.288
606 3HD1 LEU 86 3HD1 LEU 86 5.219 4.687 -4.809
607 1HD2 LEU 86 1HD2 LEU 86 3.285 2.901 -3.224
608 2HD2 LEU 86 2HD2 LEU 86 5.035 2.757 -3.399
609 3HD2 LEU 86 3HD2 LEU 86 3.995 1.400 -3.824
610 H ALA 87 H ALA 87 2.324 0.635 -8.581
611 HA ALA 87 HA ALA 87 -0.350 0.966 -9.632
612 1HB ALA 87 1HB ALA 87 0.096 -1.217 -10.725
613 2HB ALA 87 2HB ALA 87 1.650 -1.277 -9.874
614 3HB ALA 87 3HB ALA 87 1.337 -0.010 -11.058
615 H GLU 88 H GLU 88 -2.136 0.217 -8.585
616 HA GLU 88 HA GLU 88 -1.725 -1.414 -6.250
617 1HB GLU 88 1HB GLU 88 -3.205 0.520 -6.036
618 2HB GLU 88 2HB GLU 88 -4.078 -0.968 -5.733
619 1HG GLU 88 1HG GLU 88 -5.064 -0.878 -7.937
620 2HG GLU 88 2HG GLU 88 -4.167 0.594 -8.302
621 H TYR 89 H TYR 89 -2.582 -3.352 -5.883
622 HA TYR 89 HA TYR 89 -3.178 -4.987 -8.231
623 1HB TYR 89 1HB TYR 89 -2.540 -6.855 -6.857
624 2HB TYR 89 2HB TYR 89 -2.533 -5.867 -5.409
625 HD1 TYR 89 1HD TYR 89 -0.742 -6.304 -8.626
626 HD2 TYR 89 2HD TYR 89 -0.592 -4.908 -4.633
627 HE1 TYR 89 1HE TYR 89 1.702 -5.928 -8.849
628 HE2 TYR 89 2HE TYR 89 1.817 -4.526 -4.832
629 HH TYR 89 HH TYR 89 3.697 -5.428 -6.204
630 HA PRO 90 HA PRO 90 -7.446 -5.358 -6.715
631 1HB PRO 90 1HB PRO 90 -8.423 -6.930 -8.131
632 2HB PRO 90 2HB PRO 90 -7.150 -8.120 -7.824
633 1HG PRO 90 1HG PRO 90 -7.093 -5.699 -9.601
634 2HG PRO 90 2HG PRO 90 -6.600 -7.361 -9.983
635 1HD PRO 90 1HD PRO 90 -4.803 -5.517 -9.342
636 2HD PRO 90 2HD PRO 90 -4.639 -7.185 -8.744
637 H VAL 91 H VAL 91 -7.891 -5.761 -4.688
638 HA VAL 91 HA VAL 91 -6.693 -8.057 -3.360
639 HB VAL 91 HB VAL 91 -5.478 -6.144 -2.623
640 1HG1 VAL 91 1HG1 VAL 91 -8.122 -4.837 -2.071
641 2HG1 VAL 91 2HG1 VAL 91 -6.958 -4.393 -3.320
642 3HG1 VAL 91 3HG1 VAL 91 -6.553 -4.173 -1.619
643 1HG2 VAL 91 1HG2 VAL 91 -7.542 -6.793 -0.522
644 2HG2 VAL 91 2HG2 VAL 91 -5.957 -6.078 -0.217
645 3HG2 VAL 91 3HG2 VAL 91 -6.084 -7.723 -0.845
646 H GLU 92 H GLU 92 -7.963 -9.255 -2.153
647 HA GLU 92 HA GLU 92 -10.821 -8.553 -1.996
648 1HB GLU 92 1HB GLU 92 -11.182 -10.972 -1.877
649 2HB GLU 92 2HB GLU 92 -9.467 -11.171 -2.000
650 1HG GLU 92 1HG GLU 92 -10.547 -11.624 -4.169
651 2HG GLU 92 2HG GLU 92 -9.531 -10.189 -4.283
652 H VAL 93 H VAL 93 -11.322 -8.041 -0.073
653 HA VAL 93 HA VAL 93 -10.129 -9.498 2.154
654 HB VAL 93 HB VAL 93 -9.697 -7.124 2.338
655 1HG1 VAL 93 1HG1 VAL 93 -11.514 -6.201 1.052
656 2HG1 VAL 93 2HG1 VAL 93 -11.477 -5.451 2.646
657 3HG1 VAL 93 3HG1 VAL 93 -12.679 -6.692 2.282
658 1HG2 VAL 93 1HG2 VAL 93 -10.616 -6.671 4.583
659 2HG2 VAL 93 2HG2 VAL 93 -10.036 -8.337 4.426
660 3HG2 VAL 93 3HG2 VAL 93 -11.762 -7.991 4.351
661 H LYS 94 H LYS 94 -11.344 -11.099 2.731
662 HA LYS 94 HA LYS 94 -14.203 -10.651 3.007
663 1HB LYS 94 1HB LYS 94 -13.869 -11.938 0.906
664 2HB LYS 94 2HB LYS 94 -14.782 -12.841 2.086
665 1HG LYS 94 1HG LYS 94 -13.177 -14.218 0.799
666 2HG LYS 94 2HG LYS 94 -12.949 -14.303 2.540
667 1HD LYS 94 1HD LYS 94 -11.101 -12.777 2.429
668 2HD LYS 94 2HD LYS 94 -11.322 -12.569 0.697
669 1HE LYS 94 1HE LYS 94 -9.511 -14.095 1.441
670 2HE LYS 94 2HE LYS 94 -10.586 -14.701 0.227
671 1HZ LYS 94 1HZ LYS 94 -11.688 -16.056 1.918
672 2HZ LYS 94 2HZ LYS 94 -10.894 -15.261 3.140
673 3HZ LYS 94 3HZ LYS 94 -10.017 -16.272 2.119
674 H GLY 95 H GLY 95 -14.843 -10.971 4.976
675 1HA GLY 95 1HA GLY 95 -13.844 -13.069 6.609
676 2HA GLY 95 2HA GLY 95 -14.836 -11.715 7.150
677 H ASP 96 H ASP 96 -11.979 -13.139 7.553
678 HA ASP 96 HA ASP 96 -10.650 -10.611 8.338
679 1HB ASP 96 1HB ASP 96 -9.912 -13.379 9.268
680 2HB ASP 96 2HB ASP 96 -11.162 -12.482 10.104
681 H ASP 97 H ASP 97 -10.733 -12.774 5.896
682 HA ASP 97 HA ASP 97 -7.805 -13.145 5.771
683 1HB ASP 97 1HB ASP 97 -9.999 -14.516 4.247
684 2HB ASP 97 2HB ASP 97 -9.286 -15.115 5.746
685 H ILE 98 H ILE 98 -6.635 -12.478 4.063
686 HA ILE 98 HA ILE 98 -8.016 -10.738 2.135
687 HB ILE 98 HB ILE 98 -5.523 -10.103 3.700
688 1HG1 ILE 98 1HG1 ILE 98 -7.678 -9.722 4.846
689 2HG1 ILE 98 2HG1 ILE 98 -8.159 -8.651 3.523
690 1HG2 ILE 98 1HG2 ILE 98 -5.212 -9.345 1.381
691 2HG2 ILE 98 2HG2 ILE 98 -5.445 -7.959 2.441
692 3HG2 ILE 98 3HG2 ILE 98 -6.773 -8.525 1.430
693 1HD1 ILE 98 1HD1 ILE 98 -6.412 -7.111 4.038
694 2HD1 ILE 98 2HD1 ILE 98 -5.873 -8.144 5.364
695 3HD1 ILE 98 3HD1 ILE 98 -7.463 -7.380 5.431
696 H TYR 99 H TYR 99 -7.679 -11.378 0.187
697 HA TYR 99 HA TYR 99 -5.095 -12.571 -0.575
698 1HB TYR 99 1HB TYR 99 -6.220 -12.907 -2.823
699 2HB TYR 99 2HB TYR 99 -7.710 -12.455 -2.054
700 HD1 TYR 99 1HD TYR 99 -9.075 -14.037 -1.115
701 HD2 TYR 99 2HD TYR 99 -5.014 -14.983 -1.830
702 HE1 TYR 99 1HE TYR 99 -9.534 -16.391 -0.586
703 HE2 TYR 99 2HE TYR 99 -5.456 -17.341 -1.295
704 HH TYR 99 HH TYR 99 -8.609 -18.539 -1.077
705 H VAL 100 H VAL 100 -3.870 -11.647 -2.141
706 HA VAL 100 HA VAL 100 -4.841 -9.216 -3.448
707 HB VAL 100 HB VAL 100 -2.592 -8.196 -3.288
708 1HG1 VAL 100 1HG1 VAL 100 -2.535 -7.635 -0.910
709 2HG1 VAL 100 2HG1 VAL 100 -3.700 -8.926 -0.598
710 3HG1 VAL 100 3HG1 VAL 100 -4.149 -7.549 -1.607
711 1HG2 VAL 100 1HG2 VAL 100 -0.859 -9.112 -1.782
712 2HG2 VAL 100 2HG2 VAL 100 -1.215 -10.202 -3.123
713 3HG2 VAL 100 3HG2 VAL 100 -1.867 -10.538 -1.523
714 H SER 101 H SER 101 -4.362 -9.233 -5.664
715 HA SER 101 HA SER 101 -2.802 -11.597 -6.411
716 1HB SER 101 1HB SER 101 -4.691 -10.041 -8.190
717 2HB SER 101 2HB SER 101 -5.147 -11.489 -7.294
718 HG SER 101 HG SER 101 -3.391 -11.224 -9.481
719 H THR 102 H THR 102 -0.798 -11.156 -6.797
720 HA THR 102 HA THR 102 -0.078 -8.578 -7.855
721 HB THR 102 HB THR 102 2.249 -9.460 -7.372
722 HG1 THR 102 1HG THR 102 2.194 -11.556 -7.170
723 1HG2 THR 102 1HG2 THR 102 2.026 -9.169 -4.946
724 2HG2 THR 102 2HG2 THR 102 0.284 -9.406 -5.071
725 3HG2 THR 102 3HG2 THR 102 1.036 -7.989 -5.806
726 H LYS 103 H LYS 103 -0.067 -11.983 -8.604
727 HA LYS 103 HA LYS 103 1.466 -11.840 -10.953
728 1HB LYS 103 1HB LYS 103 -0.668 -13.852 -10.204
729 2HB LYS 103 2HB LYS 103 1.001 -13.935 -9.668
730 1HG LYS 103 1HG LYS 103 0.075 -14.116 -12.529
731 2HG LYS 103 2HG LYS 103 0.591 -15.469 -11.517
732 1HD LYS 103 1HD LYS 103 2.795 -14.408 -11.268
733 2HD LYS 103 2HD LYS 103 2.292 -13.120 -12.360
734 1HE LYS 103 1HE LYS 103 3.601 -14.723 -13.587
735 2HE LYS 103 2HE LYS 103 1.927 -14.775 -14.130
736 1HZ LYS 103 1HZ LYS 103 1.580 -16.787 -12.830
737 2HZ LYS 103 2HZ LYS 103 3.126 -16.695 -12.205
738 3HZ LYS 103 3HZ LYS 103 2.910 -16.993 -13.840
739 H GLY 104 H GLY 104 0.934 -10.710 -12.665
740 1HA GLY 104 1HA GLY 104 -1.906 -10.424 -13.377
741 2HA GLY 104 2HA GLY 104 -0.666 -10.756 -14.584
742 H ILE 105 H ILE 105 -0.272 -8.663 -11.805
743 HA ILE 105 HA ILE 105 -0.499 -6.320 -13.542
744 HB ILE 105 HB ILE 105 -0.453 -6.455 -10.513
745 1HG1 ILE 105 1HG1 ILE 105 -2.755 -5.905 -12.406
746 2HG1 ILE 105 2HG1 ILE 105 -2.824 -5.499 -10.701
747 1HG2 ILE 105 1HG2 ILE 105 -0.999 -4.049 -10.536
748 2HG2 ILE 105 2HG2 ILE 105 -0.821 -4.048 -12.289
749 3HG2 ILE 105 3HG2 ILE 105 0.570 -4.397 -11.264
750 1HD1 ILE 105 1HD1 ILE 105 -2.494 -8.279 -11.799
751 2HD1 ILE 105 2HD1 ILE 105 -3.977 -7.569 -11.148
752 3HD1 ILE 105 3HD1 ILE 105 -2.585 -7.819 -10.094
753 H LEU 106 H LEU 106 1.301 -5.406 -14.219
754 HA LEU 106 HA LEU 106 3.826 -6.319 -13.229
755 1HB LEU 106 1HB LEU 106 3.299 -4.075 -15.190
756 2HB LEU 106 2HB LEU 106 3.124 -5.739 -15.672
757 HG LEU 106 HG LEU 106 5.513 -6.138 -15.338
758 1HD1 LEU 106 1HD1 LEU 106 4.704 -5.460 -17.500
759 2HD1 LEU 106 2HD1 LEU 106 6.320 -4.819 -17.211
760 3HD1 LEU 106 3HD1 LEU 106 4.913 -3.764 -17.068
761 1HD2 LEU 106 1HD2 LEU 106 5.694 -3.187 -14.747
762 2HD2 LEU 106 2HD2 LEU 106 7.061 -4.279 -14.979
763 3HD2 LEU 106 3HD2 LEU 106 5.993 -4.480 -13.588
764 HA PRO 107 HA PRO 107 3.956 -3.158 -9.929
765 1HB PRO 107 1HB PRO 107 5.687 -4.174 -8.862
766 2HB PRO 107 2HB PRO 107 6.750 -3.166 -9.844
767 1HG PRO 107 1HG PRO 107 6.801 -5.862 -9.953
768 2HG PRO 107 2HG PRO 107 7.172 -4.840 -11.353
769 1HD PRO 107 1HD PRO 107 4.658 -6.320 -10.701
770 2HD PRO 107 2HD PRO 107 5.500 -6.129 -12.251
771 H ASN 108 H ASN 108 4.304 -1.009 -9.861
772 HA ASN 108 HA ASN 108 4.960 0.292 -12.347
773 1HB ASN 108 1HB ASN 108 4.357 1.534 -9.641
774 2HB ASN 108 2HB ASN 108 3.086 0.934 -10.678
775 1HD2 ASN 108 1HD2 ASN 108 2.021 2.807 -10.964
776 2HD2 ASN 108 2HD2 ASN 108 2.648 4.147 -11.815
777 H LYS 109 H LYS 109 6.476 2.410 -11.813
778 HA LYS 109 HA LYS 109 9.069 1.363 -11.713
779 1HB LYS 109 1HB LYS 109 9.852 3.665 -11.674
780 2HB LYS 109 2HB LYS 109 8.220 4.201 -11.311
781 1HG LYS 109 1HG LYS 109 7.421 3.457 -13.448
782 2HG LYS 109 2HG LYS 109 8.981 2.723 -13.825
783 1HD LYS 109 1HD LYS 109 8.689 4.879 -14.957
784 2HD LYS 109 2HD LYS 109 10.044 4.911 -13.832
785 1HE LYS 109 1HE LYS 109 8.595 6.006 -12.162
786 2HE LYS 109 2HE LYS 109 7.304 6.062 -13.363
787 1HZ LYS 109 1HZ LYS 109 8.533 8.141 -13.242
788 2HZ LYS 109 2HZ LYS 109 8.712 7.433 -14.762
789 3HZ LYS 109 3HZ LYS 109 9.958 7.354 -13.649
790 H ALA 110 H ALA 110 7.105 2.083 -9.228
791 HA ALA 110 HA ALA 110 8.764 2.922 -7.144
792 1HB ALA 110 1HB ALA 110 6.398 1.077 -6.978
793 2HB ALA 110 2HB ALA 110 6.340 2.840 -7.003
794 3HB ALA 110 3HB ALA 110 7.096 1.999 -5.642
795 H HIS 111 H HIS 111 8.227 -0.217 -8.487
796 HA HIS 111 HA HIS 111 10.252 -1.270 -6.621
797 1HB HIS 111 1HB HIS 111 8.280 -2.928 -8.220
798 2HB HIS 111 2HB HIS 111 8.091 -2.513 -6.517
799 HD1 HIS 111 1HD HIS 111 9.868 -4.920 -8.787
800 HD2 HIS 111 2HD HIS 111 9.938 -3.806 -4.777
801 HE1 HIS 111 1HE HIS 111 11.199 -6.659 -7.636
802 HE2 HIS 111 2HE HIS 111 10.684 -6.202 -5.230
803 H SER 112 H SER 112 12.139 -0.970 -7.575
804 HA SER 112 HA SER 112 12.406 -1.842 -10.340
805 1HB SER 112 1HB SER 112 14.417 -0.436 -10.383
806 2HB SER 112 2HB SER 112 14.191 -0.054 -8.675
807 HG SER 112 HG SER 112 11.953 0.574 -9.604
Start of MODEL 13
1 1H MET 1 1HT MET 1 0.393 -17.860 -5.348
2 2H MET 1 2HT MET 1 -1.147 -18.517 -5.557
3 3H MET 1 3HT MET 1 -0.988 -16.934 -5.066
4 HA MET 1 HA MET 1 -0.010 -16.356 -7.188
5 1HB MET 1 1HB MET 1 1.011 -18.567 -7.669
6 2HB MET 1 2HB MET 1 0.037 -17.994 -9.002
7 1HG MET 1 1HG MET 1 -0.274 -20.380 -8.695
8 2HG MET 1 2HG MET 1 -1.772 -19.513 -8.372
9 1HE MET 1 1HE MET 1 -1.292 -22.548 -7.548
10 2HE MET 1 2HE MET 1 -2.799 -21.686 -7.223
11 3HE MET 1 3HE MET 1 -1.991 -22.569 -5.930
12 H SER 2 H SER 2 -1.460 -15.205 -8.356
13 HA SER 2 HA SER 2 -3.406 -14.289 -8.949
14 1HB SER 2 1HB SER 2 -5.131 -15.757 -9.930
15 2HB SER 2 2HB SER 2 -4.381 -17.161 -9.165
16 HG SER 2 HG SER 2 -3.082 -17.267 -10.764
17 H PHE 3 H PHE 3 -3.777 -13.277 -7.085
18 HA PHE 3 HA PHE 3 -4.572 -12.724 -5.072
19 1HB PHE 3 1HB PHE 3 -6.709 -13.848 -4.203
20 2HB PHE 3 2HB PHE 3 -6.691 -14.816 -5.665
21 HD1 PHE 3 1HD PHE 3 -6.702 -11.291 -4.514
22 HD2 PHE 3 2HD PHE 3 -7.756 -14.045 -7.578
23 HE1 PHE 3 1HE PHE 3 -7.935 -9.513 -5.681
24 HE2 PHE 3 2HE PHE 3 -8.988 -12.272 -8.749
25 HZ PHE 3 HZ PHE 3 -9.078 -10.003 -7.802
26 H GLU 4 H GLU 4 -3.109 -13.059 -3.699
27 HA GLU 4 HA GLU 4 -2.484 -15.795 -2.830
28 1HB GLU 4 1HB GLU 4 -0.898 -13.232 -2.585
29 2HB GLU 4 2HB GLU 4 -0.731 -14.364 -3.916
30 1HG GLU 4 1HG GLU 4 -0.193 -15.040 -1.042
31 2HG GLU 4 2HG GLU 4 1.035 -14.587 -2.223
32 H LYS 5 H LYS 5 -2.999 -16.301 -0.747
33 HA LYS 5 HA LYS 5 -4.153 -14.366 1.038
34 1HB LYS 5 1HB LYS 5 -3.150 -17.173 1.626
35 2HB LYS 5 2HB LYS 5 -4.790 -16.780 1.128
36 1HG LYS 5 1HG LYS 5 -4.951 -17.161 3.442
37 2HG LYS 5 2HG LYS 5 -5.004 -15.414 3.256
38 1HD LYS 5 1HD LYS 5 -2.606 -15.291 3.816
39 2HD LYS 5 2HD LYS 5 -2.596 -17.026 4.089
40 1HE LYS 5 1HE LYS 5 -4.209 -14.997 5.634
41 2HE LYS 5 2HE LYS 5 -2.754 -15.823 6.182
42 1HZ LYS 5 1HZ LYS 5 -4.633 -16.883 7.130
43 2HZ LYS 5 2HZ LYS 5 -4.008 -17.954 5.985
44 3HZ LYS 5 3HZ LYS 5 -5.390 -17.029 5.651
45 H ILE 6 H ILE 6 -3.173 -12.981 1.911
46 HA ILE 6 HA ILE 6 -0.335 -13.258 2.440
47 HB ILE 6 HB ILE 6 -2.172 -10.884 2.533
48 1HG1 ILE 6 1HG1 ILE 6 -0.871 -10.085 0.611
49 2HG1 ILE 6 2HG1 ILE 6 -1.669 -11.617 0.276
50 1HG2 ILE 6 1HG2 ILE 6 -0.171 -9.525 2.887
51 2HG2 ILE 6 2HG2 ILE 6 0.784 -11.001 3.027
52 3HG2 ILE 6 3HG2 ILE 6 -0.463 -10.642 4.222
53 1HD1 ILE 6 1HD1 ILE 6 0.563 -11.566 -0.656
54 2HD1 ILE 6 2HD1 ILE 6 0.428 -12.809 0.578
55 3HD1 ILE 6 3HD1 ILE 6 1.247 -11.286 0.944
56 H CYS 7 H CYS 7 -3.242 -12.111 4.082
57 HA CYS 7 HA CYS 7 -2.341 -13.330 6.544
58 1HB CYS 7 1HB CYS 7 -2.533 -11.222 7.835
59 2HB CYS 7 2HB CYS 7 -2.622 -10.326 6.329
60 HG CYS 7 HG CYS 7 -0.164 -10.339 7.852
61 H SER 8 H SER 8 -3.890 -12.482 8.349
62 HA SER 8 HA SER 8 -6.592 -12.682 7.407
63 1HB SER 8 1HB SER 8 -6.262 -14.349 9.099
64 2HB SER 8 2HB SER 8 -6.952 -12.969 9.909
65 HG SER 8 HG SER 8 -5.219 -13.598 11.108
66 H LEU 9 H LEU 9 -8.145 -11.290 8.285
67 HA LEU 9 HA LEU 9 -7.555 -8.546 8.281
68 1HB LEU 9 1HB LEU 9 -9.869 -9.943 9.559
69 2HB LEU 9 2HB LEU 9 -9.731 -9.683 7.850
70 HG LEU 9 HG LEU 9 -10.013 -7.535 9.983
71 1HD1 LEU 9 1HD1 LEU 9 -8.658 -6.727 8.120
72 2HD1 LEU 9 2HD1 LEU 9 -10.248 -5.963 8.125
73 3HD1 LEU 9 3HD1 LEU 9 -9.898 -7.258 6.983
74 1HD2 LEU 9 1HD2 LEU 9 -11.936 -8.514 7.878
75 2HD2 LEU 9 2HD2 LEU 9 -12.212 -7.156 8.960
76 3HD2 LEU 9 3HD2 LEU 9 -12.069 -8.789 9.615
77 H ASP 10 H ASP 10 -7.337 -10.844 10.729
78 HA ASP 10 HA ASP 10 -7.245 -9.019 12.983
79 1HB ASP 10 1HB ASP 10 -6.539 -11.948 12.772
80 2HB ASP 10 2HB ASP 10 -8.050 -11.259 13.345
81 H ASP 11 H ASP 11 -5.022 -9.887 10.596
82 HA ASP 11 HA ASP 11 -2.740 -9.252 12.329
83 1HB ASP 11 1HB ASP 11 -2.705 -10.073 9.419
84 2HB ASP 11 2HB ASP 11 -2.561 -11.217 10.751
85 H ILE 12 H ILE 12 -4.409 -8.159 9.458
86 HA ILE 12 HA ILE 12 -3.064 -5.576 9.693
87 HB ILE 12 HB ILE 12 -2.547 -6.272 7.643
88 1HG1 ILE 12 1HG1 ILE 12 -5.031 -4.638 7.184
89 2HG1 ILE 12 2HG1 ILE 12 -3.879 -5.005 5.921
90 1HG2 ILE 12 1HG2 ILE 12 -4.087 -7.320 5.958
91 2HG2 ILE 12 2HG2 ILE 12 -5.317 -7.343 7.232
92 3HG2 ILE 12 3HG2 ILE 12 -3.830 -8.269 7.425
93 1HD1 ILE 12 1HD1 ILE 12 -2.109 -3.861 7.176
94 2HD1 ILE 12 2HD1 ILE 12 -3.258 -3.498 8.462
95 3HD1 ILE 12 3HD1 ILE 12 -3.470 -2.782 6.867
96 H TRP 13 H TRP 13 -4.126 -4.097 10.544
97 HA TRP 13 HA TRP 13 -7.015 -4.352 10.872
98 1HB TRP 13 1HB TRP 13 -6.654 -2.733 12.754
99 2HB TRP 13 2HB TRP 13 -4.933 -2.866 12.429
100 HD1 TRP 13 HD TRP 13 -3.957 -5.507 12.537
101 HE1 TRP 13 1HE TRP 13 -4.549 -7.301 14.289
102 HE3 TRP 13 3HE TRP 13 -8.313 -3.534 14.286
103 HZ2 TRP 13 2HZ TRP 13 -6.580 -7.803 16.166
104 HZ3 TRP 13 3HZ TRP 13 -9.527 -4.723 16.063
105 HH2 TRP 13 HH TRP 13 -8.678 -6.811 16.981
106 H VAL 14 H VAL 14 -8.207 -2.317 11.083
107 HA VAL 14 HA VAL 14 -7.842 -0.751 8.750
108 HB VAL 14 HB VAL 14 -10.101 -1.302 9.513
109 1HG1 VAL 14 1HG1 VAL 14 -9.530 0.406 11.920
110 2HG1 VAL 14 2HG1 VAL 14 -9.756 -1.340 11.904
111 3HG1 VAL 14 3HG1 VAL 14 -11.100 -0.275 11.491
112 1HG2 VAL 14 1HG2 VAL 14 -9.843 0.707 8.197
113 2HG2 VAL 14 2HG2 VAL 14 -9.558 1.651 9.660
114 3HG2 VAL 14 3HG2 VAL 14 -11.134 0.915 9.378
115 H GLY 15 H GLY 15 -6.879 1.132 8.486
116 1HA GLY 15 1HA GLY 15 -6.204 2.766 10.818
117 2HA GLY 15 2HA GLY 15 -6.128 3.277 9.128
118 H GLU 16 H GLU 16 -4.957 0.218 9.444
119 HA GLU 16 HA GLU 16 -2.228 1.057 10.026
120 1HB GLU 16 1HB GLU 16 -1.836 -1.389 10.376
121 2HB GLU 16 2HB GLU 16 -3.525 -1.661 10.008
122 1HG GLU 16 1HG GLU 16 -3.126 -1.713 12.399
123 2HG GLU 16 2HG GLU 16 -4.210 -0.399 11.953
124 H MET 17 H MET 17 -0.610 0.651 8.591
125 HA MET 17 HA MET 17 -1.279 -0.689 6.100
126 1HB MET 17 1HB MET 17 -1.382 1.733 5.658
127 2HB MET 17 2HB MET 17 -0.084 0.929 4.795
128 1HG MET 17 1HG MET 17 0.677 3.086 5.570
129 2HG MET 17 2HG MET 17 1.568 1.788 6.350
130 1HE MET 17 1HE MET 17 2.558 3.345 8.154
131 2HE MET 17 2HE MET 17 1.607 4.473 9.122
132 3HE MET 17 3HE MET 17 1.750 4.707 7.382
133 H GLU 18 H GLU 18 0.250 -2.026 5.461
134 HA GLU 18 HA GLU 18 2.846 -1.585 6.282
135 1HB GLU 18 1HB GLU 18 2.450 -2.459 8.347
136 2HB GLU 18 2HB GLU 18 3.212 -3.788 7.491
137 1HG GLU 18 1HG GLU 18 1.111 -4.884 7.154
138 2HG GLU 18 2HG GLU 18 0.251 -3.522 7.882
139 H THR 19 H THR 19 4.473 -3.240 5.535
140 HA THR 19 HA THR 19 3.490 -4.111 2.972
141 HB THR 19 HB THR 19 5.596 -2.708 3.008
142 HG1 THR 19 1HG THR 19 6.881 -4.390 1.799
143 1HG2 THR 19 1HG2 THR 19 6.769 -5.146 4.309
144 2HG2 THR 19 2HG2 THR 19 6.623 -3.538 5.060
145 3HG2 THR 19 3HG2 THR 19 7.696 -3.792 3.675
146 H PHE 20 H PHE 20 3.475 -6.094 2.340
147 HA PHE 20 HA PHE 20 4.280 -8.167 4.229
148 1HB PHE 20 1HB PHE 20 2.339 -9.496 3.416
149 2HB PHE 20 2HB PHE 20 1.784 -8.083 2.539
150 HD1 PHE 20 1HD PHE 20 0.236 -6.672 3.521
151 HD2 PHE 20 2HD PHE 20 2.654 -9.136 5.993
152 HE1 PHE 20 1HE PHE 20 -1.044 -5.956 5.474
153 HE2 PHE 20 2HE PHE 20 1.367 -8.424 7.952
154 HZ PHE 20 HZ PHE 20 -0.482 -6.833 7.699
155 H GLU 21 H GLU 21 4.805 -10.154 3.154
156 HA GLU 21 HA GLU 21 5.678 -9.626 0.415
157 1HB GLU 21 1HB GLU 21 6.938 -11.441 2.468
158 2HB GLU 21 2HB GLU 21 7.507 -9.828 2.064
159 1HG GLU 21 1HG GLU 21 7.957 -10.558 -0.217
160 2HG GLU 21 2HG GLU 21 7.406 -12.180 0.196
161 H THR 22 H THR 22 5.268 -11.116 -1.086
162 HA THR 22 HA THR 22 3.196 -13.066 -0.503
163 HB THR 22 HB THR 22 3.187 -13.502 -2.922
164 HG1 THR 22 1HG THR 22 4.690 -12.389 -4.238
165 1HG2 THR 22 1HG2 THR 22 2.670 -11.253 -3.758
166 2HG2 THR 22 2HG2 THR 22 3.485 -10.546 -2.369
167 3HG2 THR 22 3HG2 THR 22 1.999 -11.475 -2.138
168 H SER 23 H SER 23 3.548 -15.369 -1.562
169 HA SER 23 HA SER 23 5.767 -16.557 -0.318
170 1HB SER 23 1HB SER 23 4.920 -18.592 -1.307
171 2HB SER 23 2HB SER 23 3.929 -17.638 -2.413
172 HG SER 23 HG SER 23 3.744 -17.563 0.418
173 H ASP 24 H ASP 24 5.274 -15.104 -3.387
174 HA ASP 24 HA ASP 24 7.458 -16.438 -4.748
175 1HB ASP 24 1HB ASP 24 5.963 -13.943 -5.535
176 2HB ASP 24 2HB ASP 24 5.388 -15.561 -5.903
177 H GLY 25 H GLY 25 7.102 -13.918 -2.538
178 1HA GLY 25 1HA GLY 25 9.891 -13.166 -2.949
179 2HA GLY 25 2HA GLY 25 8.949 -12.875 -1.495
180 H THR 26 H THR 26 6.713 -11.796 -3.241
181 HA THR 26 HA THR 26 7.862 -9.322 -4.254
182 HB THR 26 HB THR 26 4.947 -10.127 -4.076
183 HG1 THR 26 1HG THR 26 6.790 -10.623 -6.209
184 1HG2 THR 26 1HG2 THR 26 4.700 -8.595 -5.984
185 2HG2 THR 26 2HG2 THR 26 6.430 -8.253 -5.937
186 3HG2 THR 26 3HG2 THR 26 5.398 -7.762 -4.594
187 H GLU 27 H GLU 27 8.030 -7.546 -2.843
188 HA GLU 27 HA GLU 27 6.486 -7.607 -0.390
189 1HB GLU 27 1HB GLU 27 7.650 -5.518 0.193
190 2HB GLU 27 2HB GLU 27 8.380 -5.450 -1.392
191 1HG GLU 27 1HG GLU 27 9.679 -7.440 -0.918
192 2HG GLU 27 2HG GLU 27 8.912 -7.570 0.667
193 H VAL 28 H VAL 28 4.656 -6.505 -0.129
194 HA VAL 28 HA VAL 28 3.911 -4.475 -2.116
195 HB VAL 28 HB VAL 28 2.096 -6.576 -0.949
196 1HG1 VAL 28 1HG1 VAL 28 0.930 -4.547 -1.538
197 2HG1 VAL 28 2HG1 VAL 28 0.475 -5.837 -2.658
198 3HG1 VAL 28 3HG1 VAL 28 1.613 -4.589 -3.164
199 1HG2 VAL 28 1HG2 VAL 28 3.622 -7.687 -2.468
200 2HG2 VAL 28 2HG2 VAL 28 3.255 -6.517 -3.737
201 3HG2 VAL 28 3HG2 VAL 28 2.008 -7.634 -3.178
202 H LEU 29 H LEU 29 2.740 -2.789 -1.187
203 HA LEU 29 HA LEU 29 2.835 -2.567 1.756
204 1HB LEU 29 1HB LEU 29 2.056 -0.486 -0.275
205 2HB LEU 29 2HB LEU 29 3.737 -0.887 -0.038
206 HG LEU 29 HG LEU 29 3.062 1.148 1.131
207 1HD1 LEU 29 1HD1 LEU 29 1.733 1.086 3.154
208 2HD1 LEU 29 2HD1 LEU 29 1.313 -0.594 2.811
209 3HD1 LEU 29 3HD1 LEU 29 0.802 0.685 1.711
210 1HD2 LEU 29 1HD2 LEU 29 4.115 0.653 3.226
211 2HD2 LEU 29 2HD2 LEU 29 4.949 -0.162 1.900
212 3HD2 LEU 29 3HD2 LEU 29 3.878 -1.072 2.970
213 H ILE 30 H ILE 30 0.983 -3.134 2.706
214 HA ILE 30 HA ILE 30 -1.542 -2.910 1.225
215 HB ILE 30 HB ILE 30 -0.751 -4.754 3.495
216 1HG1 ILE 30 1HG1 ILE 30 -1.967 -5.238 0.808
217 2HG1 ILE 30 2HG1 ILE 30 -1.698 -6.524 1.983
218 1HG2 ILE 30 1HG2 ILE 30 -2.904 -3.868 4.132
219 2HG2 ILE 30 2HG2 ILE 30 -3.063 -5.555 3.642
220 3HG2 ILE 30 3HG2 ILE 30 -3.568 -4.268 2.548
221 1HD1 ILE 30 1HD1 ILE 30 0.747 -6.134 1.800
222 2HD1 ILE 30 2HD1 ILE 30 0.408 -4.907 0.591
223 3HD1 ILE 30 3HD1 ILE 30 -0.009 -6.588 0.273
224 H VAL 31 H VAL 31 -2.899 -1.375 1.781
225 HA VAL 31 HA VAL 31 -2.646 -0.198 4.474
226 HB VAL 31 HB VAL 31 -3.819 1.048 1.973
227 1HG1 VAL 31 1HG1 VAL 31 -3.178 2.266 4.646
228 2HG1 VAL 31 2HG1 VAL 31 -4.778 1.926 4.000
229 3HG1 VAL 31 3HG1 VAL 31 -3.756 3.144 3.231
230 1HG2 VAL 31 1HG2 VAL 31 -1.421 0.784 1.675
231 2HG2 VAL 31 2HG2 VAL 31 -1.122 1.602 3.214
232 3HG2 VAL 31 3HG2 VAL 31 -1.840 2.484 1.869
233 H ASN 32 H ASN 32 -4.399 -0.782 5.744
234 HA ASN 32 HA ASN 32 -6.871 -1.297 4.269
235 1HB ASN 32 1HB ASN 32 -6.218 -1.940 7.161
236 2HB ASN 32 2HB ASN 32 -6.175 -3.091 5.831
237 1HD2 ASN 32 1HD2 ASN 32 -7.754 -3.221 8.219
238 2HD2 ASN 32 2HD2 ASN 32 -9.411 -3.272 7.744
239 H SER 33 H SER 33 -7.973 0.460 3.947
240 HA SER 33 HA SER 33 -7.942 2.566 5.964
241 1HB SER 33 1HB SER 33 -8.822 3.970 4.195
242 2HB SER 33 2HB SER 33 -8.950 2.573 3.120
243 HG SER 33 HG SER 33 -6.573 2.390 3.712
244 H GLU 34 H GLU 34 -9.850 3.428 6.762
245 HA GLU 34 HA GLU 34 -11.911 1.639 7.348
246 1HB GLU 34 1HB GLU 34 -11.853 4.648 7.579
247 2HB GLU 34 2HB GLU 34 -11.266 3.513 8.781
248 1HG GLU 34 1HG GLU 34 -13.519 2.662 9.105
249 2HG GLU 34 2HG GLU 34 -14.122 3.799 7.900
250 H GLU 35 H GLU 35 -11.855 4.391 5.100
251 HA GLU 35 HA GLU 35 -14.537 3.648 4.237
252 1HB GLU 35 1HB GLU 35 -12.914 6.127 3.673
253 2HB GLU 35 2HB GLU 35 -14.142 5.964 4.909
254 1HG GLU 35 1HG GLU 35 -15.825 5.588 3.185
255 2HG GLU 35 2HG GLU 35 -14.585 5.814 1.950
256 H HIS 36 H HIS 36 -11.294 4.120 2.937
257 HA HIS 36 HA HIS 36 -12.132 3.521 0.245
258 1HB HIS 36 1HB HIS 36 -9.323 3.802 1.374
259 2HB HIS 36 2HB HIS 36 -10.277 5.108 0.701
260 HD1 HIS 36 1HD HIS 36 -7.448 4.302 -0.402
261 HD2 HIS 36 2HD HIS 36 -11.102 3.194 -2.061
262 HE1 HIS 36 1HE HIS 36 -6.976 3.796 -2.787
263 HE2 HIS 36 2HE HIS 36 -9.247 3.572 -3.802
264 H GLY 37 H GLY 37 -11.413 1.600 2.916
265 1HA GLY 37 1HA GLY 37 -11.544 -0.746 1.243
266 2HA GLY 37 2HA GLY 37 -11.629 -0.709 2.998
267 H VAL 38 H VAL 38 -10.132 -2.613 1.745
268 HA VAL 38 HA VAL 38 -7.471 -1.756 2.562
269 HB VAL 38 HB VAL 38 -8.277 -3.648 3.880
270 1HG1 VAL 38 1HG1 VAL 38 -8.753 -5.845 2.885
271 2HG1 VAL 38 2HG1 VAL 38 -8.638 -5.122 1.280
272 3HG1 VAL 38 3HG1 VAL 38 -9.902 -4.603 2.396
273 1HG2 VAL 38 1HG2 VAL 38 -6.151 -4.523 1.926
274 2HG2 VAL 38 2HG2 VAL 38 -6.471 -5.275 3.488
275 3HG2 VAL 38 3HG2 VAL 38 -5.896 -3.612 3.412
276 H LYS 39 H LYS 39 -6.050 -1.380 1.138
277 HA LYS 39 HA LYS 39 -6.319 -2.692 -1.438
278 1HB LYS 39 1HB LYS 39 -5.862 0.252 -1.014
279 2HB LYS 39 2HB LYS 39 -7.395 -0.487 -1.435
280 1HG LYS 39 1HG LYS 39 -6.340 -1.331 -3.522
281 2HG LYS 39 2HG LYS 39 -4.943 -0.322 -3.108
282 1HD LYS 39 1HD LYS 39 -6.365 1.636 -3.019
283 2HD LYS 39 2HD LYS 39 -7.773 0.632 -3.336
284 1HE LYS 39 1HE LYS 39 -5.460 1.017 -5.245
285 2HE LYS 39 2HE LYS 39 -7.008 1.861 -5.338
286 1HZ LYS 39 1HZ LYS 39 -6.944 -0.015 -6.863
287 2HZ LYS 39 2HZ LYS 39 -8.121 -0.236 -5.688
288 3HZ LYS 39 3HZ LYS 39 -6.700 -1.089 -5.593
289 H ALA 40 H ALA 40 -4.363 -2.828 -2.615
290 HA ALA 40 HA ALA 40 -1.986 -2.602 -0.897
291 1HB ALA 40 1HB ALA 40 -1.121 -4.555 -2.072
292 2HB ALA 40 2HB ALA 40 -2.615 -4.640 -3.015
293 3HB ALA 40 3HB ALA 40 -2.654 -4.908 -1.278
294 H TYR 41 H TYR 41 -0.147 -1.826 -1.768
295 HA TYR 41 HA TYR 41 -0.195 -0.832 -4.545
296 1HB TYR 41 1HB TYR 41 0.810 1.257 -3.792
297 2HB TYR 41 2HB TYR 41 0.871 0.683 -2.134
298 HD1 TYR 41 1HD TYR 41 -1.020 0.819 -0.697
299 HD2 TYR 41 2HD TYR 41 -1.392 1.882 -4.800
300 HE1 TYR 41 1HE TYR 41 -3.215 1.807 -0.228
301 HE2 TYR 41 2HE TYR 41 -3.599 2.882 -4.337
302 HH TYR 41 HH TYR 41 -4.704 3.478 -1.171
303 H GLN 42 H GLN 42 2.053 -0.664 -5.434
304 HA GLN 42 HA GLN 42 3.816 -2.646 -4.519
305 1HB GLN 42 1HB GLN 42 4.101 -1.615 -6.883
306 2HB GLN 42 2HB GLN 42 5.539 -1.705 -5.939
307 1HG GLN 42 1HG GLN 42 5.539 0.584 -5.476
308 2HG GLN 42 2HG GLN 42 3.930 0.779 -6.176
309 1HE2 GLN 42 1HE2 GLN 42 3.723 0.872 -8.420
310 2HE2 GLN 42 2HE2 GLN 42 5.136 0.919 -9.429
311 H ALA 43 H ALA 43 5.537 -2.668 -3.132
312 HA ALA 43 HA ALA 43 5.539 -0.511 -1.191
313 1HB ALA 43 1HB ALA 43 5.513 -2.842 -0.417
314 2HB ALA 43 2HB ALA 43 6.952 -1.993 0.142
315 3HB ALA 43 3HB ALA 43 7.060 -3.119 -1.213
316 H MET 44 H MET 44 7.056 -1.206 -3.957
317 HA MET 44 HA MET 44 9.652 -0.141 -3.184
318 1HB MET 44 1HB MET 44 10.368 -0.612 -5.485
319 2HB MET 44 2HB MET 44 8.751 -1.172 -5.864
320 1HG MET 44 1HG MET 44 10.500 -2.416 -3.777
321 2HG MET 44 2HG MET 44 10.393 -2.977 -5.441
322 1HE MET 44 1HE MET 44 9.900 -5.322 -4.493
323 2HE MET 44 2HE MET 44 8.526 -5.733 -3.474
324 3HE MET 44 3HE MET 44 9.855 -4.769 -2.819
325 H CYS 45 H CYS 45 9.450 1.974 -2.852
326 HA CYS 45 HA CYS 45 8.245 3.782 -4.745
327 1HB CYS 45 1HB CYS 45 9.340 5.523 -3.443
328 2HB CYS 45 2HB CYS 45 10.373 4.334 -2.668
329 HA PRO 46 HA PRO 46 12.072 4.067 -7.164
330 1HB PRO 46 1HB PRO 46 10.728 5.065 -8.804
331 2HB PRO 46 2HB PRO 46 11.747 6.441 -8.374
332 1HG PRO 46 1HG PRO 46 9.074 6.579 -8.243
333 2HG PRO 46 2HG PRO 46 10.100 7.409 -7.060
334 1HD PRO 46 1HD PRO 46 8.404 5.013 -6.726
335 2HD PRO 46 2HD PRO 46 8.975 6.171 -5.511
336 H HIS 47 H HIS 47 11.669 5.105 -4.399
337 HA HIS 47 HA HIS 47 13.720 7.164 -4.246
338 1HB HIS 47 1HB HIS 47 12.454 8.051 -2.207
339 2HB HIS 47 2HB HIS 47 11.155 6.913 -2.614
340 HD2 HIS 47 2HD HIS 47 13.116 9.280 -4.997
341 HE1 HIS 47 1HE HIS 47 9.023 9.932 -5.658
342 HE2 HIS 47 2HE HIS 47 11.357 10.651 -6.174
343 H GLN 48 H GLN 48 14.248 7.148 -1.627
344 HA GLN 48 HA GLN 48 15.778 4.793 -1.358
345 1HB GLN 48 1HB GLN 48 16.388 5.703 0.850
346 2HB GLN 48 2HB GLN 48 15.125 6.915 0.683
347 1HG GLN 48 1HG GLN 48 16.264 7.786 -1.311
348 2HG GLN 48 2HG GLN 48 17.543 6.601 -1.075
349 1HE2 GLN 48 1HE2 GLN 48 19.099 8.142 -0.837
350 2HE2 GLN 48 2HE2 GLN 48 19.230 9.121 0.571
351 H GLU 49 H GLU 49 14.819 2.886 -1.070
352 HA GLU 49 HA GLU 49 12.417 2.747 0.480
353 1HB GLU 49 1HB GLU 49 12.425 1.475 -1.576
354 2HB GLU 49 2HB GLU 49 12.262 0.392 -0.208
355 1HG GLU 49 1HG GLU 49 14.631 -0.187 -0.381
356 2HG GLU 49 2HG GLU 49 14.768 0.864 -1.791
357 H ILE 50 H ILE 50 12.072 1.125 2.055
358 HA ILE 50 HA ILE 50 13.928 -0.090 3.663
359 HB ILE 50 HB ILE 50 14.664 2.336 3.998
360 1HG1 ILE 50 1HG1 ILE 50 13.475 1.153 6.559
361 2HG1 ILE 50 2HG1 ILE 50 14.677 2.413 6.456
362 1HG2 ILE 50 1HG2 ILE 50 11.912 2.778 5.087
363 2HG2 ILE 50 2HG2 ILE 50 12.618 3.473 3.627
364 3HG2 ILE 50 3HG2 ILE 50 13.254 3.919 5.211
365 1HD1 ILE 50 1HD1 ILE 50 15.068 -0.384 5.459
366 2HD1 ILE 50 2HD1 ILE 50 15.679 0.276 6.975
367 3HD1 ILE 50 3HD1 ILE 50 16.259 0.915 5.439
368 H LEU 51 H LEU 51 12.156 0.416 6.085
369 HA LEU 51 HA LEU 51 9.799 -0.738 4.975
370 1HB LEU 51 1HB LEU 51 8.914 -0.641 7.333
371 2HB LEU 51 2HB LEU 51 10.434 0.053 7.834
372 HG LEU 51 HG LEU 51 10.246 -2.322 8.392
373 1HD1 LEU 51 1HD1 LEU 51 10.316 -4.042 6.676
374 2HD1 LEU 51 2HD1 LEU 51 10.128 -2.807 5.433
375 3HD1 LEU 51 3HD1 LEU 51 8.840 -3.079 6.609
376 1HD2 LEU 51 1HD2 LEU 51 12.483 -1.417 8.038
377 2HD2 LEU 51 2HD2 LEU 51 12.370 -1.772 6.316
378 3HD2 LEU 51 3HD2 LEU 51 12.399 -3.091 7.485
379 H LEU 52 H LEU 52 8.889 0.693 3.647
380 HA LEU 52 HA LEU 52 8.326 3.434 4.367
381 1HB LEU 52 1HB LEU 52 6.935 3.516 2.343
382 2HB LEU 52 2HB LEU 52 7.053 1.784 2.157
383 HG LEU 52 HG LEU 52 8.422 3.291 0.634
384 1HD1 LEU 52 1HD1 LEU 52 10.121 3.464 3.056
385 2HD1 LEU 52 2HD1 LEU 52 9.289 4.778 2.224
386 3HD1 LEU 52 3HD1 LEU 52 10.626 3.925 1.429
387 1HD2 LEU 52 1HD2 LEU 52 9.801 1.032 2.073
388 2HD2 LEU 52 2HD2 LEU 52 10.292 1.709 0.522
389 3HD2 LEU 52 3HD2 LEU 52 8.737 0.892 0.675
390 H SER 53 H SER 53 7.021 0.463 4.807
391 HA SER 53 HA SER 53 4.292 0.830 5.132
392 1HB SER 53 1HB SER 53 5.509 -1.143 4.663
393 2HB SER 53 2HB SER 53 4.574 -1.465 6.055
394 HG SER 53 HG SER 53 6.502 -1.932 6.918
395 H GLU 54 H GLU 54 6.972 1.722 7.145
396 HA GLU 54 HA GLU 54 5.243 1.964 9.498
397 1HB GLU 54 1HB GLU 54 7.291 2.324 10.734
398 2HB GLU 54 2HB GLU 54 8.220 2.303 9.252
399 1HG GLU 54 1HG GLU 54 7.709 -0.016 8.902
400 2HG GLU 54 2HG GLU 54 6.659 -0.020 10.324
401 H GLY 55 H GLY 55 5.641 3.770 6.941
402 1HA GLY 55 1HA GLY 55 5.778 5.988 6.422
403 2HA GLY 55 2HA GLY 55 6.742 6.214 7.869
404 H SER 56 H SER 56 3.762 6.819 6.403
405 HA SER 56 HA SER 56 2.462 7.244 8.947
406 1HB SER 56 1HB SER 56 3.054 9.466 7.049
407 2HB SER 56 2HB SER 56 3.723 9.234 8.684
408 HG SER 56 HG SER 56 1.411 10.328 7.865
409 H TYR 57 H TYR 57 0.454 7.776 8.829
410 HA TYR 57 HA TYR 57 -1.099 7.253 6.333
411 1HB TYR 57 1HB TYR 57 -1.690 6.121 9.094
412 2HB TYR 57 2HB TYR 57 -1.107 5.179 7.734
413 HD1 TYR 57 1HD TYR 57 -2.613 4.346 6.073
414 HD2 TYR 57 2HD TYR 57 -4.015 7.089 9.004
415 HE1 TYR 57 1HE TYR 57 -4.937 3.904 5.383
416 HE2 TYR 57 2HE TYR 57 -6.325 6.651 8.319
417 HH TYR 57 HH TYR 57 -7.496 5.887 6.336
418 H GLU 58 H GLU 58 -1.985 9.042 5.916
419 HA GLU 58 HA GLU 58 -3.458 10.359 8.025
420 1HB GLU 58 1HB GLU 58 -3.234 12.436 6.591
421 2HB GLU 58 2HB GLU 58 -2.107 11.507 5.591
422 1HG GLU 58 1HG GLU 58 -0.675 11.162 7.546
423 2HG GLU 58 2HG GLU 58 -1.772 12.144 8.506
424 H GLY 59 H GLY 59 -5.372 11.587 6.955
425 1HA GLY 59 1HA GLY 59 -7.467 11.301 6.129
426 2HA GLY 59 2HA GLY 59 -7.102 9.593 5.956
427 H GLY 60 H GLY 60 -5.736 9.074 4.109
428 1HA GLY 60 1HA GLY 60 -6.780 10.475 1.714
429 2HA GLY 60 2HA GLY 60 -6.390 8.759 1.765
430 H VAL 61 H VAL 61 -4.070 10.156 3.508
431 HA VAL 61 HA VAL 61 -2.328 10.580 1.214
432 HB VAL 61 HB VAL 61 -2.423 12.097 3.821
433 1HG1 VAL 61 1HG1 VAL 61 -0.422 12.325 1.551
434 2HG1 VAL 61 2HG1 VAL 61 -0.090 11.682 3.158
435 3HG1 VAL 61 3HG1 VAL 61 -0.488 13.388 2.959
436 1HG2 VAL 61 1HG2 VAL 61 -2.780 14.081 2.397
437 2HG2 VAL 61 2HG2 VAL 61 -4.060 12.885 2.215
438 3HG2 VAL 61 3HG2 VAL 61 -2.810 13.033 0.979
439 H ILE 62 H ILE 62 -0.817 9.064 1.235
440 HA ILE 62 HA ILE 62 -0.068 7.956 3.842
441 HB ILE 62 HB ILE 62 0.257 6.662 1.106
442 1HG1 ILE 62 1HG1 ILE 62 -1.576 5.140 1.735
443 2HG1 ILE 62 2HG1 ILE 62 -2.119 6.813 1.676
444 1HG2 ILE 62 1HG2 ILE 62 0.629 5.514 3.877
445 2HG2 ILE 62 2HG2 ILE 62 1.911 5.899 2.732
446 3HG2 ILE 62 3HG2 ILE 62 0.764 4.610 2.370
447 1HD1 ILE 62 1HD1 ILE 62 -2.049 6.963 4.086
448 2HD1 ILE 62 2HD1 ILE 62 -1.464 5.301 4.183
449 3HD1 ILE 62 3HD1 ILE 62 -3.082 5.632 3.564
450 H THR 63 H THR 63 2.059 8.067 4.368
451 HA THR 63 HA THR 63 3.812 9.220 2.326
452 HB THR 63 HB THR 63 4.003 9.611 5.323
453 HG1 THR 63 1HG THR 63 3.203 11.350 3.200
454 1HG2 THR 63 1HG2 THR 63 6.194 9.662 4.198
455 2HG2 THR 63 2HG2 THR 63 5.735 11.269 4.764
456 3HG2 THR 63 3HG2 THR 63 5.577 10.860 3.056
457 H CYS 64 H CYS 64 5.179 7.792 1.616
458 HA CYS 64 HA CYS 64 5.854 5.534 3.186
459 1HB CYS 64 1HB CYS 64 5.655 4.728 1.098
460 2HB CYS 64 2HB CYS 64 7.313 5.302 0.888
461 H ARG 65 H ARG 65 8.239 7.677 1.368
462 HA ARG 65 HA ARG 65 9.351 8.192 3.969
463 1HB ARG 65 1HB ARG 65 11.064 6.926 1.843
464 2HB ARG 65 2HB ARG 65 10.531 6.153 3.336
465 1HG ARG 65 1HG ARG 65 11.746 7.829 4.626
466 2HG ARG 65 2HG ARG 65 12.281 8.596 3.135
467 1HD ARG 65 1HD ARG 65 13.446 6.562 2.496
468 2HD ARG 65 2HD ARG 65 12.920 5.792 3.995
469 HE ARG 65 HE ARG 65 14.169 8.119 4.727
470 1HH1 ARG 65 1HH1 ARG 65 15.063 5.192 3.000
471 2HH1 ARG 65 2HH1 ARG 65 16.693 5.198 3.481
472 1HH2 ARG 65 1HH2 ARG 65 16.437 8.171 5.402
473 2HH2 ARG 65 2HH2 ARG 65 17.493 6.935 4.888
474 H ALA 66 H ALA 66 10.112 8.728 0.460
475 HA ALA 66 HA ALA 66 10.593 11.488 1.202
476 1HB ALA 66 1HB ALA 66 12.790 9.831 0.005
477 2HB ALA 66 2HB ALA 66 12.710 10.395 1.675
478 3HB ALA 66 3HB ALA 66 12.849 11.559 0.356
479 H HIS 67 H HIS 67 10.316 12.878 -0.314
480 HA HIS 67 HA HIS 67 10.905 13.125 -2.841
481 1HB HIS 67 1HB HIS 67 9.596 11.158 -3.601
482 2HB HIS 67 2HB HIS 67 8.915 12.620 -4.276
483 HD2 HIS 67 2HD HIS 67 6.457 13.454 -3.095
484 HE1 HIS 67 1HE HIS 67 5.486 9.588 -1.724
485 HE2 HIS 67 2HE HIS 67 4.614 11.791 -2.548
486 H LEU 68 H LEU 68 8.574 13.492 -0.421
487 HA LEU 68 HA LEU 68 8.870 16.139 -0.042
488 1HB LEU 68 1HB LEU 68 6.338 15.648 -1.636
489 2HB LEU 68 2HB LEU 68 7.742 16.515 -2.233
490 HG LEU 68 HG LEU 68 6.103 17.366 0.152
491 1HD1 LEU 68 1HD1 LEU 68 7.246 19.507 -0.124
492 2HD1 LEU 68 2HD1 LEU 68 8.247 18.794 -1.391
493 3HD1 LEU 68 3HD1 LEU 68 8.347 18.187 0.260
494 1HD2 LEU 68 1HD2 LEU 68 4.740 17.485 -1.843
495 2HD2 LEU 68 2HD2 LEU 68 6.008 18.377 -2.682
496 3HD2 LEU 68 3HD2 LEU 68 5.180 19.104 -1.304
497 H TRP 69 H TRP 69 5.886 14.225 -0.355
498 HA TRP 69 HA TRP 69 5.670 13.476 2.337
499 1HB TRP 69 1HB TRP 69 4.404 16.114 1.594
500 2HB TRP 69 2HB TRP 69 5.464 15.772 2.942
501 HD1 TRP 69 HD TRP 69 3.867 13.379 4.330
502 HE1 TRP 69 1HE TRP 69 1.580 13.900 5.491
503 HE3 TRP 69 3HE TRP 69 2.702 17.785 2.011
504 HZ2 TRP 69 2HZ TRP 69 -0.355 15.874 5.449
505 HZ3 TRP 69 3HZ TRP 69 0.620 18.932 2.640
506 HH2 TRP 69 HH TRP 69 -0.878 17.993 4.324
507 H THR 70 H THR 70 3.676 14.566 -0.472
508 HA THR 70 HA THR 70 1.649 12.676 0.359
509 HB THR 70 HB THR 70 0.302 13.969 -1.300
510 HG1 THR 70 1HG THR 70 1.317 16.186 -1.525
511 1HG2 THR 70 1HG2 THR 70 -0.038 15.845 0.266
512 2HG2 THR 70 2HG2 THR 70 1.468 15.425 1.081
513 3HG2 THR 70 3HG2 THR 70 0.104 14.313 1.119
514 H PHE 71 H PHE 71 1.165 10.882 -0.756
515 HA PHE 71 HA PHE 71 0.999 11.222 -3.594
516 1HB PHE 71 1HB PHE 71 2.884 9.485 -3.106
517 2HB PHE 71 2HB PHE 71 1.599 8.923 -4.146
518 HD1 PHE 71 1HD PHE 71 -0.064 7.323 -3.399
519 HD2 PHE 71 2HD PHE 71 3.293 8.381 -1.012
520 HE1 PHE 71 1HE PHE 71 -0.367 5.271 -2.091
521 HE2 PHE 71 2HE PHE 71 2.988 6.331 0.312
522 HZ PHE 71 HZ PHE 71 1.162 4.773 -0.227
523 H ASN 72 H ASN 72 -1.043 10.306 -4.386
524 HA ASN 72 HA ASN 72 -2.857 10.548 -2.131
525 1HB ASN 72 1HB ASN 72 -3.579 10.427 -5.063
526 2HB ASN 72 2HB ASN 72 -3.268 11.912 -4.168
527 1HD2 ASN 72 1HD2 ASN 72 -5.752 11.028 -5.502
528 2HD2 ASN 72 2HD2 ASN 72 -6.927 11.047 -4.248
529 H ASP 73 H ASP 73 -3.787 8.985 -1.153
530 HA ASP 73 HA ASP 73 -3.495 6.262 -1.864
531 1HB ASP 73 1HB ASP 73 -5.290 7.648 0.127
532 2HB ASP 73 2HB ASP 73 -3.759 6.851 0.451
533 H GLY 74 H GLY 74 -6.070 8.590 -2.302
534 1HA GLY 74 1HA GLY 74 -8.203 8.317 -3.220
535 2HA GLY 74 2HA GLY 74 -7.911 6.587 -3.299
536 H THR 75 H THR 75 -5.369 7.038 -4.745
537 HA THR 75 HA THR 75 -6.487 7.102 -7.396
538 HB THR 75 HB THR 75 -4.381 9.169 -6.661
539 HG1 THR 75 1HG THR 75 -7.102 9.223 -6.747
540 1HG2 THR 75 1HG2 THR 75 -4.628 9.929 -8.974
541 2HG2 THR 75 2HG2 THR 75 -5.760 8.615 -9.289
542 3HG2 THR 75 3HG2 THR 75 -4.076 8.255 -8.913
543 H GLY 76 H GLY 76 -3.392 7.166 -5.539
544 1HA GLY 76 1HA GLY 76 -2.450 4.942 -7.222
545 2HA GLY 76 2HA GLY 76 -1.892 5.320 -5.590
546 H HIS 77 H HIS 77 -2.424 7.901 -7.649
547 HA HIS 77 HA HIS 77 0.245 8.186 -8.789
548 1HB HIS 77 1HB HIS 77 -2.246 9.925 -8.737
549 2HB HIS 77 2HB HIS 77 -1.854 8.770 -9.992
550 HD1 HIS 77 1HD HIS 77 -1.155 12.263 -8.937
551 HD2 HIS 77 2HD HIS 77 0.101 9.528 -11.784
552 HE1 HIS 77 1HE HIS 77 0.003 13.620 -10.670
553 HE2 HIS 77 2HE HIS 77 0.495 11.991 -12.516
554 H GLY 78 H GLY 78 1.845 9.533 -7.934
555 1HA GLY 78 1HA GLY 78 2.908 10.877 -6.475
556 2HA GLY 78 2HA GLY 78 1.617 10.548 -5.326
557 H ILE 79 H ILE 79 1.267 12.630 -4.597
558 HA ILE 79 HA ILE 79 -0.205 14.302 -6.436
559 HB ILE 79 HB ILE 79 0.449 14.765 -3.502
560 1HG1 ILE 79 1HG1 ILE 79 -0.991 12.809 -3.864
561 2HG1 ILE 79 2HG1 ILE 79 -2.084 13.781 -4.839
562 1HG2 ILE 79 1HG2 ILE 79 -1.479 16.238 -5.311
563 2HG2 ILE 79 2HG2 ILE 79 0.029 16.879 -4.658
564 3HG2 ILE 79 3HG2 ILE 79 -1.307 16.493 -3.573
565 1HD1 ILE 79 1HD1 ILE 79 -2.983 13.419 -2.616
566 2HD1 ILE 79 2HD1 ILE 79 -2.656 15.125 -2.898
567 3HD1 ILE 79 3HD1 ILE 79 -1.565 14.179 -1.894
568 H ASN 80 H ASN 80 2.675 14.662 -4.385
569 HA ASN 80 HA ASN 80 3.806 16.287 -6.451
570 1HB ASN 80 1HB ASN 80 3.574 17.306 -3.634
571 2HB ASN 80 2HB ASN 80 2.595 17.905 -4.967
572 1HD2 ASN 80 1HD2 ASN 80 3.307 19.992 -4.736
573 2HD2 ASN 80 2HD2 ASN 80 4.897 20.524 -5.140
574 HA PRO 81 HA PRO 81 5.307 16.256 -7.435
575 1HB PRO 81 1HB PRO 81 7.368 16.112 -8.410
576 2HB PRO 81 2HB PRO 81 7.259 14.351 -8.405
577 1HG PRO 81 1HG PRO 81 8.411 16.178 -6.351
578 2HG PRO 81 2HG PRO 81 8.936 14.555 -6.829
579 1HD PRO 81 1HD PRO 81 7.629 14.930 -4.547
580 2HD PRO 81 2HD PRO 81 7.278 13.516 -5.569
581 H ASP 82 H ASP 82 4.982 14.968 -9.623
582 HA ASP 82 HA ASP 82 3.263 12.653 -9.113
583 1HB ASP 82 1HB ASP 82 2.448 14.617 -10.474
584 2HB ASP 82 2HB ASP 82 2.366 13.075 -11.313
585 H ASP 83 H ASP 83 6.231 13.069 -9.318
586 HA ASP 83 HA ASP 83 7.281 11.698 -11.532
587 1HB ASP 83 1HB ASP 83 8.402 12.293 -8.847
588 2HB ASP 83 2HB ASP 83 8.545 13.333 -10.252
589 H CYS 84 H CYS 84 5.739 10.609 -8.718
590 HA CYS 84 HA CYS 84 6.403 7.907 -9.490
591 1HB CYS 84 1HB CYS 84 7.830 8.186 -7.632
592 2HB CYS 84 2HB CYS 84 6.492 7.181 -7.135
593 HG CYS 84 HG CYS 84 6.396 8.356 -4.975
594 H CYS 85 H CYS 85 4.927 6.398 -9.020
595 HA CYS 85 HA CYS 85 2.394 7.037 -7.810
596 1HB CYS 85 1HB CYS 85 1.134 6.298 -9.613
597 2HB CYS 85 2HB CYS 85 2.515 5.748 -10.488
598 HG CYS 85 HG CYS 85 3.016 8.884 -9.982
599 H LEU 86 H LEU 86 1.459 5.161 -7.198
600 HA LEU 86 HA LEU 86 3.285 2.875 -7.179
601 1HB LEU 86 1HB LEU 86 2.051 2.069 -5.151
602 2HB LEU 86 2HB LEU 86 1.172 3.583 -5.133
603 HG LEU 86 HG LEU 86 4.174 3.365 -4.827
604 1HD1 LEU 86 1HD1 LEU 86 3.497 5.534 -5.647
605 2HD1 LEU 86 2HD1 LEU 86 4.073 5.650 -3.983
606 3HD1 LEU 86 3HD1 LEU 86 2.344 5.697 -4.322
607 1HD2 LEU 86 1HD2 LEU 86 3.812 3.789 -2.442
608 2HD2 LEU 86 2HD2 LEU 86 3.097 2.264 -2.966
609 3HD2 LEU 86 3HD2 LEU 86 2.070 3.671 -2.694
610 H ALA 87 H ALA 87 2.441 0.763 -7.239
611 HA ALA 87 HA ALA 87 0.358 0.570 -9.251
612 1HB ALA 87 1HB ALA 87 2.176 -1.537 -8.096
613 2HB ALA 87 2HB ALA 87 2.378 -0.703 -9.643
614 3HB ALA 87 3HB ALA 87 1.023 -1.791 -9.398
615 H GLU 88 H GLU 88 -1.649 0.267 -8.626
616 HA GLU 88 HA GLU 88 -2.187 -0.765 -6.015
617 1HB GLU 88 1HB GLU 88 -3.608 1.018 -6.872
618 2HB GLU 88 2HB GLU 88 -4.554 -0.426 -6.578
619 1HG GLU 88 1HG GLU 88 -4.562 -0.928 -8.970
620 2HG GLU 88 2HG GLU 88 -3.614 0.525 -9.274
621 H TYR 89 H TYR 89 -2.640 -2.762 -5.517
622 HA TYR 89 HA TYR 89 -2.938 -4.703 -7.691
623 1HB TYR 89 1HB TYR 89 -2.172 -6.396 -6.032
624 2HB TYR 89 2HB TYR 89 -1.955 -5.109 -4.857
625 HD1 TYR 89 1HD TYR 89 -0.686 -6.483 -8.021
626 HD2 TYR 89 2HD TYR 89 -0.025 -3.738 -4.852
627 HE1 TYR 89 1HE TYR 89 1.625 -6.156 -8.792
628 HE2 TYR 89 2HE TYR 89 2.277 -3.399 -5.611
629 HH TYR 89 HH TYR 89 3.961 -4.594 -6.891
630 HA PRO 90 HA PRO 90 -7.085 -5.139 -6.296
631 1HB PRO 90 1HB PRO 90 -7.608 -6.054 -8.335
632 2HB PRO 90 2HB PRO 90 -7.653 -7.562 -7.419
633 1HG PRO 90 1HG PRO 90 -6.020 -7.245 -9.516
634 2HG PRO 90 2HG PRO 90 -5.561 -8.195 -8.091
635 1HD PRO 90 1HD PRO 90 -4.664 -5.491 -8.923
636 2HD PRO 90 2HD PRO 90 -3.787 -6.759 -8.051
637 H VAL 91 H VAL 91 -7.724 -5.637 -4.384
638 HA VAL 91 HA VAL 91 -6.664 -8.005 -3.020
639 HB VAL 91 HB VAL 91 -7.984 -5.525 -1.856
640 1HG1 VAL 91 1HG1 VAL 91 -6.616 -7.827 -0.477
641 2HG1 VAL 91 2HG1 VAL 91 -8.341 -7.468 -0.451
642 3HG1 VAL 91 3HG1 VAL 91 -7.196 -6.363 0.314
643 1HG2 VAL 91 1HG2 VAL 91 -5.805 -4.983 -2.784
644 2HG2 VAL 91 2HG2 VAL 91 -5.072 -6.309 -1.881
645 3HG2 VAL 91 3HG2 VAL 91 -5.754 -4.929 -1.023
646 H GLU 92 H GLU 92 -8.105 -9.509 -2.275
647 HA GLU 92 HA GLU 92 -10.935 -8.937 -2.772
648 1HB GLU 92 1HB GLU 92 -9.865 -11.753 -2.846
649 2HB GLU 92 2HB GLU 92 -9.555 -10.631 -4.174
650 1HG GLU 92 1HG GLU 92 -11.423 -11.996 -4.747
651 2HG GLU 92 2HG GLU 92 -11.917 -10.323 -4.562
652 H VAL 93 H VAL 93 -12.216 -9.549 -1.197
653 HA VAL 93 HA VAL 93 -10.794 -9.765 1.385
654 HB VAL 93 HB VAL 93 -13.433 -8.378 0.896
655 1HG1 VAL 93 1HG1 VAL 93 -13.308 -9.257 3.161
656 2HG1 VAL 93 2HG1 VAL 93 -13.175 -7.496 3.180
657 3HG1 VAL 93 3HG1 VAL 93 -11.736 -8.492 3.390
658 1HG2 VAL 93 1HG2 VAL 93 -10.681 -7.240 1.391
659 2HG2 VAL 93 2HG2 VAL 93 -12.169 -6.302 1.289
660 3HG2 VAL 93 3HG2 VAL 93 -11.579 -7.177 -0.125
661 H LYS 94 H LYS 94 -11.067 -11.488 2.603
662 HA LYS 94 HA LYS 94 -13.567 -12.969 2.511
663 1HB LYS 94 1HB LYS 94 -12.302 -14.790 3.569
664 2HB LYS 94 2HB LYS 94 -10.837 -13.843 3.511
665 1HG LYS 94 1HG LYS 94 -12.241 -14.923 1.086
666 2HG LYS 94 2HG LYS 94 -10.868 -15.675 1.879
667 1HD LYS 94 1HD LYS 94 -9.556 -14.503 0.516
668 2HD LYS 94 2HD LYS 94 -10.026 -13.076 1.436
669 1HE LYS 94 1HE LYS 94 -10.349 -12.742 -0.942
670 2HE LYS 94 2HE LYS 94 -11.870 -12.668 -0.064
671 1HZ LYS 94 1HZ LYS 94 -10.891 -14.995 -1.637
672 2HZ LYS 94 2HZ LYS 94 -12.141 -13.919 -2.059
673 3HZ LYS 94 3HZ LYS 94 -12.341 -14.942 -0.777
674 H GLY 95 H GLY 95 -14.451 -13.359 4.578
675 1HA GLY 95 1HA GLY 95 -14.903 -12.926 6.785
676 2HA GLY 95 2HA GLY 95 -14.304 -11.295 6.379
677 H ASP 96 H ASP 96 -12.376 -14.053 6.445
678 HA ASP 96 HA ASP 96 -10.968 -12.891 8.769
679 1HB ASP 96 1HB ASP 96 -11.070 -15.824 7.955
680 2HB ASP 96 2HB ASP 96 -11.849 -15.056 9.340
681 H ASP 97 H ASP 97 -10.672 -13.730 5.469
682 HA ASP 97 HA ASP 97 -7.725 -13.586 5.696
683 1HB ASP 97 1HB ASP 97 -7.655 -14.822 3.561
684 2HB ASP 97 2HB ASP 97 -9.363 -15.161 3.721
685 H ILE 98 H ILE 98 -6.563 -12.483 4.296
686 HA ILE 98 HA ILE 98 -8.040 -10.831 2.405
687 HB ILE 98 HB ILE 98 -5.677 -10.105 4.122
688 1HG1 ILE 98 1HG1 ILE 98 -7.852 -9.906 5.211
689 2HG1 ILE 98 2HG1 ILE 98 -8.443 -8.894 3.885
690 1HG2 ILE 98 1HG2 ILE 98 -5.669 -7.898 2.972
691 2HG2 ILE 98 2HG2 ILE 98 -6.901 -8.487 1.857
692 3HG2 ILE 98 3HG2 ILE 98 -5.293 -9.214 1.857
693 1HD1 ILE 98 1HD1 ILE 98 -6.919 -7.195 4.410
694 2HD1 ILE 98 2HD1 ILE 98 -6.265 -8.182 5.729
695 3HD1 ILE 98 3HD1 ILE 98 -7.945 -7.606 5.795
696 H TYR 99 H TYR 99 -7.590 -11.278 0.425
697 HA TYR 99 HA TYR 99 -4.986 -12.460 -0.227
698 1HB TYR 99 1HB TYR 99 -6.157 -13.162 -2.360
699 2HB TYR 99 2HB TYR 99 -7.656 -12.734 -1.590
700 HD1 TYR 99 1HD TYR 99 -5.916 -15.416 -2.556
701 HD2 TYR 99 2HD TYR 99 -7.617 -13.912 1.030
702 HE1 TYR 99 1HE TYR 99 -6.062 -17.698 -1.688
703 HE2 TYR 99 2HE TYR 99 -7.774 -16.212 1.912
704 HH TYR 99 HH TYR 99 -7.870 -18.500 1.042
705 H VAL 100 H VAL 100 -3.884 -11.590 -1.887
706 HA VAL 100 HA VAL 100 -5.085 -9.427 -3.427
707 HB VAL 100 HB VAL 100 -3.902 -8.289 -1.681
708 1HG1 VAL 100 1HG1 VAL 100 -1.425 -8.429 -1.443
709 2HG1 VAL 100 2HG1 VAL 100 -1.422 -9.731 -2.636
710 3HG1 VAL 100 3HG1 VAL 100 -2.229 -9.959 -1.084
711 1HG2 VAL 100 1HG2 VAL 100 -2.470 -8.053 -4.311
712 2HG2 VAL 100 2HG2 VAL 100 -2.383 -6.865 -3.010
713 3HG2 VAL 100 3HG2 VAL 100 -3.923 -7.188 -3.808
714 H SER 101 H SER 101 -4.351 -9.230 -5.422
715 HA SER 101 HA SER 101 -2.765 -11.538 -6.296
716 1HB SER 101 1HB SER 101 -4.619 -9.880 -8.008
717 2HB SER 101 2HB SER 101 -5.082 -11.384 -7.211
718 HG SER 101 HG SER 101 -4.267 -11.368 -9.511
719 H THR 102 H THR 102 -0.827 -11.250 -7.107
720 HA THR 102 HA THR 102 -0.064 -8.615 -8.111
721 HB THR 102 HB THR 102 2.260 -9.399 -7.425
722 HG1 THR 102 1HG THR 102 2.415 -11.328 -6.623
723 1HG2 THR 102 1HG2 THR 102 1.947 -8.849 -5.049
724 2HG2 THR 102 2HG2 THR 102 0.207 -9.097 -5.218
725 3HG2 THR 102 3HG2 THR 102 0.995 -7.770 -6.070
726 H LYS 103 H LYS 103 -1.089 -11.429 -9.094
727 HA LYS 103 HA LYS 103 1.047 -12.431 -10.691
728 1HB LYS 103 1HB LYS 103 -1.892 -13.163 -10.692
729 2HB LYS 103 2HB LYS 103 -0.680 -13.895 -9.667
730 1HG LYS 103 1HG LYS 103 -1.091 -15.457 -11.374
731 2HG LYS 103 2HG LYS 103 0.465 -14.735 -11.756
732 1HD LYS 103 1HD LYS 103 -0.616 -13.265 -13.404
733 2HD LYS 103 2HD LYS 103 -2.163 -14.030 -13.057
734 1HE LYS 103 1HE LYS 103 0.281 -15.410 -14.164
735 2HE LYS 103 2HE LYS 103 -1.152 -14.961 -15.077
736 1HZ LYS 103 1HZ LYS 103 -1.186 -17.279 -14.479
737 2HZ LYS 103 2HZ LYS 103 -2.461 -16.493 -13.712
738 3HZ LYS 103 3HZ LYS 103 -1.071 -16.910 -12.849
739 H GLY 104 H GLY 104 1.686 -11.593 -12.502
740 1HA GLY 104 1HA GLY 104 -0.111 -11.025 -14.647
741 2HA GLY 104 2HA GLY 104 1.634 -10.850 -14.669
742 H ILE 105 H ILE 105 1.239 -9.128 -12.162
743 HA ILE 105 HA ILE 105 0.181 -6.765 -13.525
744 HB ILE 105 HB ILE 105 0.378 -7.279 -10.545
745 1HG1 ILE 105 1HG1 ILE 105 -1.343 -8.609 -11.713
746 2HG1 ILE 105 2HG1 ILE 105 -2.013 -7.135 -12.396
747 1HG2 ILE 105 1HG2 ILE 105 -0.891 -5.174 -10.317
748 2HG2 ILE 105 2HG2 ILE 105 -0.819 -4.949 -12.064
749 3HG2 ILE 105 3HG2 ILE 105 0.664 -4.892 -11.111
750 1HD1 ILE 105 1HD1 ILE 105 -2.571 -6.342 -10.181
751 2HD1 ILE 105 2HD1 ILE 105 -1.921 -7.828 -9.483
752 3HD1 ILE 105 3HD1 ILE 105 -3.333 -7.888 -10.540
753 H LEU 106 H LEU 106 1.566 -5.296 -14.159
754 HA LEU 106 HA LEU 106 4.273 -5.428 -13.322
755 1HB LEU 106 1HB LEU 106 4.486 -3.627 -15.024
756 2HB LEU 106 2HB LEU 106 2.781 -3.744 -15.330
757 HG LEU 106 HG LEU 106 4.706 -6.015 -15.842
758 1HD1 LEU 106 1HD1 LEU 106 1.851 -5.624 -16.717
759 2HD1 LEU 106 2HD1 LEU 106 2.431 -6.783 -15.521
760 3HD1 LEU 106 3HD1 LEU 106 2.905 -6.948 -17.208
761 1HD2 LEU 106 1HD2 LEU 106 5.267 -4.140 -17.268
762 2HD2 LEU 106 2HD2 LEU 106 3.582 -3.997 -17.775
763 3HD2 LEU 106 3HD2 LEU 106 4.515 -5.427 -18.210
764 HA PRO 107 HA PRO 107 3.826 -2.102 -10.349
765 1HB PRO 107 1HB PRO 107 5.970 -2.533 -9.624
766 2HB PRO 107 2HB PRO 107 6.357 -1.075 -10.542
767 1HG PRO 107 1HG PRO 107 7.573 -3.383 -11.079
768 2HG PRO 107 2HG PRO 107 7.098 -2.278 -12.381
769 1HD PRO 107 1HD PRO 107 5.777 -4.800 -11.460
770 2HD PRO 107 2HD PRO 107 6.029 -4.196 -13.112
771 H ASN 108 H ASN 108 3.557 0.050 -10.355
772 HA ASN 108 HA ASN 108 3.067 1.406 -12.876
773 1HB ASN 108 1HB ASN 108 2.833 2.511 -10.061
774 2HB ASN 108 2HB ASN 108 1.630 1.412 -10.701
775 1HD2 ASN 108 1HD2 ASN 108 0.033 2.894 -10.420
776 2HD2 ASN 108 2HD2 ASN 108 -0.192 4.227 -11.469
777 H LYS 109 H LYS 109 3.868 3.936 -12.603
778 HA LYS 109 HA LYS 109 6.682 3.793 -12.869
779 1HB LYS 109 1HB LYS 109 5.039 6.209 -12.427
780 2HB LYS 109 2HB LYS 109 5.359 5.414 -14.003
781 1HG LYS 109 1HG LYS 109 7.725 5.948 -13.808
782 2HG LYS 109 2HG LYS 109 7.454 6.680 -12.229
783 1HD LYS 109 1HD LYS 109 6.269 7.686 -14.817
784 2HD LYS 109 2HD LYS 109 7.694 8.357 -14.025
785 1HE LYS 109 1HE LYS 109 6.353 8.878 -12.046
786 2HE LYS 109 2HE LYS 109 4.915 8.242 -12.833
787 1HZ LYS 109 1HZ LYS 109 5.127 9.948 -14.523
788 2HZ LYS 109 2HZ LYS 109 6.515 10.554 -13.776
789 3HZ LYS 109 3HZ LYS 109 5.044 10.653 -12.989
790 H ALA 110 H ALA 110 7.565 3.169 -11.394
791 HA ALA 110 HA ALA 110 8.693 4.428 -9.181
792 1HB ALA 110 1HB ALA 110 6.368 2.585 -8.492
793 2HB ALA 110 2HB ALA 110 6.459 4.306 -8.126
794 3HB ALA 110 3HB ALA 110 7.542 3.170 -7.318
795 H HIS 111 H HIS 111 8.663 1.690 -7.617
796 HA HIS 111 HA HIS 111 10.165 0.012 -7.530
797 1HB HIS 111 1HB HIS 111 8.905 -0.459 -10.244
798 2HB HIS 111 2HB HIS 111 8.359 -1.081 -8.705
799 HD1 HIS 111 1HD HIS 111 10.545 -1.892 -11.533
800 HD2 HIS 111 2HD HIS 111 9.996 -3.199 -7.626
801 HE1 HIS 111 1HE HIS 111 11.631 -4.133 -11.416
802 HE2 HIS 111 2HE HIS 111 11.656 -4.633 -8.976
803 H SER 112 H SER 112 12.155 1.078 -7.428
804 HA SER 112 HA SER 112 13.540 1.312 -9.961
805 1HB SER 112 1HB SER 112 13.373 3.459 -8.982
806 2HB SER 112 2HB SER 112 15.027 2.918 -8.694
807 HG SER 112 HG SER 112 14.213 2.158 -6.618
Start of MODEL 14
1 1H MET 1 1HT MET 1 -5.050 -19.691 -10.043
2 2H MET 1 2HT MET 1 -4.940 -18.610 -11.329
3 3H MET 1 3HT MET 1 -6.316 -19.566 -11.157
4 HA MET 1 HA MET 1 -6.730 -17.306 -10.490
5 1HB MET 1 1HB MET 1 -6.703 -19.301 -8.216
6 2HB MET 1 2HB MET 1 -7.980 -19.118 -9.408
7 1HG MET 1 1HG MET 1 -8.465 -16.884 -8.569
8 2HG MET 1 2HG MET 1 -7.184 -17.066 -7.368
9 1HE MET 1 1HE MET 1 -8.923 -16.451 -5.437
10 2HE MET 1 2HE MET 1 -10.460 -17.288 -5.209
11 3HE MET 1 3HE MET 1 -10.206 -16.283 -6.639
12 H SER 2 H SER 2 -5.286 -15.712 -10.386
13 HA SER 2 HA SER 2 -3.095 -15.859 -8.573
14 1HB SER 2 1HB SER 2 -4.015 -13.571 -10.325
15 2HB SER 2 2HB SER 2 -2.783 -14.760 -10.742
16 HG SER 2 HG SER 2 -1.405 -13.885 -9.286
17 H PHE 3 H PHE 3 -4.128 -16.082 -6.694
18 HA PHE 3 HA PHE 3 -4.608 -13.674 -5.263
19 1HB PHE 3 1HB PHE 3 -6.724 -14.688 -4.133
20 2HB PHE 3 2HB PHE 3 -6.831 -15.725 -5.537
21 HD1 PHE 3 1HD PHE 3 -6.875 -12.184 -4.495
22 HD2 PHE 3 2HD PHE 3 -7.885 -15.009 -7.514
23 HE1 PHE 3 1HE PHE 3 -8.182 -10.460 -5.666
24 HE2 PHE 3 2HE PHE 3 -9.186 -13.292 -8.691
25 HZ PHE 3 HZ PHE 3 -9.335 -11.008 -7.764
26 H GLU 4 H GLU 4 -2.934 -14.113 -4.053
27 HA GLU 4 HA GLU 4 -2.841 -16.758 -2.763
28 1HB GLU 4 1HB GLU 4 -0.620 -14.726 -3.077
29 2HB GLU 4 2HB GLU 4 -0.863 -16.092 -4.148
30 1HG GLU 4 1HG GLU 4 -0.506 -17.617 -2.253
31 2HG GLU 4 2HG GLU 4 -0.189 -16.223 -1.221
32 H LYS 5 H LYS 5 -3.054 -16.880 -0.587
33 HA LYS 5 HA LYS 5 -3.977 -14.606 0.819
34 1HB LYS 5 1HB LYS 5 -2.979 -17.192 1.999
35 2HB LYS 5 2HB LYS 5 -4.624 -16.943 1.418
36 1HG LYS 5 1HG LYS 5 -4.939 -15.169 3.099
37 2HG LYS 5 2HG LYS 5 -3.294 -15.424 3.672
38 1HD LYS 5 1HD LYS 5 -5.465 -17.512 3.717
39 2HD LYS 5 2HD LYS 5 -4.978 -16.525 5.097
40 1HE LYS 5 1HE LYS 5 -2.749 -17.437 5.005
41 2HE LYS 5 2HE LYS 5 -3.153 -18.362 3.576
42 1HZ LYS 5 1HZ LYS 5 -4.802 -19.587 4.931
43 2HZ LYS 5 2HZ LYS 5 -4.370 -18.702 6.284
44 3HZ LYS 5 3HZ LYS 5 -3.265 -19.743 5.585
45 H ILE 6 H ILE 6 -2.959 -13.170 1.852
46 HA ILE 6 HA ILE 6 -0.059 -13.454 2.076
47 HB ILE 6 HB ILE 6 -0.808 -11.729 0.574
48 1HG1 ILE 6 1HG1 ILE 6 0.412 -10.592 3.092
49 2HG1 ILE 6 2HG1 ILE 6 0.388 -9.757 1.540
50 1HG2 ILE 6 1HG2 ILE 6 -2.267 -10.500 2.868
51 2HG2 ILE 6 2HG2 ILE 6 -2.954 -11.262 1.445
52 3HG2 ILE 6 3HG2 ILE 6 -2.050 -9.746 1.276
53 1HD1 ILE 6 1HD1 ILE 6 2.542 -10.806 1.902
54 2HD1 ILE 6 2HD1 ILE 6 1.709 -11.581 0.554
55 3HD1 ILE 6 3HD1 ILE 6 1.763 -12.368 2.127
56 H CYS 7 H CYS 7 -2.946 -12.339 3.681
57 HA CYS 7 HA CYS 7 -1.901 -13.064 6.248
58 1HB CYS 7 1HB CYS 7 -0.914 -10.873 6.146
59 2HB CYS 7 2HB CYS 7 -2.263 -10.830 7.249
60 HG CYS 7 HG CYS 7 -3.461 -8.879 6.209
61 H SER 8 H SER 8 -3.578 -11.876 7.865
62 HA SER 8 HA SER 8 -6.270 -12.532 6.925
63 1HB SER 8 1HB SER 8 -6.766 -13.434 8.961
64 2HB SER 8 2HB SER 8 -5.452 -12.805 9.844
65 HG SER 8 HG SER 8 -5.771 -15.116 8.560
66 H LEU 9 H LEU 9 -7.892 -11.216 7.826
67 HA LEU 9 HA LEU 9 -7.276 -8.446 8.083
68 1HB LEU 9 1HB LEU 9 -9.774 -9.810 9.061
69 2HB LEU 9 2HB LEU 9 -9.486 -9.579 7.369
70 HG LEU 9 HG LEU 9 -9.477 -7.029 7.872
71 1HD1 LEU 9 1HD1 LEU 9 -11.910 -6.902 7.883
72 2HD1 LEU 9 2HD1 LEU 9 -11.999 -8.600 8.360
73 3HD1 LEU 9 3HD1 LEU 9 -11.341 -8.160 6.787
74 1HD2 LEU 9 1HD2 LEU 9 -10.771 -8.003 10.420
75 2HD2 LEU 9 2HD2 LEU 9 -10.679 -6.323 9.872
76 3HD2 LEU 9 3HD2 LEU 9 -9.211 -7.190 10.313
77 H ASP 10 H ASP 10 -7.409 -11.014 10.330
78 HA ASP 10 HA ASP 10 -7.499 -9.665 12.796
79 1HB ASP 10 1HB ASP 10 -5.859 -12.109 12.111
80 2HB ASP 10 2HB ASP 10 -7.566 -12.129 12.539
81 H ASP 11 H ASP 11 -4.910 -10.027 10.465
82 HA ASP 11 HA ASP 11 -2.786 -9.047 12.075
83 1HB ASP 11 1HB ASP 11 -1.680 -8.525 9.874
84 2HB ASP 11 2HB ASP 11 -3.143 -9.040 9.061
85 H ILE 12 H ILE 12 -5.041 -7.559 9.784
86 HA ILE 12 HA ILE 12 -4.179 -4.978 10.822
87 HB ILE 12 HB ILE 12 -4.499 -3.954 8.636
88 1HG1 ILE 12 1HG1 ILE 12 -6.001 -5.589 7.642
89 2HG1 ILE 12 2HG1 ILE 12 -4.728 -6.785 7.740
90 1HG2 ILE 12 1HG2 ILE 12 -2.232 -4.612 9.363
91 2HG2 ILE 12 2HG2 ILE 12 -2.389 -4.826 7.612
92 3HG2 ILE 12 3HG2 ILE 12 -2.495 -6.220 8.684
93 1HD1 ILE 12 1HD1 ILE 12 -5.026 -5.940 5.432
94 2HD1 ILE 12 2HD1 ILE 12 -3.424 -5.554 6.058
95 3HD1 ILE 12 3HD1 ILE 12 -4.671 -4.307 5.997
96 H TRP 13 H TRP 13 -5.668 -4.104 11.855
97 HA TRP 13 HA TRP 13 -8.478 -4.536 11.455
98 1HB TRP 13 1HB TRP 13 -8.710 -2.940 13.320
99 2HB TRP 13 2HB TRP 13 -6.983 -2.610 13.249
100 HD1 TRP 13 HD TRP 13 -5.419 -4.875 13.646
101 HE1 TRP 13 1HE TRP 13 -5.736 -6.723 15.461
102 HE3 TRP 13 3HE TRP 13 -10.337 -4.103 14.681
103 HZ2 TRP 13 2HZ TRP 13 -7.852 -7.681 17.098
104 HZ3 TRP 13 3HZ TRP 13 -11.445 -5.506 16.373
105 HH2 TRP 13 HH TRP 13 -10.223 -7.255 17.552
106 H VAL 14 H VAL 14 -9.947 -2.418 11.285
107 HA VAL 14 HA VAL 14 -9.231 -1.132 9.017
108 HB VAL 14 HB VAL 14 -11.136 0.283 9.563
109 1HG1 VAL 14 1HG1 VAL 14 -11.591 -2.683 9.896
110 2HG1 VAL 14 2HG1 VAL 14 -11.472 -1.810 8.368
111 3HG1 VAL 14 3HG1 VAL 14 -12.839 -1.521 9.442
112 1HG2 VAL 14 1HG2 VAL 14 -12.584 -0.267 11.507
113 2HG2 VAL 14 2HG2 VAL 14 -11.014 0.386 11.974
114 3HG2 VAL 14 3HG2 VAL 14 -11.316 -1.346 12.099
115 H GLY 15 H GLY 15 -7.908 0.415 8.687
116 1HA GLY 15 1HA GLY 15 -7.251 2.368 10.768
117 2HA GLY 15 2HA GLY 15 -6.921 2.527 9.048
118 H GLU 16 H GLU 16 -6.088 -0.554 9.606
119 HA GLU 16 HA GLU 16 -3.414 0.045 10.656
120 1HB GLU 16 1HB GLU 16 -4.632 -2.627 10.080
121 2HB GLU 16 2HB GLU 16 -4.867 -1.945 11.630
122 1HG GLU 16 1HG GLU 16 -2.309 -2.831 10.314
123 2HG GLU 16 2HG GLU 16 -3.062 -3.495 11.769
124 H MET 17 H MET 17 -1.583 -0.692 9.504
125 HA MET 17 HA MET 17 -1.910 -1.709 6.822
126 1HB MET 17 1HB MET 17 -2.070 0.708 6.494
127 2HB MET 17 2HB MET 17 -0.615 0.051 5.781
128 1HG MET 17 1HG MET 17 0.717 0.863 7.610
129 2HG MET 17 2HG MET 17 -0.666 1.465 8.473
130 1HE MET 17 1HE MET 17 0.256 3.824 8.800
131 2HE MET 17 2HE MET 17 1.024 4.788 7.541
132 3HE MET 17 3HE MET 17 1.779 3.288 8.088
133 H GLU 18 H GLU 18 -0.223 -2.929 6.298
134 HA GLU 18 HA GLU 18 2.301 -2.463 7.647
135 1HB GLU 18 1HB GLU 18 2.734 -4.679 8.265
136 2HB GLU 18 2HB GLU 18 1.250 -5.314 7.563
137 1HG GLU 18 1HG GLU 18 -0.055 -4.264 9.311
138 2HG GLU 18 2HG GLU 18 1.382 -3.483 9.962
139 H THR 19 H THR 19 4.092 -3.438 6.557
140 HA THR 19 HA THR 19 3.548 -3.757 3.739
141 HB THR 19 HB THR 19 6.167 -3.619 5.239
142 HG1 THR 19 1HG THR 19 5.930 -1.443 3.834
143 1HG2 THR 19 1HG2 THR 19 7.153 -3.145 3.010
144 2HG2 THR 19 2HG2 THR 19 5.569 -3.413 2.277
145 3HG2 THR 19 3HG2 THR 19 6.404 -4.738 3.079
146 H PHE 20 H PHE 20 3.423 -5.644 2.915
147 HA PHE 20 HA PHE 20 4.618 -7.956 4.295
148 1HB PHE 20 1HB PHE 20 2.842 -9.328 3.274
149 2HB PHE 20 2HB PHE 20 2.102 -7.889 2.603
150 HD1 PHE 20 1HD PHE 20 0.864 -6.345 4.016
151 HD2 PHE 20 2HD PHE 20 2.630 -9.862 5.615
152 HE1 PHE 20 1HE PHE 20 -0.514 -6.111 6.031
153 HE2 PHE 20 2HE PHE 20 1.252 -9.633 7.645
154 HZ PHE 20 HZ PHE 20 -0.323 -7.756 7.851
155 H GLU 21 H GLU 21 5.437 -9.578 2.854
156 HA GLU 21 HA GLU 21 6.040 -8.485 0.205
157 1HB GLU 21 1HB GLU 21 7.715 -10.396 1.859
158 2HB GLU 21 2HB GLU 21 8.053 -8.686 1.633
159 1HG GLU 21 1HG GLU 21 8.326 -9.076 -0.780
160 2HG GLU 21 2HG GLU 21 8.030 -10.791 -0.520
161 H THR 22 H THR 22 5.639 -9.718 -1.505
162 HA THR 22 HA THR 22 3.897 -11.979 -1.105
163 HB THR 22 HB THR 22 3.617 -11.919 -3.537
164 HG1 THR 22 1HG THR 22 4.837 -10.550 -4.782
165 1HG2 THR 22 1HG2 THR 22 2.379 -10.218 -2.215
166 2HG2 THR 22 2HG2 THR 22 2.803 -9.630 -3.827
167 3HG2 THR 22 3HG2 THR 22 3.741 -9.110 -2.435
168 H SER 23 H SER 23 4.395 -13.932 -2.701
169 HA SER 23 HA SER 23 6.863 -14.986 -1.837
170 1HB SER 23 1HB SER 23 6.181 -16.972 -3.078
171 2HB SER 23 2HB SER 23 4.870 -16.036 -3.794
172 HG SER 23 HG SER 23 3.739 -16.245 -2.009
173 H ASP 24 H ASP 24 6.063 -13.018 -4.391
174 HA ASP 24 HA ASP 24 8.280 -13.925 -6.088
175 1HB ASP 24 1HB ASP 24 7.592 -12.132 -7.655
176 2HB ASP 24 2HB ASP 24 6.333 -11.666 -6.528
177 H GLY 25 H GLY 25 7.892 -12.018 -3.451
178 1HA GLY 25 1HA GLY 25 10.428 -10.693 -3.987
179 2HA GLY 25 2HA GLY 25 9.631 -10.832 -2.426
180 H THR 26 H THR 26 7.073 -9.875 -3.947
181 HA THR 26 HA THR 26 7.811 -7.113 -4.370
182 HB THR 26 HB THR 26 5.080 -8.413 -4.519
183 HG1 THR 26 1HG THR 26 7.105 -7.997 -6.475
184 1HG2 THR 26 1HG2 THR 26 6.174 -5.860 -5.729
185 2HG2 THR 26 2HG2 THR 26 5.059 -5.954 -4.364
186 3HG2 THR 26 3HG2 THR 26 4.543 -6.487 -5.966
187 H GLU 27 H GLU 27 7.926 -5.838 -2.657
188 HA GLU 27 HA GLU 27 6.437 -6.474 -0.232
189 1HB GLU 27 1HB GLU 27 7.799 -4.710 0.800
190 2HB GLU 27 2HB GLU 27 8.498 -4.340 -0.772
191 1HG GLU 27 1HG GLU 27 9.359 -6.659 -0.865
192 2HG GLU 27 2HG GLU 27 8.750 -6.913 0.767
193 H VAL 28 H VAL 28 4.658 -5.515 0.301
194 HA VAL 28 HA VAL 28 3.838 -3.095 -1.150
195 HB VAL 28 HB VAL 28 2.182 -5.578 -0.710
196 1HG1 VAL 28 1HG1 VAL 28 0.554 -4.607 -2.229
197 2HG1 VAL 28 2HG1 VAL 28 1.475 -3.099 -2.203
198 3HG1 VAL 28 3HG1 VAL 28 0.742 -3.716 -0.719
199 1HG2 VAL 28 1HG2 VAL 28 3.393 -4.602 -3.288
200 2HG2 VAL 28 2HG2 VAL 28 2.246 -5.934 -3.154
201 3HG2 VAL 28 3HG2 VAL 28 3.834 -6.057 -2.393
202 H LEU 29 H LEU 29 2.594 -1.759 0.098
203 HA LEU 29 HA LEU 29 2.187 -2.224 2.960
204 1HB LEU 29 1HB LEU 29 1.324 0.028 1.116
205 2HB LEU 29 2HB LEU 29 2.781 -0.003 2.094
206 HG LEU 29 HG LEU 29 0.089 -0.206 3.330
207 1HD1 LEU 29 1HD1 LEU 29 2.782 0.584 4.378
208 2HD1 LEU 29 2HD1 LEU 29 1.885 -0.893 4.743
209 3HD1 LEU 29 3HD1 LEU 29 1.280 0.673 5.288
210 1HD2 LEU 29 1HD2 LEU 29 1.628 2.304 2.699
211 2HD2 LEU 29 2HD2 LEU 29 0.215 2.218 3.750
212 3HD2 LEU 29 3HD2 LEU 29 0.064 1.832 2.035
213 H ILE 30 H ILE 30 0.447 -3.399 3.534
214 HA ILE 30 HA ILE 30 -1.924 -3.168 1.851
215 HB ILE 30 HB ILE 30 -1.251 -5.369 3.844
216 1HG1 ILE 30 1HG1 ILE 30 0.190 -5.416 1.866
217 2HG1 ILE 30 2HG1 ILE 30 -1.215 -5.308 0.828
218 1HG2 ILE 30 1HG2 ILE 30 -3.212 -6.511 2.889
219 2HG2 ILE 30 2HG2 ILE 30 -3.527 -5.114 1.861
220 3HG2 ILE 30 3HG2 ILE 30 -3.672 -4.967 3.610
221 1HD1 ILE 30 1HD1 ILE 30 -0.337 -7.579 0.907
222 2HD1 ILE 30 2HD1 ILE 30 -1.962 -7.502 1.589
223 3HD1 ILE 30 3HD1 ILE 30 -0.564 -7.614 2.657
224 H VAL 31 H VAL 31 -3.336 -1.846 2.575
225 HA VAL 31 HA VAL 31 -3.501 -1.335 5.458
226 HB VAL 31 HB VAL 31 -2.794 0.657 4.099
227 1HG1 VAL 31 1HG1 VAL 31 -5.426 0.397 2.735
228 2HG1 VAL 31 2HG1 VAL 31 -3.830 0.160 2.017
229 3HG1 VAL 31 3HG1 VAL 31 -4.315 1.759 2.586
230 1HG2 VAL 31 1HG2 VAL 31 -4.427 2.258 4.969
231 2HG2 VAL 31 2HG2 VAL 31 -4.068 1.025 6.183
232 3HG2 VAL 31 3HG2 VAL 31 -5.565 0.946 5.261
233 H ASN 32 H ASN 32 -5.417 -1.585 6.434
234 HA ASN 32 HA ASN 32 -7.682 -2.368 4.717
235 1HB ASN 32 1HB ASN 32 -7.126 -3.082 7.613
236 2HB ASN 32 2HB ASN 32 -7.035 -4.171 6.234
237 1HD2 ASN 32 1HD2 ASN 32 -8.593 -4.492 8.593
238 2HD2 ASN 32 2HD2 ASN 32 -10.254 -4.576 8.112
239 H SER 33 H SER 33 -8.895 -0.677 4.387
240 HA SER 33 HA SER 33 -9.250 1.250 6.530
241 1HB SER 33 1HB SER 33 -9.872 1.382 3.574
242 2HB SER 33 2HB SER 33 -8.534 2.180 4.394
243 HG SER 33 HG SER 33 -10.177 3.353 5.611
244 H GLU 34 H GLU 34 -11.304 1.853 7.189
245 HA GLU 34 HA GLU 34 -13.284 -0.212 7.131
246 1HB GLU 34 1HB GLU 34 -12.943 1.184 9.173
247 2HB GLU 34 2HB GLU 34 -14.593 1.250 8.608
248 1HG GLU 34 1HG GLU 34 -13.885 3.436 9.368
249 2HG GLU 34 2HG GLU 34 -14.214 3.469 7.644
250 H GLU 35 H GLU 35 -12.723 2.852 5.681
251 HA GLU 35 HA GLU 35 -15.293 2.912 4.335
252 1HB GLU 35 1HB GLU 35 -13.006 4.809 4.588
253 2HB GLU 35 2HB GLU 35 -14.539 4.901 5.428
254 1HG GLU 35 1HG GLU 35 -15.664 5.372 3.311
255 2HG GLU 35 2HG GLU 35 -14.088 5.362 2.505
256 H HIS 36 H HIS 36 -11.815 2.879 3.506
257 HA HIS 36 HA HIS 36 -12.520 2.715 0.684
258 1HB HIS 36 1HB HIS 36 -10.024 2.806 0.289
259 2HB HIS 36 2HB HIS 36 -9.828 2.999 2.026
260 HD1 HIS 36 1HD HIS 36 -10.225 4.915 -0.976
261 HD2 HIS 36 2HD HIS 36 -11.256 5.414 3.008
262 HE1 HIS 36 1HE HIS 36 -10.682 7.359 -0.704
263 HE2 HIS 36 2HE HIS 36 -11.002 7.651 1.766
264 H GLY 37 H GLY 37 -12.119 0.530 3.094
265 1HA GLY 37 1HA GLY 37 -12.015 -1.633 1.217
266 2HA GLY 37 2HA GLY 37 -12.160 -1.759 2.969
267 H VAL 38 H VAL 38 -10.514 -3.464 1.579
268 HA VAL 38 HA VAL 38 -7.972 -2.762 2.752
269 HB VAL 38 HB VAL 38 -8.674 -5.252 1.158
270 1HG1 VAL 38 1HG1 VAL 38 -6.770 -6.264 2.316
271 2HG1 VAL 38 2HG1 VAL 38 -6.447 -4.729 3.120
272 3HG1 VAL 38 3HG1 VAL 38 -6.277 -4.859 1.370
273 1HG2 VAL 38 1HG2 VAL 38 -10.170 -5.068 3.066
274 2HG2 VAL 38 2HG2 VAL 38 -8.795 -4.813 4.141
275 3HG2 VAL 38 3HG2 VAL 38 -9.001 -6.364 3.330
276 H LYS 39 H LYS 39 -6.295 -1.977 1.709
277 HA LYS 39 HA LYS 39 -6.268 -1.969 -1.223
278 1HB LYS 39 1HB LYS 39 -5.110 0.345 -0.931
279 2HB LYS 39 2HB LYS 39 -5.780 0.274 0.667
280 1HG LYS 39 1HG LYS 39 -7.216 1.603 -0.770
281 2HG LYS 39 2HG LYS 39 -8.051 0.143 -0.224
282 1HD LYS 39 1HD LYS 39 -7.586 -0.946 -2.357
283 2HD LYS 39 2HD LYS 39 -6.689 0.467 -2.902
284 1HE LYS 39 1HE LYS 39 -8.702 1.819 -2.789
285 2HE LYS 39 2HE LYS 39 -9.622 0.429 -2.210
286 1HZ LYS 39 1HZ LYS 39 -8.257 0.628 -4.846
287 2HZ LYS 39 2HZ LYS 39 -9.925 0.742 -4.601
288 3HZ LYS 39 3HZ LYS 39 -9.130 -0.703 -4.298
289 H ALA 40 H ALA 40 -4.358 -2.221 -2.169
290 HA ALA 40 HA ALA 40 -2.014 -2.667 -0.456
291 1HB ALA 40 1HB ALA 40 -2.962 -4.804 -1.175
292 2HB ALA 40 2HB ALA 40 -1.389 -4.538 -1.919
293 3HB ALA 40 3HB ALA 40 -2.866 -4.291 -2.857
294 H TYR 41 H TYR 41 -0.376 -1.360 -0.980
295 HA TYR 41 HA TYR 41 -0.115 -0.360 -3.770
296 1HB TYR 41 1HB TYR 41 0.490 1.822 -2.921
297 2HB TYR 41 2HB TYR 41 0.368 1.264 -1.268
298 HD1 TYR 41 1HD TYR 41 -1.804 1.591 -4.275
299 HD2 TYR 41 2HD TYR 41 -1.485 1.818 -0.051
300 HE1 TYR 41 1HE TYR 41 -4.108 2.482 -4.148
301 HE2 TYR 41 2HE TYR 41 -3.780 2.693 0.089
302 HH TYR 41 HH TYR 41 -5.284 3.925 -1.350
303 H GLN 42 H GLN 42 2.156 0.002 -4.410
304 HA GLN 42 HA GLN 42 4.207 -1.493 -3.360
305 1HB GLN 42 1HB GLN 42 5.717 0.020 -4.552
306 2HB GLN 42 2HB GLN 42 4.511 1.256 -4.744
307 1HG GLN 42 1HG GLN 42 3.162 -0.439 -6.020
308 2HG GLN 42 2HG GLN 42 4.580 -1.471 -5.994
309 1HE2 GLN 42 1HE2 GLN 42 6.440 -0.762 -7.036
310 2HE2 GLN 42 2HE2 GLN 42 6.385 0.383 -8.330
311 H ALA 43 H ALA 43 5.821 -1.199 -1.702
312 HA ALA 43 HA ALA 43 5.347 1.125 0.019
313 1HB ALA 43 1HB ALA 43 5.403 -1.679 0.997
314 2HB ALA 43 2HB ALA 43 3.981 -0.690 0.736
315 3HB ALA 43 3HB ALA 43 5.163 -0.226 1.977
316 H MET 44 H MET 44 7.702 -0.034 -1.586
317 HA MET 44 HA MET 44 9.596 -1.126 0.301
318 1HB MET 44 1HB MET 44 11.285 -0.922 -1.511
319 2HB MET 44 2HB MET 44 10.089 -0.086 -2.489
320 1HG MET 44 1HG MET 44 8.653 -2.078 -2.417
321 2HG MET 44 2HG MET 44 9.892 -2.910 -1.479
322 1HE MET 44 1HE MET 44 12.313 -3.518 -2.412
323 2HE MET 44 2HE MET 44 12.587 -1.841 -2.898
324 3HE MET 44 3HE MET 44 12.853 -3.146 -4.048
325 H CYS 45 H CYS 45 9.020 2.069 -0.781
326 HA CYS 45 HA CYS 45 11.486 3.326 0.079
327 1HB CYS 45 1HB CYS 45 8.840 4.706 -0.260
328 2HB CYS 45 2HB CYS 45 9.474 4.004 -1.737
329 HA PRO 46 HA PRO 46 9.609 4.372 4.362
330 1HB PRO 46 1HB PRO 46 10.775 2.799 5.568
331 2HB PRO 46 2HB PRO 46 11.976 4.066 5.791
332 1HG PRO 46 1HG PRO 46 12.150 1.667 4.140
333 2HG PRO 46 2HG PRO 46 13.426 2.829 4.534
334 1HD PRO 46 1HD PRO 46 12.458 2.553 2.009
335 2HD PRO 46 2HD PRO 46 13.043 4.103 2.650
336 H HIS 47 H HIS 47 9.379 6.684 4.183
337 HA HIS 47 HA HIS 47 11.687 8.508 3.779
338 1HB HIS 47 1HB HIS 47 8.758 9.305 4.163
339 2HB HIS 47 2HB HIS 47 9.399 8.815 2.616
340 HD2 HIS 47 2HD HIS 47 10.174 11.744 5.126
341 HE1 HIS 47 1HE HIS 47 10.398 13.428 1.279
342 HE2 HIS 47 2HE HIS 47 10.012 13.803 3.677
343 H GLN 48 H GLN 48 9.703 7.536 6.341
344 HA GLN 48 HA GLN 48 11.361 9.149 8.114
345 1HB GLN 48 1HB GLN 48 8.819 7.545 8.615
346 2HB GLN 48 2HB GLN 48 8.913 9.298 8.512
347 1HG GLN 48 1HG GLN 48 10.142 7.573 10.653
348 2HG GLN 48 2HG GLN 48 8.724 8.599 10.819
349 1HE2 GLN 48 1HE2 GLN 48 8.982 10.816 10.915
350 2HE2 GLN 48 2HE2 GLN 48 10.504 11.554 11.258
351 H GLU 49 H GLU 49 13.174 8.012 8.652
352 HA GLU 49 HA GLU 49 13.128 5.260 8.039
353 1HB GLU 49 1HB GLU 49 15.099 6.297 7.333
354 2HB GLU 49 2HB GLU 49 15.567 5.211 8.622
355 1HG GLU 49 1HG GLU 49 15.790 7.044 10.162
356 2HG GLU 49 2HG GLU 49 15.231 8.179 8.930
357 H ILE 50 H ILE 50 11.785 4.393 9.209
358 HA ILE 50 HA ILE 50 12.648 3.254 11.703
359 HB ILE 50 HB ILE 50 11.297 5.392 12.229
360 1HG1 ILE 50 1HG1 ILE 50 11.350 3.533 13.870
361 2HG1 ILE 50 2HG1 ILE 50 9.920 2.823 13.135
362 1HG2 ILE 50 1HG2 ILE 50 9.809 5.409 10.345
363 2HG2 ILE 50 2HG2 ILE 50 8.870 5.402 11.839
364 3HG2 ILE 50 3HG2 ILE 50 9.034 3.923 10.896
365 1HD1 ILE 50 1HD1 ILE 50 10.035 5.482 14.508
366 2HD1 ILE 50 2HD1 ILE 50 9.339 3.992 15.144
367 3HD1 ILE 50 3HD1 ILE 50 8.613 4.776 13.740
368 H LEU 51 H LEU 51 10.005 1.809 11.914
369 HA LEU 51 HA LEU 51 10.272 0.085 9.710
370 1HB LEU 51 1HB LEU 51 8.160 -0.935 10.503
371 2HB LEU 51 2HB LEU 51 7.938 0.401 11.611
372 HG LEU 51 HG LEU 51 9.930 -0.278 12.860
373 1HD1 LEU 51 1HD1 LEU 51 8.063 -2.584 12.393
374 2HD1 LEU 51 2HD1 LEU 51 7.777 -1.229 13.480
375 3HD1 LEU 51 3HD1 LEU 51 9.102 -2.351 13.798
376 1HD2 LEU 51 1HD2 LEU 51 11.080 -2.389 12.338
377 2HD2 LEU 51 2HD2 LEU 51 11.262 -1.210 11.047
378 3HD2 LEU 51 3HD2 LEU 51 10.119 -2.540 10.866
379 H LEU 52 H LEU 52 9.554 0.210 7.771
380 HA LEU 52 HA LEU 52 8.697 2.607 6.689
381 1HB LEU 52 1HB LEU 52 9.990 1.045 5.380
382 2HB LEU 52 2HB LEU 52 8.531 1.460 4.531
383 HG LEU 52 HG LEU 52 7.567 -0.756 5.111
384 1HD1 LEU 52 1HD1 LEU 52 10.245 -0.800 3.742
385 2HD1 LEU 52 2HD1 LEU 52 8.690 -0.426 3.000
386 3HD1 LEU 52 3HD1 LEU 52 9.009 -2.048 3.614
387 1HD2 LEU 52 1HD2 LEU 52 9.053 -2.517 5.934
388 2HD2 LEU 52 2HD2 LEU 52 8.820 -1.257 7.138
389 3HD2 LEU 52 3HD2 LEU 52 10.326 -1.326 6.214
390 H SER 53 H SER 53 6.749 -0.268 7.322
391 HA SER 53 HA SER 53 4.327 0.587 6.099
392 1HB SER 53 1HB SER 53 4.877 -1.651 6.553
393 2HB SER 53 2HB SER 53 3.436 -1.157 7.389
394 HG SER 53 HG SER 53 4.512 -1.625 9.244
395 H GLU 54 H GLU 54 5.768 1.349 9.102
396 HA GLU 54 HA GLU 54 3.319 2.440 10.187
397 1HB GLU 54 1HB GLU 54 4.826 3.265 12.030
398 2HB GLU 54 2HB GLU 54 6.156 2.486 11.187
399 1HG GLU 54 1HG GLU 54 5.400 1.043 12.929
400 2HG GLU 54 2HG GLU 54 4.963 0.333 11.378
401 H GLY 55 H GLY 55 5.226 3.576 7.781
402 1HA GLY 55 1HA GLY 55 6.170 5.966 8.007
403 2HA GLY 55 2HA GLY 55 4.525 6.330 8.504
404 H SER 56 H SER 56 3.206 4.565 6.625
405 HA SER 56 HA SER 56 3.999 5.755 4.108
406 1HB SER 56 1HB SER 56 2.915 3.908 3.046
407 2HB SER 56 2HB SER 56 2.326 3.302 4.596
408 HG SER 56 HG SER 56 5.056 3.603 3.921
409 H TYR 57 H TYR 57 0.994 4.471 5.193
410 HA TYR 57 HA TYR 57 -0.326 6.695 3.831
411 1HB TYR 57 1HB TYR 57 -1.305 4.093 4.986
412 2HB TYR 57 2HB TYR 57 -1.081 4.481 3.297
413 HD1 TYR 57 1HD TYR 57 -2.598 6.364 2.315
414 HD2 TYR 57 2HD TYR 57 -3.417 4.231 5.898
415 HE1 TYR 57 1HE TYR 57 -4.986 6.876 2.074
416 HE2 TYR 57 2HE TYR 57 -5.798 4.748 5.672
417 HH TYR 57 HH TYR 57 -7.220 6.313 4.594
418 H GLU 58 H GLU 58 -0.639 8.434 4.928
419 HA GLU 58 HA GLU 58 -1.566 8.274 7.698
420 1HB GLU 58 1HB GLU 58 -0.533 10.476 8.048
421 2HB GLU 58 2HB GLU 58 0.049 10.471 6.388
422 1HG GLU 58 1HG GLU 58 1.440 8.524 6.874
423 2HG GLU 58 2HG GLU 58 0.841 8.500 8.529
424 H GLY 59 H GLY 59 -3.704 8.491 7.547
425 1HA GLY 59 1HA GLY 59 -4.840 10.975 6.765
426 2HA GLY 59 2HA GLY 59 -5.711 9.560 7.332
427 H GLY 60 H GLY 60 -4.131 10.921 4.624
428 1HA GLY 60 1HA GLY 60 -5.907 10.874 2.635
429 2HA GLY 60 2HA GLY 60 -5.511 9.159 2.717
430 H VAL 61 H VAL 61 -2.760 10.520 3.652
431 HA VAL 61 HA VAL 61 -1.776 10.977 0.937
432 HB VAL 61 HB VAL 61 -0.580 11.840 3.597
433 1HG1 VAL 61 1HG1 VAL 61 0.986 13.160 2.252
434 2HG1 VAL 61 2HG1 VAL 61 0.274 12.502 0.781
435 3HG1 VAL 61 3HG1 VAL 61 1.122 11.437 1.899
436 1HG2 VAL 61 1HG2 VAL 61 -1.179 14.125 2.923
437 2HG2 VAL 61 2HG2 VAL 61 -2.605 13.102 3.093
438 3HG2 VAL 61 3HG2 VAL 61 -1.978 13.486 1.490
439 H ILE 62 H ILE 62 -0.167 9.634 0.210
440 HA ILE 62 HA ILE 62 0.586 7.511 2.061
441 HB ILE 62 HB ILE 62 0.510 7.450 -0.962
442 1HG1 ILE 62 1HG1 ILE 62 -1.646 7.316 0.139
443 2HG1 ILE 62 2HG1 ILE 62 -1.059 5.977 1.133
444 1HG2 ILE 62 1HG2 ILE 62 2.419 6.133 -0.132
445 2HG2 ILE 62 2HG2 ILE 62 1.161 5.068 -0.762
446 3HG2 ILE 62 3HG2 ILE 62 1.350 5.276 0.977
447 1HD1 ILE 62 1HD1 ILE 62 -2.455 5.165 -0.651
448 2HD1 ILE 62 2HD1 ILE 62 -0.794 4.602 -0.835
449 3HD1 ILE 62 3HD1 ILE 62 -1.396 5.920 -1.841
450 H THR 63 H THR 63 2.563 7.273 2.626
451 HA THR 63 HA THR 63 4.502 8.956 1.321
452 HB THR 63 HB THR 63 4.575 7.698 4.090
453 HG1 THR 63 1HG THR 63 2.871 8.996 4.067
454 1HG2 THR 63 1HG2 THR 63 6.734 8.475 3.171
455 2HG2 THR 63 2HG2 THR 63 6.216 9.466 4.535
456 3HG2 THR 63 3HG2 THR 63 6.028 10.065 2.885
457 H CYS 64 H CYS 64 6.524 7.874 1.032
458 HA CYS 64 HA CYS 64 6.546 5.096 1.116
459 1HB CYS 64 1HB CYS 64 5.992 5.574 -1.304
460 2HB CYS 64 2HB CYS 64 7.643 5.198 -1.477
461 H ARG 65 H ARG 65 9.672 6.566 0.117
462 HA ARG 65 HA ARG 65 11.180 7.153 2.645
463 1HB ARG 65 1HB ARG 65 12.437 6.259 -0.037
464 2HB ARG 65 2HB ARG 65 12.123 5.132 1.245
465 1HG ARG 65 1HG ARG 65 13.887 5.936 2.577
466 2HG ARG 65 2HG ARG 65 14.121 7.399 1.668
467 1HD ARG 65 1HD ARG 65 15.861 5.834 1.093
468 2HD ARG 65 2HD ARG 65 14.798 5.979 -0.297
469 HE ARG 65 HE ARG 65 14.895 3.730 1.569
470 1HH1 ARG 65 1HH1 ARG 65 14.073 5.006 -1.678
471 2HH1 ARG 65 2HH1 ARG 65 13.689 3.482 -2.298
472 1HH2 ARG 65 1HH2 ARG 65 14.350 1.593 0.585
473 2HH2 ARG 65 2HH2 ARG 65 13.834 1.570 -1.035
474 H ALA 66 H ALA 66 13.518 8.592 0.941
475 HA ALA 66 HA ALA 66 12.491 11.144 1.412
476 1HB ALA 66 1HB ALA 66 14.595 12.029 0.855
477 2HB ALA 66 2HB ALA 66 15.005 10.606 -0.106
478 3HB ALA 66 3HB ALA 66 14.828 10.469 1.642
479 H HIS 67 H HIS 67 10.925 12.008 0.405
480 HA HIS 67 HA HIS 67 10.619 12.934 -2.456
481 1HB HIS 67 1HB HIS 67 8.710 14.315 -1.499
482 2HB HIS 67 2HB HIS 67 8.866 13.555 0.029
483 HD2 HIS 67 2HD HIS 67 7.028 13.004 -3.262
484 HE1 HIS 67 1HE HIS 67 5.708 10.164 -0.444
485 HE2 HIS 67 2HE HIS 67 5.690 10.918 -2.845
486 H LEU 68 H LEU 68 9.843 15.407 -2.388
487 HA LEU 68 HA LEU 68 10.729 16.897 -0.032
488 1HB LEU 68 1HB LEU 68 11.135 18.125 -2.755
489 2HB LEU 68 2HB LEU 68 12.326 16.974 -2.206
490 HG LEU 68 HG LEU 68 12.893 18.404 -0.307
491 1HD1 LEU 68 1HD1 LEU 68 13.944 20.202 -1.531
492 2HD1 LEU 68 2HD1 LEU 68 12.949 19.819 -2.936
493 3HD1 LEU 68 3HD1 LEU 68 14.122 18.642 -2.335
494 1HD2 LEU 68 1HD2 LEU 68 10.954 20.401 -1.476
495 2HD2 LEU 68 2HD2 LEU 68 12.064 20.703 -0.137
496 3HD2 LEU 68 3HD2 LEU 68 10.750 19.540 0.045
497 H TRP 69 H TRP 69 8.403 15.769 -1.663
498 HA TRP 69 HA TRP 69 6.459 17.878 -1.417
499 1HB TRP 69 1HB TRP 69 5.586 17.232 -3.760
500 2HB TRP 69 2HB TRP 69 7.114 16.380 -3.953
501 HD1 TRP 69 HD TRP 69 5.765 19.958 -3.648
502 HE1 TRP 69 1HE TRP 69 7.500 21.573 -4.639
503 HE3 TRP 69 3HE TRP 69 9.574 16.663 -4.550
504 HZ2 TRP 69 2HZ TRP 69 10.109 21.484 -5.665
505 HZ3 TRP 69 3HZ TRP 69 11.654 17.516 -5.542
506 HH2 TRP 69 HH TRP 69 11.914 19.878 -6.088
507 H THR 70 H THR 70 4.356 16.182 -2.717
508 HA THR 70 HA THR 70 4.341 13.885 -0.791
509 HB THR 70 HB THR 70 1.914 14.271 -0.488
510 HG1 THR 70 1HG THR 70 2.457 16.405 -2.255
511 1HG2 THR 70 1HG2 THR 70 3.666 16.626 0.248
512 2HG2 THR 70 2HG2 THR 70 3.508 15.130 1.172
513 3HG2 THR 70 3HG2 THR 70 2.130 16.218 1.012
514 H PHE 71 H PHE 71 2.871 12.179 -1.175
515 HA PHE 71 HA PHE 71 2.268 11.650 -4.014
516 1HB PHE 71 1HB PHE 71 2.789 9.605 -1.839
517 2HB PHE 71 2HB PHE 71 4.113 10.275 -2.767
518 HD1 PHE 71 1HD PHE 71 4.770 9.350 -4.741
519 HD2 PHE 71 2HD PHE 71 0.932 8.399 -3.184
520 HE1 PHE 71 1HE PHE 71 4.495 7.646 -6.486
521 HE2 PHE 71 2HE PHE 71 0.656 6.690 -4.937
522 HZ PHE 71 HZ PHE 71 2.435 6.316 -6.578
523 H ASN 72 H ASN 72 0.031 10.740 -4.289
524 HA ASN 72 HA ASN 72 -1.536 11.089 -1.802
525 1HB ASN 72 1HB ASN 72 -2.408 11.861 -4.571
526 2HB ASN 72 2HB ASN 72 -1.756 12.983 -3.391
527 1HD2 ASN 72 1HD2 ASN 72 -2.950 13.444 -1.541
528 2HD2 ASN 72 2HD2 ASN 72 -4.644 13.145 -1.452
529 H ASP 73 H ASP 73 -3.153 9.804 -1.276
530 HA ASP 73 HA ASP 73 -3.283 7.163 -2.373
531 1HB ASP 73 1HB ASP 73 -4.728 8.591 -0.154
532 2HB ASP 73 2HB ASP 73 -3.526 7.323 -0.014
533 H GLY 74 H GLY 74 -5.630 9.779 -2.054
534 1HA GLY 74 1HA GLY 74 -7.656 10.190 -3.078
535 2HA GLY 74 2HA GLY 74 -7.817 8.451 -3.240
536 H THR 75 H THR 75 -5.398 10.530 -4.627
537 HA THR 75 HA THR 75 -6.514 10.380 -7.261
538 HB THR 75 HB THR 75 -3.825 11.356 -6.258
539 HG1 THR 75 1HG THR 75 -6.179 12.739 -7.006
540 1HG2 THR 75 1HG2 THR 75 -5.171 11.850 -8.934
541 2HG2 THR 75 2HG2 THR 75 -3.781 10.813 -8.671
542 3HG2 THR 75 3HG2 THR 75 -3.643 12.551 -8.395
543 H GLY 76 H GLY 76 -4.172 8.617 -5.361
544 1HA GLY 76 1HA GLY 76 -4.038 6.373 -7.102
545 2HA GLY 76 2HA GLY 76 -3.002 6.700 -5.725
546 H HIS 77 H HIS 77 -1.816 9.033 -6.455
547 HA HIS 77 HA HIS 77 -0.055 8.191 -8.547
548 1HB HIS 77 1HB HIS 77 -1.719 10.680 -8.889
549 2HB HIS 77 2HB HIS 77 -2.139 9.168 -9.663
550 HD1 HIS 77 1HD HIS 77 -1.059 8.638 -11.834
551 HD2 HIS 77 2HD HIS 77 0.663 11.846 -9.899
552 HE1 HIS 77 1HE HIS 77 0.506 9.655 -13.509
553 HE2 HIS 77 2HE HIS 77 1.065 11.853 -12.420
554 H GLY 78 H GLY 78 1.893 9.504 -8.431
555 1HA GLY 78 1HA GLY 78 3.383 10.691 -7.201
556 2HA GLY 78 2HA GLY 78 2.150 10.887 -5.958
557 H ILE 79 H ILE 79 2.021 13.072 -5.634
558 HA ILE 79 HA ILE 79 1.080 14.692 -7.802
559 HB ILE 79 HB ILE 79 2.127 15.555 -5.069
560 1HG1 ILE 79 1HG1 ILE 79 -0.236 15.673 -4.375
561 2HG1 ILE 79 2HG1 ILE 79 0.233 14.033 -4.803
562 1HG2 ILE 79 1HG2 ILE 79 0.856 17.624 -5.444
563 2HG2 ILE 79 2HG2 ILE 79 0.374 17.039 -7.036
564 3HG2 ILE 79 3HG2 ILE 79 2.071 17.383 -6.704
565 1HD1 ILE 79 1HD1 ILE 79 -1.988 14.545 -5.622
566 2HD1 ILE 79 2HD1 ILE 79 -0.878 14.257 -6.960
567 3HD1 ILE 79 3HD1 ILE 79 -1.351 15.906 -6.546
568 H ASN 80 H ASN 80 4.005 14.150 -6.017
569 HA ASN 80 HA ASN 80 5.489 14.869 -8.358
570 1HB ASN 80 1HB ASN 80 6.233 15.824 -5.604
571 2HB ASN 80 2HB ASN 80 5.541 16.876 -6.820
572 1HD2 ASN 80 1HD2 ASN 80 6.853 17.456 -8.600
573 2HD2 ASN 80 2HD2 ASN 80 8.563 17.181 -8.607
574 HA PRO 81 HA PRO 81 6.888 14.128 -9.397
575 1HB PRO 81 1HB PRO 81 8.860 12.993 -9.672
576 2HB PRO 81 2HB PRO 81 7.829 12.031 -10.740
577 1HG PRO 81 1HG PRO 81 9.221 10.935 -8.696
578 2HG PRO 81 2HG PRO 81 7.657 10.305 -9.231
579 1HD PRO 81 1HD PRO 81 8.337 11.716 -6.753
580 2HD PRO 81 2HD PRO 81 6.894 10.763 -7.142
581 H ASP 82 H ASP 82 5.676 13.937 -11.280
582 HA ASP 82 HA ASP 82 3.191 12.444 -11.132
583 1HB ASP 82 1HB ASP 82 4.316 14.295 -13.261
584 2HB ASP 82 2HB ASP 82 3.130 14.716 -12.037
585 H ASP 83 H ASP 83 6.259 12.042 -12.324
586 HA ASP 83 HA ASP 83 6.033 10.455 -14.564
587 1HB ASP 83 1HB ASP 83 8.009 10.332 -12.347
588 2HB ASP 83 2HB ASP 83 8.172 11.271 -13.827
589 H CYS 84 H CYS 84 5.482 9.549 -11.188
590 HA CYS 84 HA CYS 84 4.704 6.950 -12.168
591 1HB CYS 84 1HB CYS 84 5.701 5.902 -10.159
592 2HB CYS 84 2HB CYS 84 6.460 7.435 -9.770
593 HG CYS 84 HG CYS 84 7.921 7.415 -12.336
594 H CYS 85 H CYS 85 3.389 5.816 -10.712
595 HA CYS 85 HA CYS 85 1.924 7.345 -8.723
596 1HB CYS 85 1HB CYS 85 0.573 7.493 -10.721
597 2HB CYS 85 2HB CYS 85 -0.171 6.390 -9.593
598 HG CYS 85 HG CYS 85 1.267 5.707 -12.564
599 H LEU 86 H LEU 86 0.166 5.447 -8.000
600 HA LEU 86 HA LEU 86 1.969 3.347 -7.025
601 1HB LEU 86 1HB LEU 86 1.027 4.505 -5.191
602 2HB LEU 86 2HB LEU 86 0.209 2.968 -5.282
603 HG LEU 86 HG LEU 86 -0.995 5.548 -6.283
604 1HD1 LEU 86 1HD1 LEU 86 -3.114 4.369 -6.198
605 2HD1 LEU 86 2HD1 LEU 86 -2.277 2.880 -5.756
606 3HD1 LEU 86 3HD1 LEU 86 -1.992 3.618 -7.331
607 1HD2 LEU 86 1HD2 LEU 86 -1.399 4.154 -3.659
608 2HD2 LEU 86 2HD2 LEU 86 -2.351 5.509 -4.232
609 3HD2 LEU 86 3HD2 LEU 86 -0.639 5.722 -3.885
610 H ALA 87 H ALA 87 1.529 1.253 -7.129
611 HA ALA 87 HA ALA 87 -0.450 0.531 -9.138
612 1HB ALA 87 1HB ALA 87 1.833 -1.073 -7.978
613 2HB ALA 87 2HB ALA 87 1.854 -0.225 -9.522
614 3HB ALA 87 3HB ALA 87 0.761 -1.590 -9.280
615 H GLU 88 H GLU 88 -2.346 -0.016 -8.322
616 HA GLU 88 HA GLU 88 -2.631 -0.993 -5.629
617 1HB GLU 88 1HB GLU 88 -4.999 -1.259 -6.234
618 2HB GLU 88 2HB GLU 88 -4.634 -0.718 -7.855
619 1HG GLU 88 1HG GLU 88 -4.001 1.451 -7.028
620 2HG GLU 88 2HG GLU 88 -4.331 0.904 -5.376
621 H TYR 89 H TYR 89 -2.297 -3.001 -5.181
622 HA TYR 89 HA TYR 89 -2.580 -5.009 -7.241
623 1HB TYR 89 1HB TYR 89 -1.642 -6.558 -5.536
624 2HB TYR 89 2HB TYR 89 -1.653 -5.248 -4.360
625 HD1 TYR 89 1HD TYR 89 0.011 -3.514 -4.423
626 HD2 TYR 89 2HD TYR 89 -0.089 -6.509 -7.438
627 HE1 TYR 89 1HE TYR 89 2.222 -2.789 -5.210
628 HE2 TYR 89 2HE TYR 89 2.120 -5.796 -8.227
629 HH TYR 89 HH TYR 89 3.485 -3.863 -8.169
630 HA PRO 90 HA PRO 90 -6.807 -5.536 -5.984
631 1HB PRO 90 1HB PRO 90 -7.691 -6.898 -7.603
632 2HB PRO 90 2HB PRO 90 -6.582 -8.207 -7.228
633 1HG PRO 90 1HG PRO 90 -6.191 -5.820 -9.000
634 2HG PRO 90 2HG PRO 90 -5.663 -7.492 -9.257
635 1HD PRO 90 1HD PRO 90 -3.973 -5.575 -8.446
636 2HD PRO 90 2HD PRO 90 -3.821 -7.250 -7.871
637 H VAL 91 H VAL 91 -7.287 -6.049 -3.999
638 HA VAL 91 HA VAL 91 -6.250 -8.542 -2.952
639 HB VAL 91 HB VAL 91 -4.912 -6.771 -2.058
640 1HG1 VAL 91 1HG1 VAL 91 -7.455 -5.490 -1.089
641 2HG1 VAL 91 2HG1 VAL 91 -6.390 -4.897 -2.363
642 3HG1 VAL 91 3HG1 VAL 91 -5.821 -4.949 -0.697
643 1HG2 VAL 91 1HG2 VAL 91 -6.852 -7.767 0.005
644 2HG2 VAL 91 2HG2 VAL 91 -5.266 -7.075 0.350
645 3HG2 VAL 91 3HG2 VAL 91 -5.396 -8.586 -0.552
646 H GLU 92 H GLU 92 -7.608 -9.776 -1.946
647 HA GLU 92 HA GLU 92 -10.385 -8.825 -1.795
648 1HB GLU 92 1HB GLU 92 -9.418 -11.614 -2.354
649 2HB GLU 92 2HB GLU 92 -9.855 -10.414 -3.568
650 1HG GLU 92 1HG GLU 92 -12.087 -10.377 -2.883
651 2HG GLU 92 2HG GLU 92 -11.811 -11.386 -1.497
652 H VAL 93 H VAL 93 -11.360 -9.065 -0.023
653 HA VAL 93 HA VAL 93 -10.057 -10.486 2.190
654 HB VAL 93 HB VAL 93 -10.033 -8.102 2.551
655 1HG1 VAL 93 1HG1 VAL 93 -11.865 -7.378 1.179
656 2HG1 VAL 93 2HG1 VAL 93 -12.091 -6.772 2.823
657 3HG1 VAL 93 3HG1 VAL 93 -13.023 -8.158 2.256
658 1HG2 VAL 93 1HG2 VAL 93 -10.312 -9.478 4.543
659 2HG2 VAL 93 2HG2 VAL 93 -12.063 -9.430 4.348
660 3HG2 VAL 93 3HG2 VAL 93 -11.174 -7.951 4.721
661 H LYS 94 H LYS 94 -11.059 -12.252 2.825
662 HA LYS 94 HA LYS 94 -13.995 -12.289 2.679
663 1HB LYS 94 1HB LYS 94 -14.040 -14.598 1.993
664 2HB LYS 94 2HB LYS 94 -12.306 -14.766 2.209
665 1HG LYS 94 1HG LYS 94 -13.413 -12.849 0.189
666 2HG LYS 94 2HG LYS 94 -13.239 -14.566 -0.185
667 1HD LYS 94 1HD LYS 94 -10.948 -13.024 0.976
668 2HD LYS 94 2HD LYS 94 -11.219 -12.936 -0.747
669 1HE LYS 94 1HE LYS 94 -10.801 -15.445 0.846
670 2HE LYS 94 2HE LYS 94 -9.614 -14.640 -0.189
671 1HZ LYS 94 1HZ LYS 94 -10.612 -16.436 -1.383
672 2HZ LYS 94 2HZ LYS 94 -11.180 -14.961 -2.055
673 3HZ LYS 94 3HZ LYS 94 -12.161 -15.869 -1.052
674 H GLY 95 H GLY 95 -14.429 -11.938 4.737
675 1HA GLY 95 1HA GLY 95 -13.894 -14.025 6.609
676 2HA GLY 95 2HA GLY 95 -14.706 -12.501 6.954
677 H ASP 96 H ASP 96 -12.002 -14.277 7.311
678 HA ASP 96 HA ASP 96 -10.528 -11.946 8.333
679 1HB ASP 96 1HB ASP 96 -10.417 -14.852 9.215
680 2HB ASP 96 2HB ASP 96 -11.066 -13.455 10.084
681 H ASP 97 H ASP 97 -10.631 -13.978 5.815
682 HA ASP 97 HA ASP 97 -7.703 -14.221 5.629
683 1HB ASP 97 1HB ASP 97 -8.122 -15.692 3.726
684 2HB ASP 97 2HB ASP 97 -9.849 -15.524 3.962
685 H ILE 98 H ILE 98 -6.527 -13.190 4.222
686 HA ILE 98 HA ILE 98 -7.891 -11.564 2.237
687 HB ILE 98 HB ILE 98 -5.688 -10.759 4.129
688 1HG1 ILE 98 1HG1 ILE 98 -8.067 -10.561 4.838
689 2HG1 ILE 98 2HG1 ILE 98 -8.340 -9.539 3.443
690 1HG2 ILE 98 1HG2 ILE 98 -5.021 -10.000 1.905
691 2HG2 ILE 98 2HG2 ILE 98 -5.516 -8.639 2.910
692 3HG2 ILE 98 3HG2 ILE 98 -6.608 -9.267 1.675
693 1HD1 ILE 98 1HD1 ILE 98 -6.484 -8.852 5.686
694 2HD1 ILE 98 2HD1 ILE 98 -8.124 -8.229 5.441
695 3HD1 ILE 98 3HD1 ILE 98 -6.855 -7.865 4.266
696 H TYR 99 H TYR 99 -7.351 -11.943 0.324
697 HA TYR 99 HA TYR 99 -4.770 -13.222 -0.325
698 1HB TYR 99 1HB TYR 99 -5.973 -14.007 -2.392
699 2HB TYR 99 2HB TYR 99 -7.446 -13.408 -1.677
700 HD1 TYR 99 1HD TYR 99 -7.846 -14.361 0.844
701 HD2 TYR 99 2HD TYR 99 -5.558 -16.277 -2.174
702 HE1 TYR 99 1HE TYR 99 -8.190 -16.534 1.957
703 HE2 TYR 99 2HE TYR 99 -5.888 -18.438 -1.062
704 HH TYR 99 HH TYR 99 -6.401 -19.279 1.171
705 H VAL 100 H VAL 100 -3.629 -12.458 -2.015
706 HA VAL 100 HA VAL 100 -4.591 -9.940 -3.159
707 HB VAL 100 HB VAL 100 -2.910 -9.457 -1.525
708 1HG1 VAL 100 1HG1 VAL 100 -1.034 -11.182 -3.147
709 2HG1 VAL 100 2HG1 VAL 100 -1.631 -11.521 -1.524
710 3HG1 VAL 100 3HG1 VAL 100 -0.539 -10.161 -1.795
711 1HG2 VAL 100 1HG2 VAL 100 -2.997 -7.960 -3.412
712 2HG2 VAL 100 2HG2 VAL 100 -1.893 -8.987 -4.326
713 3HG2 VAL 100 3HG2 VAL 100 -1.318 -8.129 -2.897
714 H SER 101 H SER 101 -4.190 -9.531 -5.179
715 HA SER 101 HA SER 101 -3.333 -11.766 -6.877
716 1HB SER 101 1HB SER 101 -4.986 -9.331 -7.570
717 2HB SER 101 2HB SER 101 -5.682 -10.891 -7.130
718 HG SER 101 HG SER 101 -4.824 -11.783 -8.880
719 H THR 102 H THR 102 -1.450 -11.439 -8.016
720 HA THR 102 HA THR 102 -0.566 -8.670 -8.291
721 HB THR 102 HB THR 102 1.804 -9.583 -8.253
722 HG1 THR 102 1HG THR 102 1.931 -11.571 -7.037
723 1HG2 THR 102 1HG2 THR 102 0.125 -9.882 -5.753
724 2HG2 THR 102 2HG2 THR 102 0.824 -8.378 -6.352
725 3HG2 THR 102 3HG2 THR 102 1.877 -9.677 -5.790
726 H LYS 103 H LYS 103 -1.552 -11.344 -9.973
727 HA LYS 103 HA LYS 103 0.137 -11.052 -12.278
728 1HB LYS 103 1HB LYS 103 -2.506 -12.468 -11.918
729 2HB LYS 103 2HB LYS 103 -0.934 -13.206 -11.725
730 1HG LYS 103 1HG LYS 103 -0.472 -12.859 -14.109
731 2HG LYS 103 2HG LYS 103 -2.050 -12.103 -14.301
732 1HD LYS 103 1HD LYS 103 -3.125 -14.191 -13.569
733 2HD LYS 103 2HD LYS 103 -1.539 -14.944 -13.407
734 1HE LYS 103 1HE LYS 103 -1.134 -14.623 -15.800
735 2HE LYS 103 2HE LYS 103 -2.714 -13.867 -15.969
736 1HZ LYS 103 1HZ LYS 103 -3.742 -15.931 -15.280
737 2HZ LYS 103 2HZ LYS 103 -2.246 -16.668 -15.105
738 3HZ LYS 103 3HZ LYS 103 -2.776 -16.189 -16.628
739 H GLY 104 H GLY 104 -0.063 -9.473 -13.701
740 1HA GLY 104 1HA GLY 104 -2.754 -8.416 -14.241
741 2HA GLY 104 2HA GLY 104 -1.445 -8.495 -15.415
742 H ILE 105 H ILE 105 -0.997 -7.466 -12.137
743 HA ILE 105 HA ILE 105 -0.540 -4.769 -13.147
744 HB ILE 105 HB ILE 105 -1.665 -5.566 -10.457
745 1HG1 ILE 105 1HG1 ILE 105 -3.263 -5.655 -12.332
746 2HG1 ILE 105 2HG1 ILE 105 -2.868 -3.992 -12.745
747 1HG2 ILE 105 1HG2 ILE 105 -0.984 -2.810 -11.517
748 2HG2 ILE 105 2HG2 ILE 105 -0.133 -3.656 -10.225
749 3HG2 ILE 105 3HG2 ILE 105 -1.805 -3.142 -9.991
750 1HD1 ILE 105 1HD1 ILE 105 -4.953 -4.086 -11.590
751 2HD1 ILE 105 2HD1 ILE 105 -3.759 -3.253 -10.586
752 3HD1 ILE 105 3HD1 ILE 105 -4.207 -4.925 -10.240
753 H LEU 106 H LEU 106 1.530 -4.483 -13.248
754 HA LEU 106 HA LEU 106 3.309 -5.783 -11.426
755 1HB LEU 106 1HB LEU 106 4.985 -4.765 -12.988
756 2HB LEU 106 2HB LEU 106 3.658 -4.172 -13.943
757 HG LEU 106 HG LEU 106 4.175 -7.113 -13.505
758 1HD1 LEU 106 1HD1 LEU 106 2.675 -7.441 -15.393
759 2HD1 LEU 106 2HD1 LEU 106 2.387 -5.703 -15.475
760 3HD1 LEU 106 3HD1 LEU 106 1.864 -6.617 -14.063
761 1HD2 LEU 106 1HD2 LEU 106 5.070 -7.128 -15.779
762 2HD2 LEU 106 2HD2 LEU 106 6.036 -6.131 -14.695
763 3HD2 LEU 106 3HD2 LEU 106 4.926 -5.372 -15.841
764 HA PRO 107 HA PRO 107 4.145 -2.018 -9.045
765 1HB PRO 107 1HB PRO 107 5.868 -3.034 -7.916
766 2HB PRO 107 2HB PRO 107 6.913 -2.166 -9.044
767 1HG PRO 107 1HG PRO 107 6.986 -4.816 -8.844
768 2HG PRO 107 2HG PRO 107 7.184 -4.006 -10.409
769 1HD PRO 107 1HD PRO 107 4.777 -5.371 -9.267
770 2HD PRO 107 2HD PRO 107 5.430 -5.437 -10.920
771 H ASN 108 H ASN 108 4.631 0.131 -9.604
772 HA ASN 108 HA ASN 108 5.088 0.611 -12.374
773 1HB ASN 108 1HB ASN 108 4.766 2.980 -11.686
774 2HB ASN 108 2HB ASN 108 4.596 2.431 -10.026
775 1HD2 ASN 108 1HD2 ASN 108 2.533 3.139 -9.837
776 2HD2 ASN 108 2HD2 ASN 108 1.185 2.418 -10.631
777 H LYS 109 H LYS 109 6.588 2.417 -12.993
778 HA LYS 109 HA LYS 109 9.159 1.664 -13.046
779 1HB LYS 109 1HB LYS 109 9.768 4.044 -13.503
780 2HB LYS 109 2HB LYS 109 8.122 4.465 -13.078
781 1HG LYS 109 1HG LYS 109 7.319 2.997 -14.926
782 2HG LYS 109 2HG LYS 109 9.000 2.746 -15.388
783 1HD LYS 109 1HD LYS 109 8.036 4.483 -16.784
784 2HD LYS 109 2HD LYS 109 9.252 5.191 -15.717
785 1HE LYS 109 1HE LYS 109 7.514 5.968 -14.207
786 2HE LYS 109 2HE LYS 109 6.276 5.222 -15.200
787 1HZ LYS 109 1HZ LYS 109 6.333 7.485 -15.628
788 2HZ LYS 109 2HZ LYS 109 6.946 6.799 -17.027
789 3HZ LYS 109 3HZ LYS 109 7.968 7.565 -15.901
790 H ALA 110 H ALA 110 8.030 3.904 -10.763
791 HA ALA 110 HA ALA 110 10.547 4.477 -9.564
792 1HB ALA 110 1HB ALA 110 7.875 4.816 -8.235
793 2HB ALA 110 2HB ALA 110 8.615 5.979 -9.335
794 3HB ALA 110 3HB ALA 110 9.385 5.611 -7.789
795 H HIS 111 H HIS 111 8.242 2.013 -8.866
796 HA HIS 111 HA HIS 111 8.256 0.179 -7.564
797 1HB HIS 111 1HB HIS 111 10.303 -0.497 -6.208
798 2HB HIS 111 2HB HIS 111 11.115 0.919 -6.847
799 HD1 HIS 111 1HD HIS 111 10.186 -2.553 -7.719
800 HD2 HIS 111 2HD HIS 111 11.795 0.792 -9.577
801 HE1 HIS 111 1HE HIS 111 11.185 -3.388 -9.851
802 HE2 HIS 111 2HE HIS 111 12.411 -1.403 -10.773
803 H SER 112 H SER 112 9.428 3.093 -6.221
804 HA SER 112 HA SER 112 9.254 4.123 -4.304
805 1HB SER 112 1HB SER 112 7.083 4.718 -5.114
806 2HB SER 112 2HB SER 112 6.867 4.309 -3.418
807 HG SER 112 HG SER 112 6.438 2.145 -4.301
Start of MODEL 15
1 1H MET 1 1HT MET 1 -4.822 -17.147 -6.274
2 2H MET 1 2HT MET 1 -4.924 -18.780 -6.586
3 3H MET 1 3HT MET 1 -6.058 -17.724 -7.241
4 HA MET 1 HA MET 1 -3.182 -17.742 -7.917
5 1HB MET 1 1HB MET 1 -3.935 -18.488 -10.150
6 2HB MET 1 2HB MET 1 -5.604 -18.491 -9.590
7 1HG MET 1 1HG MET 1 -4.613 -20.735 -9.675
8 2HG MET 1 2HG MET 1 -5.135 -20.281 -8.054
9 1HE MET 1 1HE MET 1 -3.685 -22.211 -6.949
10 2HE MET 1 2HE MET 1 -1.982 -22.477 -7.310
11 3HE MET 1 3HE MET 1 -3.200 -22.734 -8.560
12 H SER 2 H SER 2 -2.481 -15.964 -9.079
13 HA SER 2 HA SER 2 -2.367 -13.744 -9.461
14 1HB SER 2 1HB SER 2 -5.354 -13.961 -10.093
15 2HB SER 2 2HB SER 2 -4.054 -14.079 -11.276
16 HG SER 2 HG SER 2 -3.838 -11.994 -11.284
17 H PHE 3 H PHE 3 -5.598 -13.999 -8.052
18 HA PHE 3 HA PHE 3 -4.952 -12.243 -5.864
19 1HB PHE 3 1HB PHE 3 -7.255 -12.924 -5.080
20 2HB PHE 3 2HB PHE 3 -7.374 -13.965 -6.487
21 HD1 PHE 3 1HD PHE 3 -7.749 -10.631 -5.223
22 HD2 PHE 3 2HD PHE 3 -7.381 -12.937 -8.780
23 HE1 PHE 3 1HE PHE 3 -8.671 -8.763 -6.525
24 HE2 PHE 3 2HE PHE 3 -8.301 -11.069 -10.093
25 HZ PHE 3 HZ PHE 3 -8.947 -8.980 -8.966
26 H GLU 4 H GLU 4 -3.814 -12.962 -4.262
27 HA GLU 4 HA GLU 4 -3.981 -15.799 -3.520
28 1HB GLU 4 1HB GLU 4 -1.566 -13.968 -3.417
29 2HB GLU 4 2HB GLU 4 -1.847 -15.166 -4.670
30 1HG GLU 4 1HG GLU 4 -1.496 -15.779 -1.752
31 2HG GLU 4 2HG GLU 4 -0.241 -15.924 -2.983
32 H LYS 5 H LYS 5 -4.068 -16.136 -1.276
33 HA LYS 5 HA LYS 5 -4.864 -13.870 0.265
34 1HB LYS 5 1HB LYS 5 -4.348 -16.718 1.132
35 2HB LYS 5 2HB LYS 5 -5.914 -15.954 0.833
36 1HG LYS 5 1HG LYS 5 -5.520 -14.425 2.674
37 2HG LYS 5 2HG LYS 5 -3.950 -15.141 2.972
38 1HD LYS 5 1HD LYS 5 -5.089 -17.300 3.437
39 2HD LYS 5 2HD LYS 5 -6.630 -16.437 3.321
40 1HE LYS 5 1HE LYS 5 -6.028 -16.467 5.650
41 2HE LYS 5 2HE LYS 5 -5.754 -14.853 5.041
42 1HZ LYS 5 1HZ LYS 5 -3.366 -15.346 4.856
43 2HZ LYS 5 2HZ LYS 5 -3.642 -16.891 5.424
44 3HZ LYS 5 3HZ LYS 5 -3.913 -15.597 6.430
45 H ILE 6 H ILE 6 -3.695 -12.601 1.317
46 HA ILE 6 HA ILE 6 -0.904 -13.344 1.805
47 HB ILE 6 HB ILE 6 -1.259 -11.336 0.443
48 1HG1 ILE 6 1HG1 ILE 6 -0.096 -10.723 3.170
49 2HG1 ILE 6 2HG1 ILE 6 0.177 -9.756 1.725
50 1HG2 ILE 6 1HG2 ILE 6 -2.645 -10.204 2.844
51 2HG2 ILE 6 2HG2 ILE 6 -3.381 -10.625 1.316
52 3HG2 ILE 6 3HG2 ILE 6 -2.229 -9.272 1.394
53 1HD1 ILE 6 1HD1 ILE 6 1.275 -11.659 0.653
54 2HD1 ILE 6 2HD1 ILE 6 1.033 -12.616 2.116
55 3HD1 ILE 6 3HD1 ILE 6 2.071 -11.197 2.155
56 H CYS 7 H CYS 7 -3.772 -11.988 3.233
57 HA CYS 7 HA CYS 7 -2.780 -12.623 5.894
58 1HB CYS 7 1HB CYS 7 -3.330 -10.377 6.746
59 2HB CYS 7 2HB CYS 7 -3.600 -9.837 5.101
60 HG CYS 7 HG CYS 7 -0.906 -9.958 6.823
61 H SER 8 H SER 8 -4.459 -11.779 7.519
62 HA SER 8 HA SER 8 -7.158 -12.097 6.564
63 1HB SER 8 1HB SER 8 -6.837 -14.215 7.614
64 2HB SER 8 2HB SER 8 -7.574 -13.181 8.808
65 HG SER 8 HG SER 8 -4.910 -12.891 9.047
66 H LEU 9 H LEU 9 -8.678 -11.010 7.890
67 HA LEU 9 HA LEU 9 -8.003 -8.399 8.650
68 1HB LEU 9 1HB LEU 9 -10.322 -10.085 9.578
69 2HB LEU 9 2HB LEU 9 -10.257 -9.399 7.988
70 HG LEU 9 HG LEU 9 -11.795 -8.107 9.292
71 1HD1 LEU 9 1HD1 LEU 9 -11.217 -6.908 11.322
72 2HD1 LEU 9 2HD1 LEU 9 -9.633 -7.703 11.323
73 3HD1 LEU 9 3HD1 LEU 9 -11.100 -8.662 11.507
74 1HD2 LEU 9 1HD2 LEU 9 -10.450 -6.835 7.744
75 2HD2 LEU 9 2HD2 LEU 9 -9.224 -6.574 8.987
76 3HD2 LEU 9 3HD2 LEU 9 -10.831 -5.869 9.167
77 H ASP 10 H ASP 10 -7.907 -11.400 10.312
78 HA ASP 10 HA ASP 10 -7.769 -10.542 12.996
79 1HB ASP 10 1HB ASP 10 -6.571 -13.002 11.705
80 2HB ASP 10 2HB ASP 10 -8.173 -12.884 12.418
81 H ASP 11 H ASP 11 -5.329 -10.617 10.455
82 HA ASP 11 HA ASP 11 -3.411 -9.653 12.441
83 1HB ASP 11 1HB ASP 11 -2.700 -11.813 11.473
84 2HB ASP 11 2HB ASP 11 -1.561 -10.525 11.135
85 H ILE 12 H ILE 12 -5.239 -8.675 9.844
86 HA ILE 12 HA ILE 12 -3.679 -6.225 9.798
87 HB ILE 12 HB ILE 12 -3.209 -7.005 7.698
88 1HG1 ILE 12 1HG1 ILE 12 -5.536 -5.143 7.284
89 2HG1 ILE 12 2HG1 ILE 12 -4.375 -5.554 6.048
90 1HG2 ILE 12 1HG2 ILE 12 -4.854 -7.827 6.024
91 2HG2 ILE 12 2HG2 ILE 12 -6.104 -7.683 7.262
92 3HG2 ILE 12 3HG2 ILE 12 -4.778 -8.824 7.479
93 1HD1 ILE 12 1HD1 ILE 12 -3.712 -4.168 8.648
94 2HD1 ILE 12 2HD1 ILE 12 -3.829 -3.398 7.065
95 3HD1 ILE 12 3HD1 ILE 12 -2.559 -4.581 7.377
96 H TRP 13 H TRP 13 -4.632 -4.745 10.662
97 HA TRP 13 HA TRP 13 -7.522 -4.898 11.069
98 1HB TRP 13 1HB TRP 13 -7.061 -3.433 13.041
99 2HB TRP 13 2HB TRP 13 -5.352 -3.545 12.652
100 HD1 TRP 13 HD TRP 13 -4.380 -6.241 12.620
101 HE1 TRP 13 1HE TRP 13 -4.877 -8.081 14.349
102 HE3 TRP 13 3HE TRP 13 -8.655 -4.319 14.686
103 HZ2 TRP 13 2HZ TRP 13 -6.804 -8.640 16.322
104 HZ3 TRP 13 3HZ TRP 13 -9.754 -5.575 16.489
105 HH2 TRP 13 HH TRP 13 -8.845 -7.694 17.286
106 H VAL 14 H VAL 14 -8.618 -2.820 11.353
107 HA VAL 14 HA VAL 14 -8.253 -1.197 9.041
108 HB VAL 14 HB VAL 14 -10.139 -0.833 11.391
109 1HG1 VAL 14 1HG1 VAL 14 -11.466 0.539 9.869
110 2HG1 VAL 14 2HG1 VAL 14 -10.219 0.373 8.633
111 3HG1 VAL 14 3HG1 VAL 14 -9.863 1.224 10.138
112 1HG2 VAL 14 1HG2 VAL 14 -11.831 -1.875 9.966
113 2HG2 VAL 14 2HG2 VAL 14 -10.489 -2.979 10.268
114 3HG2 VAL 14 3HG2 VAL 14 -10.618 -2.147 8.720
115 H GLY 15 H GLY 15 -7.076 0.546 8.878
116 1HA GLY 15 1HA GLY 15 -6.504 2.175 11.244
117 2HA GLY 15 2HA GLY 15 -6.324 2.687 9.569
118 H GLU 16 H GLU 16 -5.232 -0.409 9.982
119 HA GLU 16 HA GLU 16 -2.506 0.422 10.575
120 1HB GLU 16 1HB GLU 16 -2.228 -2.208 10.660
121 2HB GLU 16 2HB GLU 16 -3.961 -2.166 10.861
122 1HG GLU 16 1HG GLU 16 -1.954 -0.870 12.682
123 2HG GLU 16 2HG GLU 16 -2.868 -2.333 13.001
124 H MET 17 H MET 17 -0.806 -0.396 9.377
125 HA MET 17 HA MET 17 -1.320 -1.465 6.737
126 1HB MET 17 1HB MET 17 -1.505 0.941 6.377
127 2HB MET 17 2HB MET 17 -0.052 0.286 5.627
128 1HG MET 17 1HG MET 17 1.270 1.074 7.545
129 2HG MET 17 2HG MET 17 -0.181 1.814 8.214
130 1HE MET 17 1HE MET 17 1.976 4.844 7.112
131 2HE MET 17 2HE MET 17 2.573 3.300 7.713
132 3HE MET 17 3HE MET 17 1.153 4.046 8.451
133 H GLU 18 H GLU 18 0.335 -2.672 6.116
134 HA GLU 18 HA GLU 18 2.950 -2.131 6.998
135 1HB GLU 18 1HB GLU 18 2.361 -3.225 8.944
136 2HB GLU 18 2HB GLU 18 3.399 -4.343 8.060
137 1HG GLU 18 1HG GLU 18 1.480 -5.611 7.340
138 2HG GLU 18 2HG GLU 18 0.413 -4.528 8.242
139 H THR 19 H THR 19 4.584 -3.503 6.023
140 HA THR 19 HA THR 19 3.582 -4.214 3.405
141 HB THR 19 HB THR 19 5.453 -2.571 3.508
142 HG1 THR 19 1HG THR 19 6.462 -4.914 2.281
143 1HG2 THR 19 1HG2 THR 19 6.724 -3.482 5.416
144 2HG2 THR 19 2HG2 THR 19 7.728 -3.381 3.958
145 3HG2 THR 19 3HG2 THR 19 7.072 -4.931 4.464
146 H PHE 20 H PHE 20 3.844 -6.069 2.434
147 HA PHE 20 HA PHE 20 5.165 -8.258 3.838
148 1HB PHE 20 1HB PHE 20 3.402 -9.798 2.958
149 2HB PHE 20 2HB PHE 20 2.490 -8.399 2.444
150 HD1 PHE 20 1HD PHE 20 1.340 -7.005 4.082
151 HD2 PHE 20 2HD PHE 20 3.610 -10.389 5.287
152 HE1 PHE 20 1HE PHE 20 0.285 -6.917 6.298
153 HE2 PHE 20 2HE PHE 20 2.565 -10.307 7.509
154 HZ PHE 20 HZ PHE 20 0.900 -8.570 8.020
155 H GLU 21 H GLU 21 6.014 -9.779 2.463
156 HA GLU 21 HA GLU 21 6.624 -8.700 -0.193
157 1HB GLU 21 1HB GLU 21 8.086 -10.736 1.496
158 2HB GLU 21 2HB GLU 21 8.506 -9.039 1.323
159 1HG GLU 21 1HG GLU 21 9.034 -9.340 -0.995
160 2HG GLU 21 2HG GLU 21 8.518 -11.027 -0.922
161 H THR 22 H THR 22 6.220 -9.877 -1.968
162 HA THR 22 HA THR 22 4.472 -12.182 -1.743
163 HB THR 22 HB THR 22 4.325 -12.064 -4.174
164 HG1 THR 22 1HG THR 22 5.587 -10.407 -5.261
165 1HG2 THR 22 1HG2 THR 22 4.360 -9.285 -3.003
166 2HG2 THR 22 2HG2 THR 22 2.994 -10.404 -2.925
167 3HG2 THR 22 3HG2 THR 22 3.531 -9.758 -4.481
168 H SER 23 H SER 23 5.064 -14.191 -3.146
169 HA SER 23 HA SER 23 7.620 -15.116 -2.388
170 1HB SER 23 1HB SER 23 7.018 -17.110 -3.639
171 2HB SER 23 2HB SER 23 5.688 -16.217 -4.377
172 HG SER 23 HG SER 23 6.024 -16.802 -1.611
173 H ASP 24 H ASP 24 6.592 -13.185 -4.936
174 HA ASP 24 HA ASP 24 8.694 -13.949 -6.797
175 1HB ASP 24 1HB ASP 24 7.743 -12.204 -8.263
176 2HB ASP 24 2HB ASP 24 6.638 -11.747 -6.974
177 H GLY 25 H GLY 25 8.492 -12.134 -4.074
178 1HA GLY 25 1HA GLY 25 10.992 -10.796 -4.714
179 2HA GLY 25 2HA GLY 25 10.291 -10.993 -3.117
180 H THR 26 H THR 26 7.708 -9.937 -4.572
181 HA THR 26 HA THR 26 8.419 -7.154 -4.865
182 HB THR 26 HB THR 26 5.693 -8.476 -4.946
183 HG1 THR 26 1HG THR 26 7.711 -8.102 -6.900
184 1HG2 THR 26 1HG2 THR 26 5.057 -6.484 -6.237
185 2HG2 THR 26 2HG2 THR 26 6.696 -5.854 -6.068
186 3HG2 THR 26 3HG2 THR 26 5.670 -6.025 -4.644
187 H GLU 27 H GLU 27 8.402 -5.770 -3.121
188 HA GLU 27 HA GLU 27 7.215 -6.633 -0.631
189 1HB GLU 27 1HB GLU 27 8.691 -4.109 -1.406
190 2HB GLU 27 2HB GLU 27 9.472 -5.605 -0.900
191 1HG GLU 27 1HG GLU 27 7.609 -4.052 0.838
192 2HG GLU 27 2HG GLU 27 9.363 -3.892 0.864
193 H VAL 28 H VAL 28 5.236 -5.951 -0.111
194 HA VAL 28 HA VAL 28 4.008 -3.759 -1.660
195 HB VAL 28 HB VAL 28 2.679 -6.376 -0.947
196 1HG1 VAL 28 1HG1 VAL 28 1.053 -4.618 -0.953
197 2HG1 VAL 28 2HG1 VAL 28 0.806 -5.658 -2.356
198 3HG1 VAL 28 3HG1 VAL 28 1.582 -4.087 -2.550
199 1HG2 VAL 28 1HG2 VAL 28 3.572 -5.394 -3.654
200 2HG2 VAL 28 2HG2 VAL 28 2.632 -6.856 -3.370
201 3HG2 VAL 28 3HG2 VAL 28 4.274 -6.726 -2.738
202 H LEU 29 H LEU 29 2.747 -2.487 -0.550
203 HA LEU 29 HA LEU 29 2.698 -2.610 2.369
204 1HB LEU 29 1HB LEU 29 2.025 -0.479 0.340
205 2HB LEU 29 2HB LEU 29 3.450 -0.565 1.348
206 HG LEU 29 HG LEU 29 0.648 -0.055 2.329
207 1HD1 LEU 29 1HD1 LEU 29 1.944 -1.224 3.991
208 2HD1 LEU 29 2HD1 LEU 29 1.722 0.468 4.455
209 3HD1 LEU 29 3HD1 LEU 29 3.263 -0.073 3.780
210 1HD2 LEU 29 1HD2 LEU 29 1.456 2.204 2.782
211 2HD2 LEU 29 2HD2 LEU 29 1.541 1.824 1.065
212 3HD2 LEU 29 3HD2 LEU 29 3.007 1.798 2.050
213 H ILE 30 H ILE 30 0.975 -3.643 3.212
214 HA ILE 30 HA ILE 30 -1.584 -3.641 1.806
215 HB ILE 30 HB ILE 30 -0.709 -5.116 4.314
216 1HG1 ILE 30 1HG1 ILE 30 -0.597 -7.139 2.914
217 2HG1 ILE 30 2HG1 ILE 30 0.533 -5.913 2.350
218 1HG2 ILE 30 1HG2 ILE 30 -3.113 -4.782 4.265
219 2HG2 ILE 30 2HG2 ILE 30 -2.729 -6.483 4.002
220 3HG2 ILE 30 3HG2 ILE 30 -3.195 -5.465 2.640
221 1HD1 ILE 30 1HD1 ILE 30 -0.948 -5.321 0.540
222 2HD1 ILE 30 2HD1 ILE 30 -2.129 -6.491 1.116
223 3HD1 ILE 30 3HD1 ILE 30 -0.567 -7.046 0.505
224 H VAL 31 H VAL 31 -2.898 -1.970 2.310
225 HA VAL 31 HA VAL 31 -2.788 -0.883 5.055
226 HB VAL 31 HB VAL 31 -3.752 0.516 2.550
227 1HG1 VAL 31 1HG1 VAL 31 -4.805 1.363 4.541
228 2HG1 VAL 31 2HG1 VAL 31 -3.680 2.561 3.903
229 3HG1 VAL 31 3HG1 VAL 31 -3.237 1.597 5.310
230 1HG2 VAL 31 1HG2 VAL 31 -1.370 0.169 2.355
231 2HG2 VAL 31 2HG2 VAL 31 -1.104 0.861 3.959
232 3HG2 VAL 31 3HG2 VAL 31 -1.701 1.875 2.646
233 H ASN 32 H ASN 32 -4.644 -1.335 6.197
234 HA ASN 32 HA ASN 32 -7.050 -1.705 4.558
235 1HB ASN 32 1HB ASN 32 -6.496 -2.627 7.391
236 2HB ASN 32 2HB ASN 32 -6.506 -3.648 5.960
237 1HD2 ASN 32 1HD2 ASN 32 -8.052 -3.964 8.307
238 2HD2 ASN 32 2HD2 ASN 32 -9.712 -3.893 7.856
239 H SER 33 H SER 33 -7.986 0.142 4.334
240 HA SER 33 HA SER 33 -7.983 2.064 6.518
241 1HB SER 33 1HB SER 33 -8.562 2.338 3.588
242 2HB SER 33 2HB SER 33 -7.065 2.813 4.392
243 HG SER 33 HG SER 33 -8.000 4.494 5.252
244 H GLU 34 H GLU 34 -9.903 3.015 7.235
245 HA GLU 34 HA GLU 34 -12.308 1.510 6.837
246 1HB GLU 34 1HB GLU 34 -11.810 4.110 8.328
247 2HB GLU 34 2HB GLU 34 -11.788 2.508 9.030
248 1HG GLU 34 1HG GLU 34 -14.176 2.257 8.531
249 2HG GLU 34 2HG GLU 34 -14.198 3.898 7.885
250 H GLU 35 H GLU 35 -10.888 4.425 5.615
251 HA GLU 35 HA GLU 35 -13.317 5.277 4.232
252 1HB GLU 35 1HB GLU 35 -10.565 6.541 4.426
253 2HB GLU 35 2HB GLU 35 -11.903 6.894 5.490
254 1HG GLU 35 1HG GLU 35 -11.719 8.716 4.029
255 2HG GLU 35 2HG GLU 35 -13.154 7.828 3.552
256 H HIS 36 H HIS 36 -9.973 4.311 3.435
257 HA HIS 36 HA HIS 36 -10.557 4.344 0.582
258 1HB HIS 36 1HB HIS 36 -8.230 3.377 0.351
259 2HB HIS 36 2HB HIS 36 -8.061 3.509 2.085
260 HD1 HIS 36 1HD HIS 36 -7.414 5.780 3.081
261 HD2 HIS 36 2HD HIS 36 -8.151 5.866 -1.011
262 HE1 HIS 36 1HE HIS 36 -6.514 7.951 2.274
263 HE2 HIS 36 2HE HIS 36 -6.398 7.489 -0.151
264 H GLY 37 H GLY 37 -10.776 2.104 3.114
265 1HA GLY 37 1HA GLY 37 -11.377 -0.062 1.274
266 2HA GLY 37 2HA GLY 37 -11.545 -0.089 3.034
267 H VAL 38 H VAL 38 -10.369 -2.287 2.047
268 HA VAL 38 HA VAL 38 -7.607 -1.811 2.768
269 HB VAL 38 HB VAL 38 -8.672 -3.738 3.850
270 1HG1 VAL 38 1HG1 VAL 38 -10.303 -4.340 2.199
271 2HG1 VAL 38 2HG1 VAL 38 -9.309 -5.743 2.592
272 3HG1 VAL 38 3HG1 VAL 38 -9.036 -4.859 1.091
273 1HG2 VAL 38 1HG2 VAL 38 -6.541 -4.586 1.887
274 2HG2 VAL 38 2HG2 VAL 38 -7.014 -5.489 3.326
275 3HG2 VAL 38 3HG2 VAL 38 -6.282 -3.892 3.488
276 H LYS 39 H LYS 39 -6.106 -1.435 1.421
277 HA LYS 39 HA LYS 39 -6.348 -2.463 -1.297
278 1HB LYS 39 1HB LYS 39 -5.612 -0.328 -2.225
279 2HB LYS 39 2HB LYS 39 -5.535 0.374 -0.612
280 1HG LYS 39 1HG LYS 39 -7.954 0.135 -0.371
281 2HG LYS 39 2HG LYS 39 -8.037 -0.655 -1.943
282 1HD LYS 39 1HD LYS 39 -7.090 2.167 -1.554
283 2HD LYS 39 2HD LYS 39 -8.739 1.720 -1.986
284 1HE LYS 39 1HE LYS 39 -6.270 1.068 -3.600
285 2HE LYS 39 2HE LYS 39 -7.417 2.351 -3.948
286 1HZ LYS 39 1HZ LYS 39 -7.869 0.397 -5.279
287 2HZ LYS 39 2HZ LYS 39 -9.144 0.693 -4.227
288 3HZ LYS 39 3HZ LYS 39 -8.047 -0.546 -3.890
289 H ALA 40 H ALA 40 -4.263 -2.549 -2.438
290 HA ALA 40 HA ALA 40 -1.992 -2.657 -0.585
291 1HB ALA 40 1HB ALA 40 -2.720 -4.626 -2.758
292 2HB ALA 40 2HB ALA 40 -2.729 -4.925 -1.022
293 3HB ALA 40 3HB ALA 40 -1.205 -4.626 -1.858
294 H TYR 41 H TYR 41 -0.176 -1.755 -1.283
295 HA TYR 41 HA TYR 41 -0.023 -0.802 -4.068
296 1HB TYR 41 1HB TYR 41 0.802 1.332 -3.320
297 2HB TYR 41 2HB TYR 41 0.717 0.868 -1.640
298 HD1 TYR 41 1HD TYR 41 -1.392 1.485 -4.635
299 HD2 TYR 41 2HD TYR 41 -1.226 1.259 -0.393
300 HE1 TYR 41 1HE TYR 41 -3.654 2.429 -4.500
301 HE2 TYR 41 2HE TYR 41 -3.490 2.197 -0.248
302 HH TYR 41 HH TYR 41 -4.987 3.599 -1.605
303 H GLN 42 H GLN 42 2.276 -0.205 -4.608
304 HA GLN 42 HA GLN 42 4.033 -2.239 -3.672
305 1HB GLN 42 1HB GLN 42 4.164 -1.079 -5.956
306 2HB GLN 42 2HB GLN 42 5.697 -1.297 -5.235
307 1HG GLN 42 1HG GLN 42 5.617 1.046 -4.453
308 2HG GLN 42 2HG GLN 42 4.124 1.220 -5.379
309 1HE2 GLN 42 1HE2 GLN 42 4.220 1.172 -7.605
310 2HE2 GLN 42 2HE2 GLN 42 5.705 1.320 -8.470
311 H ALA 43 H ALA 43 5.818 -2.089 -2.217
312 HA ALA 43 HA ALA 43 5.511 0.052 -0.271
313 1HB ALA 43 1HB ALA 43 6.961 -1.277 1.146
314 2HB ALA 43 2HB ALA 43 7.280 -2.364 -0.204
315 3HB ALA 43 3HB ALA 43 5.659 -2.274 0.487
316 H MET 44 H MET 44 6.986 -0.063 -2.955
317 HA MET 44 HA MET 44 9.511 1.218 -2.112
318 1HB MET 44 1HB MET 44 8.543 0.292 -4.824
319 2HB MET 44 2HB MET 44 9.787 -0.468 -3.850
320 1HG MET 44 1HG MET 44 9.960 2.243 -5.167
321 2HG MET 44 2HG MET 44 10.756 0.773 -5.719
322 1HE MET 44 1HE MET 44 13.416 0.134 -2.946
323 2HE MET 44 2HE MET 44 12.742 -0.420 -4.481
324 3HE MET 44 3HE MET 44 11.788 -0.532 -3.008
325 H CYS 45 H CYS 45 9.920 3.439 -2.606
326 HA CYS 45 HA CYS 45 7.610 4.721 -3.816
327 1HB CYS 45 1HB CYS 45 8.192 5.197 -1.278
328 2HB CYS 45 2HB CYS 45 7.653 6.491 -2.314
329 HA PRO 46 HA PRO 46 9.996 6.210 -7.219
330 1HB PRO 46 1HB PRO 46 9.202 8.295 -7.897
331 2HB PRO 46 2HB PRO 46 9.256 8.949 -6.253
332 1HG PRO 46 1HG PRO 46 7.292 7.031 -7.477
333 2HG PRO 46 2HG PRO 46 6.966 8.477 -6.504
334 1HD PRO 46 1HD PRO 46 6.951 5.961 -5.468
335 2HD PRO 46 2HD PRO 46 7.414 7.389 -4.521
336 H HIS 47 H HIS 47 10.408 8.188 -4.320
337 HA HIS 47 HA HIS 47 13.163 8.622 -4.801
338 1HB HIS 47 1HB HIS 47 13.289 8.861 -2.133
339 2HB HIS 47 2HB HIS 47 11.541 8.961 -2.320
340 HD2 HIS 47 2HD HIS 47 14.543 10.740 -4.141
341 HE1 HIS 47 1HE HIS 47 11.606 13.632 -3.360
342 HE2 HIS 47 2HE HIS 47 13.965 13.208 -4.000
343 H GLN 48 H GLN 48 12.304 6.562 -1.971
344 HA GLN 48 HA GLN 48 14.032 4.447 -2.969
345 1HB GLN 48 1HB GLN 48 15.484 4.481 -0.978
346 2HB GLN 48 2HB GLN 48 14.698 5.937 -0.413
347 1HG GLN 48 1HG GLN 48 15.577 7.184 -2.301
348 2HG GLN 48 2HG GLN 48 16.363 5.722 -2.900
349 1HE2 GLN 48 1HE2 GLN 48 18.117 4.927 -1.853
350 2HE2 GLN 48 2HE2 GLN 48 19.021 5.816 -0.697
351 H GLU 49 H GLU 49 14.124 2.683 -1.191
352 HA GLU 49 HA GLU 49 11.534 2.602 0.101
353 1HB GLU 49 1HB GLU 49 12.244 0.569 -1.082
354 2HB GLU 49 2HB GLU 49 12.013 0.270 0.627
355 1HG GLU 49 1HG GLU 49 14.419 0.343 0.984
356 2HG GLU 49 2HG GLU 49 14.657 0.604 -0.746
357 H ILE 50 H ILE 50 11.235 2.848 2.187
358 HA ILE 50 HA ILE 50 13.408 2.850 4.064
359 HB ILE 50 HB ILE 50 13.744 4.975 2.943
360 1HG1 ILE 50 1HG1 ILE 50 14.178 4.963 5.362
361 2HG1 ILE 50 2HG1 ILE 50 12.524 5.472 5.678
362 1HG2 ILE 50 1HG2 ILE 50 11.630 5.351 1.976
363 2HG2 ILE 50 2HG2 ILE 50 12.060 6.766 2.941
364 3HG2 ILE 50 3HG2 ILE 50 10.888 5.600 3.554
365 1HD1 ILE 50 1HD1 ILE 50 12.945 7.581 4.536
366 2HD1 ILE 50 2HD1 ILE 50 14.607 7.077 4.222
367 3HD1 ILE 50 3HD1 ILE 50 14.058 7.325 5.881
368 H LEU 51 H LEU 51 10.805 1.672 3.479
369 HA LEU 51 HA LEU 51 9.093 0.775 4.501
370 1HB LEU 51 1HB LEU 51 8.913 0.783 6.958
371 2HB LEU 51 2HB LEU 51 10.214 1.953 7.032
372 HG LEU 51 HG LEU 51 11.757 0.309 6.070
373 1HD1 LEU 51 1HD1 LEU 51 11.517 0.487 8.475
374 2HD1 LEU 51 2HD1 LEU 51 11.870 -1.170 7.981
375 3HD1 LEU 51 3HD1 LEU 51 10.227 -0.714 8.446
376 1HD2 LEU 51 1HD2 LEU 51 9.393 -1.572 6.186
377 2HD2 LEU 51 2HD2 LEU 51 11.059 -2.037 5.849
378 3HD2 LEU 51 3HD2 LEU 51 10.197 -0.999 4.719
379 H LEU 52 H LEU 52 7.738 1.952 3.312
380 HA LEU 52 HA LEU 52 6.424 4.330 4.209
381 1HB LEU 52 1HB LEU 52 4.601 3.579 2.626
382 2HB LEU 52 2HB LEU 52 5.546 2.149 2.310
383 HG LEU 52 HG LEU 52 6.350 4.966 1.569
384 1HD1 LEU 52 1HD1 LEU 52 8.189 3.927 0.341
385 2HD1 LEU 52 2HD1 LEU 52 7.707 2.345 0.955
386 3HD1 LEU 52 3HD1 LEU 52 8.311 3.570 2.066
387 1HD2 LEU 52 1HD2 LEU 52 5.957 4.175 -0.718
388 2HD2 LEU 52 2HD2 LEU 52 4.499 4.087 0.292
389 3HD2 LEU 52 3HD2 LEU 52 5.413 2.629 -0.051
390 H SER 53 H SER 53 6.126 0.967 4.699
391 HA SER 53 HA SER 53 3.572 0.662 5.682
392 1HB SER 53 1HB SER 53 4.829 -1.064 4.814
393 2HB SER 53 2HB SER 53 4.659 -1.465 6.491
394 HG SER 53 HG SER 53 6.851 -1.023 6.762
395 H GLU 54 H GLU 54 6.526 1.752 7.143
396 HA GLU 54 HA GLU 54 5.329 1.656 9.782
397 1HB GLU 54 1HB GLU 54 7.745 2.390 10.440
398 2HB GLU 54 2HB GLU 54 8.156 1.845 8.827
399 1HG GLU 54 1HG GLU 54 7.056 0.207 11.105
400 2HG GLU 54 2HG GLU 54 8.619 0.048 10.328
401 H GLY 55 H GLY 55 5.276 3.895 7.361
402 1HA GLY 55 1HA GLY 55 5.991 6.186 8.949
403 2HA GLY 55 2HA GLY 55 4.266 5.892 8.917
404 H SER 56 H SER 56 3.054 6.323 7.038
405 HA SER 56 HA SER 56 4.132 8.238 5.298
406 1HB SER 56 1HB SER 56 3.441 7.002 3.274
407 2HB SER 56 2HB SER 56 3.158 5.579 4.266
408 HG SER 56 HG SER 56 5.612 6.882 3.730
409 H TYR 57 H TYR 57 1.630 5.910 5.539
410 HA TYR 57 HA TYR 57 -0.451 7.894 4.987
411 1HB TYR 57 1HB TYR 57 -0.541 4.895 5.417
412 2HB TYR 57 2HB TYR 57 -0.565 5.701 3.869
413 HD1 TYR 57 1HD TYR 57 -2.572 4.971 6.878
414 HD2 TYR 57 2HD TYR 57 -2.615 6.556 2.932
415 HE1 TYR 57 1HE TYR 57 -5.026 4.935 6.879
416 HE2 TYR 57 2HE TYR 57 -5.038 6.532 2.937
417 HH TYR 57 HH TYR 57 -6.799 6.166 5.738
418 H GLU 58 H GLU 58 -1.096 9.075 6.718
419 HA GLU 58 HA GLU 58 -1.739 7.504 9.018
420 1HB GLU 58 1HB GLU 58 0.076 8.744 9.849
421 2HB GLU 58 2HB GLU 58 -1.328 9.524 10.518
422 1HG GLU 58 1HG GLU 58 0.222 10.578 8.177
423 2HG GLU 58 2HG GLU 58 0.459 11.087 9.839
424 H GLY 59 H GLY 59 -3.716 7.218 9.409
425 1HA GLY 59 1HA GLY 59 -5.610 9.352 9.319
426 2HA GLY 59 2HA GLY 59 -5.967 7.655 9.616
427 H GLY 60 H GLY 60 -5.038 9.839 7.064
428 1HA GLY 60 1HA GLY 60 -7.054 9.686 5.308
429 2HA GLY 60 2HA GLY 60 -6.247 8.154 5.015
430 H VAL 61 H VAL 61 -4.164 10.761 5.936
431 HA VAL 61 HA VAL 61 -3.650 11.496 3.160
432 HB VAL 61 HB VAL 61 -2.590 12.663 5.742
433 1HG1 VAL 61 1HG1 VAL 61 -1.042 13.052 3.875
434 2HG1 VAL 61 2HG1 VAL 61 -1.816 14.567 4.345
435 3HG1 VAL 61 3HG1 VAL 61 -2.359 13.708 2.903
436 1HG2 VAL 61 1HG2 VAL 61 -4.711 13.710 3.871
437 2HG2 VAL 61 2HG2 VAL 61 -4.089 14.562 5.285
438 3HG2 VAL 61 3HG2 VAL 61 -4.978 13.051 5.481
439 H ILE 62 H ILE 62 -1.668 11.115 2.168
440 HA ILE 62 HA ILE 62 0.124 9.352 3.667
441 HB ILE 62 HB ILE 62 -0.257 9.577 0.703
442 1HG1 ILE 62 1HG1 ILE 62 -2.117 8.478 1.829
443 2HG1 ILE 62 2HG1 ILE 62 -0.958 7.424 2.648
444 1HG2 ILE 62 1HG2 ILE 62 2.056 9.010 1.236
445 2HG2 ILE 62 2HG2 ILE 62 1.233 7.610 0.544
446 3HG2 ILE 62 3HG2 ILE 62 1.509 7.699 2.283
447 1HD1 ILE 62 1HD1 ILE 62 -0.328 6.419 0.558
448 2HD1 ILE 62 2HD1 ILE 62 -1.418 7.501 -0.308
449 3HD1 ILE 62 3HD1 ILE 62 -2.071 6.292 0.804
450 H THR 63 H THR 63 1.932 10.107 4.229
451 HA THR 63 HA THR 63 3.293 12.256 2.765
452 HB THR 63 HB THR 63 4.104 10.602 5.186
453 HG1 THR 63 1HG THR 63 2.258 12.247 5.334
454 1HG2 THR 63 1HG2 THR 63 5.322 13.145 4.075
455 2HG2 THR 63 2HG2 THR 63 6.027 11.531 3.987
456 3HG2 THR 63 3HG2 THR 63 5.844 12.324 5.550
457 H CYS 64 H CYS 64 5.182 11.576 1.490
458 HA CYS 64 HA CYS 64 5.072 8.754 1.046
459 1HB CYS 64 1HB CYS 64 7.285 10.416 -0.140
460 2HB CYS 64 2HB CYS 64 5.639 10.569 -0.751
461 H ARG 65 H ARG 65 8.360 10.269 1.453
462 HA ARG 65 HA ARG 65 8.372 9.899 4.211
463 1HB ARG 65 1HB ARG 65 9.970 7.687 2.893
464 2HB ARG 65 2HB ARG 65 8.379 7.443 3.602
465 1HG ARG 65 1HG ARG 65 10.817 8.429 5.091
466 2HG ARG 65 2HG ARG 65 10.197 6.778 5.135
467 1HD ARG 65 1HD ARG 65 8.110 7.558 6.097
468 2HD ARG 65 2HD ARG 65 8.653 9.231 5.997
469 HE ARG 65 HE ARG 65 10.536 7.915 7.477
470 1HH1 ARG 65 1HH1 ARG 65 7.057 8.466 7.762
471 2HH1 ARG 65 2HH1 ARG 65 7.090 8.647 9.468
472 1HH2 ARG 65 1HH2 ARG 65 10.564 8.114 9.797
473 2HH2 ARG 65 2HH2 ARG 65 9.103 8.421 10.640
474 H ALA 66 H ALA 66 10.254 10.181 1.270
475 HA ALA 66 HA ALA 66 12.472 11.227 2.838
476 1HB ALA 66 1HB ALA 66 12.306 10.503 -0.086
477 2HB ALA 66 2HB ALA 66 13.008 9.500 1.182
478 3HB ALA 66 3HB ALA 66 13.751 11.046 0.766
479 H HIS 67 H HIS 67 10.158 12.014 0.349
480 HA HIS 67 HA HIS 67 11.285 14.713 0.296
481 1HB HIS 67 1HB HIS 67 10.578 13.809 -1.867
482 2HB HIS 67 2HB HIS 67 9.826 15.357 -1.546
483 HD2 HIS 67 2HD HIS 67 7.014 15.066 -0.717
484 HE1 HIS 67 1HE HIS 67 6.584 11.754 -3.274
485 HE2 HIS 67 2HE HIS 67 5.521 13.815 -2.362
486 H LEU 68 H LEU 68 9.369 16.541 0.058
487 HA LEU 68 HA LEU 68 8.978 17.078 2.705
488 1HB LEU 68 1HB LEU 68 7.426 18.921 1.971
489 2HB LEU 68 2HB LEU 68 7.648 18.376 0.336
490 HG LEU 68 HG LEU 68 9.862 19.409 2.118
491 1HD1 LEU 68 1HD1 LEU 68 10.711 17.875 0.453
492 2HD1 LEU 68 2HD1 LEU 68 11.198 19.531 0.085
493 3HD1 LEU 68 3HD1 LEU 68 9.888 18.773 -0.822
494 1HD2 LEU 68 1HD2 LEU 68 9.795 21.412 0.715
495 2HD2 LEU 68 2HD2 LEU 68 8.282 21.167 1.584
496 3HD2 LEU 68 3HD2 LEU 68 8.389 20.770 -0.131
497 H TRP 69 H TRP 69 6.138 16.498 0.509
498 HA TRP 69 HA TRP 69 4.981 15.473 2.953
499 1HB TRP 69 1HB TRP 69 2.812 16.662 2.526
500 2HB TRP 69 2HB TRP 69 3.673 17.636 1.341
501 HD1 TRP 69 HD TRP 69 5.183 19.598 2.252
502 HE1 TRP 69 1HE TRP 69 5.657 20.525 4.622
503 HE3 TRP 69 3HE TRP 69 3.047 15.886 5.047
504 HZ2 TRP 69 2HZ TRP 69 5.186 19.792 7.277
505 HZ3 TRP 69 3HZ TRP 69 3.105 16.080 7.498
506 HH2 TRP 69 HH TRP 69 4.151 17.993 8.586
507 H THR 70 H THR 70 3.172 15.915 -0.083
508 HA THR 70 HA THR 70 1.998 13.384 0.701
509 HB THR 70 HB THR 70 0.107 14.214 -0.694
510 HG1 THR 70 1HG THR 70 0.292 16.150 -1.625
511 1HG2 THR 70 1HG2 THR 70 0.139 14.391 1.776
512 2HG2 THR 70 2HG2 THR 70 -0.643 15.791 1.047
513 3HG2 THR 70 3HG2 THR 70 1.010 15.920 1.647
514 H PHE 71 H PHE 71 1.582 11.782 -0.534
515 HA PHE 71 HA PHE 71 1.798 11.882 -3.428
516 1HB PHE 71 1HB PHE 71 2.632 9.530 -1.667
517 2HB PHE 71 2HB PHE 71 3.805 10.644 -2.361
518 HD1 PHE 71 1HD PHE 71 1.396 7.980 -3.125
519 HD2 PHE 71 2HD PHE 71 4.414 10.552 -4.664
520 HE1 PHE 71 1HE PHE 71 1.502 6.640 -5.169
521 HE2 PHE 71 2HE PHE 71 4.517 9.202 -6.718
522 HZ PHE 71 HZ PHE 71 3.062 7.247 -6.971
523 H ASN 72 H ASN 72 -0.116 10.557 -4.270
524 HA ASN 72 HA ASN 72 -1.877 9.988 -2.002
525 1HB ASN 72 1HB ASN 72 -2.756 11.300 -4.575
526 2HB ASN 72 2HB ASN 72 -2.547 12.100 -3.024
527 1HD2 ASN 72 1HD2 ASN 72 -4.647 10.206 -4.972
528 2HD2 ASN 72 2HD2 ASN 72 -5.944 10.144 -3.841
529 H ASP 73 H ASP 73 -2.934 8.169 -1.862
530 HA ASP 73 HA ASP 73 -2.229 6.091 -3.707
531 1HB ASP 73 1HB ASP 73 -2.253 5.792 -1.232
532 2HB ASP 73 2HB ASP 73 -3.180 4.590 -2.112
533 H GLY 74 H GLY 74 -5.195 7.744 -2.743
534 1HA GLY 74 1HA GLY 74 -7.372 7.587 -3.495
535 2HA GLY 74 2HA GLY 74 -6.954 6.074 -4.280
536 H THR 75 H THR 75 -5.070 6.807 -5.954
537 HA THR 75 HA THR 75 -6.460 8.004 -8.130
538 HB THR 75 HB THR 75 -3.958 9.418 -7.094
539 HG1 THR 75 1HG THR 75 -6.576 9.810 -6.600
540 1HG2 THR 75 1HG2 THR 75 -4.093 9.369 -9.545
541 2HG2 THR 75 2HG2 THR 75 -4.341 11.004 -8.927
542 3HG2 THR 75 3HG2 THR 75 -5.719 10.048 -9.470
543 H GLY 76 H GLY 76 -3.365 7.062 -6.686
544 1HA GLY 76 1HA GLY 76 -2.681 5.360 -9.020
545 2HA GLY 76 2HA GLY 76 -2.133 5.217 -7.370
546 H HIS 77 H HIS 77 -2.227 7.674 -9.907
547 HA HIS 77 HA HIS 77 0.565 8.118 -9.588
548 1HB HIS 77 1HB HIS 77 0.187 10.187 -11.007
549 2HB HIS 77 2HB HIS 77 -1.518 9.773 -11.038
550 HD1 HIS 77 1HD HIS 77 -2.243 8.486 -12.985
551 HD2 HIS 77 2HD HIS 77 1.794 7.952 -12.190
552 HE1 HIS 77 1HE HIS 77 -1.359 7.078 -14.867
553 HE2 HIS 77 2HE HIS 77 1.112 6.966 -14.470
554 H GLY 78 H GLY 78 1.553 9.518 -8.330
555 1HA GLY 78 1HA GLY 78 1.711 10.730 -6.320
556 2HA GLY 78 2HA GLY 78 -0.047 10.781 -6.253
557 H ILE 79 H ILE 79 0.762 13.055 -5.543
558 HA ILE 79 HA ILE 79 0.451 14.805 -7.826
559 HB ILE 79 HB ILE 79 0.789 15.486 -4.865
560 1HG1 ILE 79 1HG1 ILE 79 -1.680 15.496 -6.620
561 2HG1 ILE 79 2HG1 ILE 79 -1.622 16.259 -5.043
562 1HG2 ILE 79 1HG2 ILE 79 1.640 17.310 -6.188
563 2HG2 ILE 79 2HG2 ILE 79 0.117 17.784 -5.434
564 3HG2 ILE 79 3HG2 ILE 79 0.160 17.349 -7.144
565 1HD1 ILE 79 1HD1 ILE 79 -2.697 14.093 -4.927
566 2HD1 ILE 79 2HD1 ILE 79 -1.211 14.120 -3.983
567 3HD1 ILE 79 3HD1 ILE 79 -1.240 13.327 -5.557
568 H ASN 80 H ASN 80 2.871 13.783 -5.555
569 HA ASN 80 HA ASN 80 4.907 14.917 -7.266
570 1HB ASN 80 1HB ASN 80 4.957 15.062 -4.303
571 2HB ASN 80 2HB ASN 80 4.484 16.465 -5.241
572 1HD2 ASN 80 1HD2 ASN 80 6.139 17.441 -6.530
573 2HD2 ASN 80 2HD2 ASN 80 7.812 17.236 -6.191
574 HA PRO 81 HA PRO 81 6.111 14.143 -8.374
575 1HB PRO 81 1HB PRO 81 7.766 12.998 -9.443
576 2HB PRO 81 2HB PRO 81 6.652 11.659 -9.733
577 1HG PRO 81 1HG PRO 81 8.527 12.111 -7.463
578 2HG PRO 81 2HG PRO 81 8.057 10.580 -8.222
579 1HD PRO 81 1HD PRO 81 7.072 11.271 -5.849
580 2HD PRO 81 2HD PRO 81 6.032 10.509 -7.072
581 H ASP 82 H ASP 82 4.731 14.318 -10.259
582 HA ASP 82 HA ASP 82 2.198 13.015 -9.837
583 1HB ASP 82 1HB ASP 82 2.169 15.387 -10.390
584 2HB ASP 82 2HB ASP 82 1.281 14.468 -11.593
585 H ASP 83 H ASP 83 4.842 12.481 -11.895
586 HA ASP 83 HA ASP 83 3.285 10.960 -13.826
587 1HB ASP 83 1HB ASP 83 5.378 12.169 -14.513
588 2HB ASP 83 2HB ASP 83 5.356 10.470 -14.953
589 H CYS 84 H CYS 84 4.365 10.366 -10.734
590 HA CYS 84 HA CYS 84 4.965 7.616 -11.338
591 1HB CYS 84 1HB CYS 84 6.014 7.539 -9.157
592 2HB CYS 84 2HB CYS 84 5.572 9.219 -8.881
593 HG CYS 84 HG CYS 84 7.098 9.393 -11.687
594 H CYS 85 H CYS 85 4.188 6.093 -10.054
595 HA CYS 85 HA CYS 85 1.690 6.549 -8.635
596 1HB CYS 85 1HB CYS 85 0.901 5.873 -10.728
597 2HB CYS 85 2HB CYS 85 0.913 4.411 -9.759
598 HG CYS 85 HG CYS 85 2.182 4.747 -12.659
599 H LEU 86 H LEU 86 1.053 4.183 -7.764
600 HA LEU 86 HA LEU 86 3.508 3.208 -6.434
601 1HB LEU 86 1HB LEU 86 2.449 4.884 -5.030
602 2HB LEU 86 2HB LEU 86 2.593 3.319 -4.259
603 HG LEU 86 HG LEU 86 0.261 2.897 -4.390
604 1HD1 LEU 86 1HD1 LEU 86 -0.564 4.604 -2.867
605 2HD1 LEU 86 2HD1 LEU 86 0.835 5.608 -3.247
606 3HD1 LEU 86 3HD1 LEU 86 1.057 4.046 -2.458
607 1HD2 LEU 86 1HD2 LEU 86 -1.363 4.555 -5.139
608 2HD2 LEU 86 2HD2 LEU 86 -0.320 4.046 -6.462
609 3HD2 LEU 86 3HD2 LEU 86 -0.067 5.609 -5.697
610 H ALA 87 H ALA 87 2.179 1.933 -8.344
611 HA ALA 87 HA ALA 87 1.042 0.026 -9.053
612 1HB ALA 87 1HB ALA 87 3.219 -0.814 -8.211
613 2HB ALA 87 2HB ALA 87 1.912 -2.001 -8.202
614 3HB ALA 87 3HB ALA 87 2.396 -1.227 -6.697
615 H GLU 88 H GLU 88 -1.106 0.008 -8.935
616 HA GLU 88 HA GLU 88 -2.339 -0.343 -6.338
617 1HB GLU 88 1HB GLU 88 -3.293 1.405 -7.723
618 2HB GLU 88 2HB GLU 88 -4.479 0.130 -7.498
619 1HG GLU 88 1HG GLU 88 -4.036 -0.734 -9.677
620 2HG GLU 88 2HG GLU 88 -2.781 0.470 -9.950
621 H TYR 89 H TYR 89 -2.596 -2.309 -5.606
622 HA TYR 89 HA TYR 89 -3.076 -4.488 -7.492
623 1HB TYR 89 1HB TYR 89 -2.530 -5.964 -5.559
624 2HB TYR 89 2HB TYR 89 -2.293 -4.520 -4.579
625 HD1 TYR 89 1HD TYR 89 -0.285 -3.276 -4.620
626 HD2 TYR 89 2HD TYR 89 -0.889 -6.459 -7.370
627 HE1 TYR 89 1HE TYR 89 2.096 -3.204 -5.226
628 HE2 TYR 89 2HE TYR 89 1.482 -6.392 -7.980
629 HH TYR 89 HH TYR 89 3.301 -4.892 -7.939
630 HA PRO 90 HA PRO 90 -7.291 -4.406 -6.020
631 1HB PRO 90 1HB PRO 90 -8.115 -5.171 -8.001
632 2HB PRO 90 2HB PRO 90 -8.085 -6.764 -7.252
633 1HG PRO 90 1HG PRO 90 -6.629 -6.003 -9.474
634 2HG PRO 90 2HG PRO 90 -6.296 -7.408 -8.470
635 1HD PRO 90 1HD PRO 90 -4.782 -4.938 -8.723
636 2HD PRO 90 2HD PRO 90 -4.316 -6.413 -7.879
637 H VAL 91 H VAL 91 -8.363 -5.288 -4.337
638 HA VAL 91 HA VAL 91 -7.154 -7.608 -3.009
639 HB VAL 91 HB VAL 91 -8.143 -5.044 -1.728
640 1HG1 VAL 91 1HG1 VAL 91 -8.522 -6.932 -0.292
641 2HG1 VAL 91 2HG1 VAL 91 -7.212 -5.936 0.351
642 3HG1 VAL 91 3HG1 VAL 91 -6.848 -7.448 -0.481
643 1HG2 VAL 91 1HG2 VAL 91 -6.050 -4.625 -2.842
644 2HG2 VAL 91 2HG2 VAL 91 -5.327 -6.045 -2.111
645 3HG2 VAL 91 3HG2 VAL 91 -5.776 -4.668 -1.100
646 H GLU 92 H GLU 92 -8.626 -9.009 -2.108
647 HA GLU 92 HA GLU 92 -11.431 -8.185 -2.051
648 1HB GLU 92 1HB GLU 92 -12.142 -10.474 -2.724
649 2HB GLU 92 2HB GLU 92 -10.469 -10.869 -3.038
650 1HG GLU 92 1HG GLU 92 -10.356 -9.338 -4.857
651 2HG GLU 92 2HG GLU 92 -11.937 -8.669 -4.454
652 H VAL 93 H VAL 93 -12.564 -8.831 -0.345
653 HA VAL 93 HA VAL 93 -11.060 -10.239 1.759
654 HB VAL 93 HB VAL 93 -13.419 -8.371 2.085
655 1HG1 VAL 93 1HG1 VAL 93 -13.263 -9.982 3.892
656 2HG1 VAL 93 2HG1 VAL 93 -12.826 -8.376 4.473
657 3HG1 VAL 93 3HG1 VAL 93 -11.568 -9.566 4.145
658 1HG2 VAL 93 1HG2 VAL 93 -11.799 -6.743 2.975
659 2HG2 VAL 93 2HG2 VAL 93 -11.505 -7.132 1.282
660 3HG2 VAL 93 3HG2 VAL 93 -10.487 -7.835 2.535
661 H LYS 94 H LYS 94 -11.826 -12.163 2.409
662 HA LYS 94 HA LYS 94 -14.652 -12.618 2.022
663 1HB LYS 94 1HB LYS 94 -13.509 -13.994 0.306
664 2HB LYS 94 2HB LYS 94 -14.358 -14.979 1.467
665 1HG LYS 94 1HG LYS 94 -12.373 -16.112 0.992
666 2HG LYS 94 2HG LYS 94 -12.180 -15.436 2.601
667 1HD LYS 94 1HD LYS 94 -10.784 -13.647 1.744
668 2HD LYS 94 2HD LYS 94 -10.975 -14.254 0.102
669 1HE LYS 94 1HE LYS 94 -9.638 -15.630 2.443
670 2HE LYS 94 2HE LYS 94 -8.875 -15.053 0.969
671 1HZ LYS 94 1HZ LYS 94 -10.831 -17.303 1.091
672 2HZ LYS 94 2HZ LYS 94 -9.184 -17.458 0.989
673 3HZ LYS 94 3HZ LYS 94 -10.011 -16.812 -0.294
674 H GLY 95 H GLY 95 -15.277 -12.198 3.989
675 1HA GLY 95 1HA GLY 95 -14.798 -14.175 5.989
676 2HA GLY 95 2HA GLY 95 -15.739 -12.700 6.181
677 H ASP 96 H ASP 96 -13.033 -14.272 7.023
678 HA ASP 96 HA ASP 96 -11.877 -11.821 8.225
679 1HB ASP 96 1HB ASP 96 -10.761 -13.342 9.778
680 2HB ASP 96 2HB ASP 96 -11.508 -14.717 8.975
681 H ASP 97 H ASP 97 -11.445 -13.671 5.594
682 HA ASP 97 HA ASP 97 -8.539 -13.393 5.823
683 1HB ASP 97 1HB ASP 97 -8.429 -15.188 4.107
684 2HB ASP 97 2HB ASP 97 -10.187 -15.338 4.253
685 H ILE 98 H ILE 98 -7.330 -12.675 3.988
686 HA ILE 98 HA ILE 98 -8.944 -11.031 2.153
687 HB ILE 98 HB ILE 98 -6.453 -10.292 3.681
688 1HG1 ILE 98 1HG1 ILE 98 -8.611 -10.122 4.934
689 2HG1 ILE 98 2HG1 ILE 98 -9.185 -8.987 3.694
690 1HG2 ILE 98 1HG2 ILE 98 -7.852 -8.684 1.531
691 2HG2 ILE 98 2HG2 ILE 98 -6.244 -9.389 1.419
692 3HG2 ILE 98 3HG2 ILE 98 -6.555 -8.089 2.563
693 1HD1 ILE 98 1HD1 ILE 98 -8.537 -7.853 5.614
694 2HD1 ILE 98 2HD1 ILE 98 -7.541 -7.442 4.202
695 3HD1 ILE 98 3HD1 ILE 98 -6.903 -8.513 5.467
696 H TYR 99 H TYR 99 -8.439 -11.187 0.056
697 HA TYR 99 HA TYR 99 -5.986 -12.534 -0.838
698 1HB TYR 99 1HB TYR 99 -7.023 -12.146 -3.123
699 2HB TYR 99 2HB TYR 99 -8.464 -11.656 -2.292
700 HD1 TYR 99 1HD TYR 99 -6.219 -14.576 -2.572
701 HD2 TYR 99 2HD TYR 99 -10.138 -13.105 -1.906
702 HE1 TYR 99 1HE TYR 99 -7.086 -16.859 -2.725
703 HE2 TYR 99 2HE TYR 99 -11.017 -15.366 -2.034
704 HH TYR 99 HH TYR 99 -10.382 -17.489 -3.045
705 H VAL 100 H VAL 100 -4.566 -11.468 -2.127
706 HA VAL 100 HA VAL 100 -5.285 -8.819 -3.064
707 HB VAL 100 HB VAL 100 -2.973 -8.014 -2.726
708 1HG1 VAL 100 1HG1 VAL 100 -2.963 -7.729 -0.314
709 2HG1 VAL 100 2HG1 VAL 100 -4.185 -8.991 -0.166
710 3HG1 VAL 100 3HG1 VAL 100 -4.573 -7.487 -0.993
711 1HG2 VAL 100 1HG2 VAL 100 -2.494 -10.611 -1.258
712 2HG2 VAL 100 2HG2 VAL 100 -1.366 -9.258 -1.327
713 3HG2 VAL 100 3HG2 VAL 100 -1.769 -10.145 -2.797
714 H SER 101 H SER 101 -4.739 -8.526 -5.194
715 HA SER 101 HA SER 101 -3.708 -10.912 -6.504
716 1HB SER 101 1HB SER 101 -4.809 -8.340 -7.640
717 2HB SER 101 2HB SER 101 -5.740 -9.820 -7.420
718 HG SER 101 HG SER 101 -4.587 -10.797 -9.085
719 H THR 102 H THR 102 -1.693 -11.097 -6.660
720 HA THR 102 HA THR 102 -0.051 -8.782 -7.389
721 HB THR 102 HB THR 102 1.747 -9.595 -5.863
722 HG1 THR 102 1HG THR 102 1.253 -11.625 -5.428
723 1HG2 THR 102 1HG2 THR 102 -0.834 -8.856 -4.462
724 2HG2 THR 102 2HG2 THR 102 0.322 -7.718 -5.149
725 3HG2 THR 102 3HG2 THR 102 0.780 -8.715 -3.767
726 H LYS 103 H LYS 103 -0.719 -12.200 -7.487
727 HA LYS 103 HA LYS 103 1.787 -12.892 -8.617
728 1HB LYS 103 1HB LYS 103 -0.752 -14.542 -8.653
729 2HB LYS 103 2HB LYS 103 0.350 -14.478 -7.291
730 1HG LYS 103 1HG LYS 103 1.106 -15.399 -10.053
731 2HG LYS 103 2HG LYS 103 0.682 -16.466 -8.707
732 1HD LYS 103 1HD LYS 103 2.529 -15.520 -7.399
733 2HD LYS 103 2HD LYS 103 2.969 -14.488 -8.754
734 1HE LYS 103 1HE LYS 103 3.502 -16.388 -10.117
735 2HE LYS 103 2HE LYS 103 2.958 -17.487 -8.853
736 1HZ LYS 103 1HZ LYS 103 4.708 -16.689 -7.428
737 2HZ LYS 103 2HZ LYS 103 5.252 -15.580 -8.564
738 3HZ LYS 103 3HZ LYS 103 5.392 -17.234 -8.861
739 H GLY 104 H GLY 104 2.233 -11.935 -10.412
740 1HA GLY 104 1HA GLY 104 0.327 -12.139 -12.648
741 2HA GLY 104 2HA GLY 104 2.077 -12.260 -12.828
742 H ILE 105 H ILE 105 1.344 -10.021 -10.470
743 HA ILE 105 HA ILE 105 1.293 -7.826 -12.421
744 HB ILE 105 HB ILE 105 0.376 -7.765 -9.538
745 1HG1 ILE 105 1HG1 ILE 105 -1.122 -9.127 -10.959
746 2HG1 ILE 105 2HG1 ILE 105 -1.274 -7.774 -12.075
747 1HG2 ILE 105 1HG2 ILE 105 -0.548 -5.557 -10.134
748 2HG2 ILE 105 2HG2 ILE 105 0.140 -5.712 -11.750
749 3HG2 ILE 105 3HG2 ILE 105 1.204 -5.604 -10.347
750 1HD1 ILE 105 1HD1 ILE 105 -2.316 -6.439 -10.324
751 2HD1 ILE 105 2HD1 ILE 105 -2.167 -7.789 -9.205
752 3HD1 ILE 105 3HD1 ILE 105 -3.202 -7.932 -10.624
753 H LEU 106 H LEU 106 3.271 -6.916 -12.614
754 HA LEU 106 HA LEU 106 5.041 -6.879 -10.376
755 1HB LEU 106 1HB LEU 106 6.448 -5.627 -12.101
756 2HB LEU 106 2HB LEU 106 5.217 -6.049 -13.255
757 HG LEU 106 HG LEU 106 6.868 -8.080 -11.748
758 1HD1 LEU 106 1HD1 LEU 106 6.015 -9.698 -13.348
759 2HD1 LEU 106 2HD1 LEU 106 5.030 -8.447 -14.098
760 3HD1 LEU 106 3HD1 LEU 106 4.695 -8.951 -12.442
761 1HD2 LEU 106 1HD2 LEU 106 8.036 -8.421 -13.868
762 2HD2 LEU 106 2HD2 LEU 106 8.271 -6.795 -13.232
763 3HD2 LEU 106 3HD2 LEU 106 7.151 -7.066 -14.568
764 HA PRO 107 HA PRO 107 3.700 -2.868 -9.040
765 1HB PRO 107 1HB PRO 107 5.182 -2.836 -7.305
766 2HB PRO 107 2HB PRO 107 6.146 -1.785 -8.349
767 1HG PRO 107 1HG PRO 107 7.062 -4.092 -7.406
768 2HG PRO 107 2HG PRO 107 7.528 -3.505 -9.018
769 1HD PRO 107 1HD PRO 107 5.560 -5.629 -8.250
770 2HD PRO 107 2HD PRO 107 6.682 -5.578 -9.627
771 H ASN 108 H ASN 108 3.206 -1.220 -10.256
772 HA ASN 108 HA ASN 108 4.753 -0.628 -12.565
773 1HB ASN 108 1HB ASN 108 2.502 -0.700 -13.103
774 2HB ASN 108 2HB ASN 108 2.897 1.023 -12.947
775 1HD2 ASN 108 1HD2 ASN 108 1.957 2.289 -11.472
776 2HD2 ASN 108 2HD2 ASN 108 0.673 1.760 -10.454
777 H LYS 109 H LYS 109 6.121 0.795 -12.774
778 HA LYS 109 HA LYS 109 7.497 2.554 -12.521
779 1HB LYS 109 1HB LYS 109 5.158 3.796 -11.037
780 2HB LYS 109 2HB LYS 109 5.457 3.925 -12.758
781 1HG LYS 109 1HG LYS 109 7.208 5.093 -10.608
782 2HG LYS 109 2HG LYS 109 6.047 5.977 -11.593
783 1HD LYS 109 1HD LYS 109 7.291 5.468 -13.603
784 2HD LYS 109 2HD LYS 109 8.411 4.462 -12.689
785 1HE LYS 109 1HE LYS 109 9.094 6.430 -11.389
786 2HE LYS 109 2HE LYS 109 8.000 7.428 -12.341
787 1HZ LYS 109 1HZ LYS 109 10.265 7.593 -13.140
788 2HZ LYS 109 2HZ LYS 109 9.251 6.923 -14.300
789 3HZ LYS 109 3HZ LYS 109 10.315 5.932 -13.453
790 H ALA 110 H ALA 110 8.889 3.678 -10.971
791 HA ALA 110 HA ALA 110 10.085 3.978 -9.140
792 1HB ALA 110 1HB ALA 110 9.214 3.651 -6.906
793 2HB ALA 110 2HB ALA 110 7.916 2.635 -7.529
794 3HB ALA 110 3HB ALA 110 7.957 4.355 -7.924
795 H HIS 111 H HIS 111 8.658 0.876 -8.515
796 HA HIS 111 HA HIS 111 11.349 -0.171 -8.050
797 1HB HIS 111 1HB HIS 111 8.711 -1.670 -7.826
798 2HB HIS 111 2HB HIS 111 9.489 -0.830 -6.497
799 HD1 HIS 111 1HD HIS 111 11.889 -1.857 -5.741
800 HD2 HIS 111 2HD HIS 111 9.541 -4.276 -8.158
801 HE1 HIS 111 1HE HIS 111 12.777 -4.163 -5.436
802 HE2 HIS 111 2HE HIS 111 11.657 -5.448 -7.234
803 H SER 112 H SER 112 9.434 0.302 -10.647
804 HA SER 112 HA SER 112 10.922 -1.623 -12.215
805 1HB SER 112 1HB SER 112 8.926 -2.125 -13.552
806 2HB SER 112 2HB SER 112 7.957 -1.065 -12.532
807 HG SER 112 HG SER 112 7.631 -2.675 -11.386
Start of MODEL 16
1 1H MET 1 1HT MET 1 -7.901 -19.693 -8.148
2 2H MET 1 2HT MET 1 -8.084 -18.303 -9.112
3 3H MET 1 3HT MET 1 -8.008 -18.156 -7.454
4 HA MET 1 HA MET 1 -5.764 -18.801 -7.372
5 1HB MET 1 1HB MET 1 -5.790 -18.839 -10.415
6 2HB MET 1 2HB MET 1 -6.160 -20.299 -9.527
7 1HG MET 1 1HG MET 1 -3.914 -20.499 -10.181
8 2HG MET 1 2HG MET 1 -3.901 -20.179 -8.463
9 1HE MET 1 1HE MET 1 -1.348 -19.664 -8.433
10 2HE MET 1 2HE MET 1 -0.560 -18.552 -9.551
11 3HE MET 1 3HE MET 1 -1.296 -20.039 -10.154
12 H SER 2 H SER 2 -4.006 -17.178 -8.341
13 HA SER 2 HA SER 2 -3.284 -15.162 -8.759
14 1HB SER 2 1HB SER 2 -6.078 -14.396 -9.691
15 2HB SER 2 2HB SER 2 -4.819 -15.039 -10.738
16 HG SER 2 HG SER 2 -5.168 -12.626 -10.523
17 H PHE 3 H PHE 3 -6.441 -15.146 -7.154
18 HA PHE 3 HA PHE 3 -5.583 -13.131 -5.305
19 1HB PHE 3 1HB PHE 3 -7.610 -13.992 -3.919
20 2HB PHE 3 2HB PHE 3 -7.943 -15.021 -5.291
21 HD1 PHE 3 1HD PHE 3 -7.634 -11.495 -4.269
22 HD2 PHE 3 2HD PHE 3 -9.094 -14.250 -7.159
23 HE1 PHE 3 1HE PHE 3 -8.925 -9.689 -5.320
24 HE2 PHE 3 2HE PHE 3 -10.388 -12.444 -8.223
25 HZ PHE 3 HZ PHE 3 -10.304 -10.164 -7.304
26 H GLU 4 H GLU 4 -3.813 -13.642 -4.325
27 HA GLU 4 HA GLU 4 -3.525 -16.293 -3.091
28 1HB GLU 4 1HB GLU 4 -1.173 -15.808 -3.127
29 2HB GLU 4 2HB GLU 4 -1.464 -14.147 -3.620
30 1HG GLU 4 1HG GLU 4 -0.670 -15.382 -5.509
31 2HG GLU 4 2HG GLU 4 -2.359 -14.978 -5.773
32 H LYS 5 H LYS 5 -3.014 -16.320 -0.821
33 HA LYS 5 HA LYS 5 -4.025 -14.010 0.541
34 1HB LYS 5 1HB LYS 5 -2.901 -16.560 1.699
35 2HB LYS 5 2HB LYS 5 -4.602 -16.257 1.356
36 1HG LYS 5 1HG LYS 5 -4.570 -14.406 2.952
37 2HG LYS 5 2HG LYS 5 -2.879 -14.749 3.309
38 1HD LYS 5 1HD LYS 5 -3.492 -16.966 4.120
39 2HD LYS 5 2HD LYS 5 -5.193 -16.608 3.780
40 1HE LYS 5 1HE LYS 5 -5.088 -14.711 5.298
41 2HE LYS 5 2HE LYS 5 -3.402 -15.062 5.644
42 1HZ LYS 5 1HZ LYS 5 -5.711 -16.802 6.248
43 2HZ LYS 5 2HZ LYS 5 -4.809 -15.889 7.355
44 3HZ LYS 5 3HZ LYS 5 -4.088 -17.196 6.563
45 H ILE 6 H ILE 6 -2.987 -12.423 1.276
46 HA ILE 6 HA ILE 6 -0.077 -12.570 1.331
47 HB ILE 6 HB ILE 6 -1.032 -10.769 0.008
48 1HG1 ILE 6 1HG1 ILE 6 0.371 -9.746 2.477
49 2HG1 ILE 6 2HG1 ILE 6 0.162 -8.806 1.004
50 1HG2 ILE 6 1HG2 ILE 6 -2.329 -9.730 2.501
51 2HG2 ILE 6 2HG2 ILE 6 -3.128 -10.381 1.070
52 3HG2 ILE 6 3HG2 ILE 6 -2.236 -8.863 0.967
53 1HD1 ILE 6 1HD1 ILE 6 2.379 -9.764 1.093
54 2HD1 ILE 6 2HD1 ILE 6 1.461 -10.477 -0.233
55 3HD1 ILE 6 3HD1 ILE 6 1.697 -11.380 1.263
56 H CYS 7 H CYS 7 -2.798 -11.595 3.281
57 HA CYS 7 HA CYS 7 -1.457 -12.385 5.702
58 1HB CYS 7 1HB CYS 7 -0.530 -10.187 5.602
59 2HB CYS 7 2HB CYS 7 -1.785 -10.183 6.815
60 HG CYS 7 HG CYS 7 -1.973 -7.749 5.584
61 H SER 8 H SER 8 -2.941 -11.336 7.569
62 HA SER 8 HA SER 8 -5.734 -11.973 6.918
63 1HB SER 8 1HB SER 8 -5.940 -13.121 8.947
64 2HB SER 8 2HB SER 8 -4.413 -12.595 9.573
65 HG SER 8 HG SER 8 -3.552 -14.241 8.632
66 H LEU 9 H LEU 9 -7.233 -10.808 8.175
67 HA LEU 9 HA LEU 9 -6.620 -8.088 8.740
68 1HB LEU 9 1HB LEU 9 -8.951 -9.649 9.823
69 2HB LEU 9 2HB LEU 9 -8.882 -9.199 8.152
70 HG LEU 9 HG LEU 9 -8.904 -6.749 8.911
71 1HD1 LEU 9 1HD1 LEU 9 -10.890 -7.841 8.059
72 2HD1 LEU 9 2HD1 LEU 9 -11.305 -6.737 9.371
73 3HD1 LEU 9 3HD1 LEU 9 -11.249 -8.473 9.664
74 1HD2 LEU 9 1HD2 LEU 9 -8.200 -7.098 11.251
75 2HD2 LEU 9 2HD2 LEU 9 -9.698 -7.970 11.569
76 3HD2 LEU 9 3HD2 LEU 9 -9.745 -6.258 11.154
77 H ASP 10 H ASP 10 -6.546 -10.987 10.696
78 HA ASP 10 HA ASP 10 -6.276 -9.658 13.176
79 1HB ASP 10 1HB ASP 10 -6.911 -12.004 13.166
80 2HB ASP 10 2HB ASP 10 -5.417 -11.788 14.053
81 H ASP 11 H ASP 11 -4.196 -9.814 10.564
82 HA ASP 11 HA ASP 11 -1.825 -9.171 12.157
83 1HB ASP 11 1HB ASP 11 -0.660 -8.949 9.963
84 2HB ASP 11 2HB ASP 11 -2.173 -9.284 9.137
85 H ILE 12 H ILE 12 -3.831 -7.773 9.572
86 HA ILE 12 HA ILE 12 -3.093 -5.159 10.637
87 HB ILE 12 HB ILE 12 -3.704 -4.150 8.507
88 1HG1 ILE 12 1HG1 ILE 12 -5.191 -5.958 7.663
89 2HG1 ILE 12 2HG1 ILE 12 -3.772 -6.975 7.432
90 1HG2 ILE 12 1HG2 ILE 12 -1.382 -4.617 9.008
91 2HG2 ILE 12 2HG2 ILE 12 -1.672 -4.873 7.279
92 3HG2 ILE 12 3HG2 ILE 12 -1.565 -6.257 8.377
93 1HD1 ILE 12 1HD1 ILE 12 -4.314 -4.389 6.020
94 2HD1 ILE 12 2HD1 ILE 12 -4.513 -6.007 5.344
95 3HD1 ILE 12 3HD1 ILE 12 -2.904 -5.423 5.787
96 H TRP 13 H TRP 13 -4.455 -4.328 11.763
97 HA TRP 13 HA TRP 13 -7.187 -5.101 11.867
98 1HB TRP 13 1HB TRP 13 -7.224 -3.508 13.768
99 2HB TRP 13 2HB TRP 13 -5.592 -3.038 13.350
100 HD1 TRP 13 HD TRP 13 -3.670 -4.947 13.599
101 HE1 TRP 13 1HE TRP 13 -3.504 -6.942 15.258
102 HE3 TRP 13 3HE TRP 13 -8.552 -5.193 15.041
103 HZ2 TRP 13 2HZ TRP 13 -5.233 -8.396 16.934
104 HZ3 TRP 13 3HZ TRP 13 -9.221 -6.907 16.668
105 HH2 TRP 13 HH TRP 13 -7.597 -8.473 17.594
106 H VAL 14 H VAL 14 -8.848 -3.331 12.090
107 HA VAL 14 HA VAL 14 -9.099 -1.955 9.698
108 HB VAL 14 HB VAL 14 -11.040 -2.589 11.030
109 1HG1 VAL 14 1HG1 VAL 14 -10.195 -2.272 13.268
110 2HG1 VAL 14 2HG1 VAL 14 -11.706 -1.390 13.057
111 3HG1 VAL 14 3HG1 VAL 14 -10.167 -0.525 13.036
112 1HG2 VAL 14 1HG2 VAL 14 -10.852 0.395 10.676
113 2HG2 VAL 14 2HG2 VAL 14 -12.348 -0.518 10.886
114 3HG2 VAL 14 3HG2 VAL 14 -11.340 -0.788 9.462
115 H GLY 15 H GLY 15 -7.920 -0.331 8.968
116 1HA GLY 15 1HA GLY 15 -7.384 1.947 10.721
117 2HA GLY 15 2HA GLY 15 -7.322 1.943 8.960
118 H GLU 16 H GLU 16 -5.874 -0.838 9.761
119 HA GLU 16 HA GLU 16 -3.263 0.333 10.342
120 1HB GLU 16 1HB GLU 16 -2.646 -2.096 10.896
121 2HB GLU 16 2HB GLU 16 -4.324 -2.463 10.610
122 1HG GLU 16 1HG GLU 16 -3.785 -2.229 12.965
123 2HG GLU 16 2HG GLU 16 -5.029 -1.095 12.413
124 H MET 17 H MET 17 -1.441 -0.368 9.210
125 HA MET 17 HA MET 17 -1.808 -1.720 6.659
126 1HB MET 17 1HB MET 17 -2.224 0.623 6.116
127 2HB MET 17 2HB MET 17 -0.707 0.042 5.452
128 1HG MET 17 1HG MET 17 0.499 1.113 7.317
129 2HG MET 17 2HG MET 17 -1.028 1.769 7.901
130 1HE MET 17 1HE MET 17 0.069 4.159 7.954
131 2HE MET 17 2HE MET 17 0.835 4.915 6.561
132 3HE MET 17 3HE MET 17 1.582 3.506 7.319
133 H GLU 18 H GLU 18 0.076 -2.696 6.029
134 HA GLU 18 HA GLU 18 2.539 -1.636 6.840
135 1HB GLU 18 1HB GLU 18 2.290 -2.793 8.860
136 2HB GLU 18 2HB GLU 18 3.497 -3.663 7.929
137 1HG GLU 18 1HG GLU 18 1.833 -5.323 7.303
138 2HG GLU 18 2HG GLU 18 0.638 -4.476 8.285
139 H THR 19 H THR 19 4.385 -2.488 5.873
140 HA THR 19 HA THR 19 3.993 -3.430 3.228
141 HB THR 19 HB THR 19 6.518 -3.354 4.869
142 HG1 THR 19 1HG THR 19 5.983 -1.304 4.754
143 1HG2 THR 19 1HG2 THR 19 6.125 -3.463 1.870
144 2HG2 THR 19 2HG2 THR 19 6.783 -4.750 2.885
145 3HG2 THR 19 3HG2 THR 19 7.680 -3.247 2.678
146 H PHE 20 H PHE 20 3.867 -5.402 2.510
147 HA PHE 20 HA PHE 20 5.031 -7.646 3.999
148 1HB PHE 20 1HB PHE 20 3.245 -9.081 3.009
149 2HB PHE 20 2HB PHE 20 2.442 -7.638 2.419
150 HD1 PHE 20 1HD PHE 20 1.088 -6.303 3.829
151 HD2 PHE 20 2HD PHE 20 3.322 -9.541 5.419
152 HE1 PHE 20 1HE PHE 20 -0.206 -6.166 5.914
153 HE2 PHE 20 2HE PHE 20 2.040 -9.410 7.504
154 HZ PHE 20 HZ PHE 20 0.269 -7.724 7.756
155 H GLU 21 H GLU 21 5.765 -9.342 2.578
156 HA GLU 21 HA GLU 21 6.374 -8.315 -0.086
157 1HB GLU 21 1HB GLU 21 7.758 -10.505 1.481
158 2HB GLU 21 2HB GLU 21 8.318 -8.844 1.327
159 1HG GLU 21 1HG GLU 21 8.580 -9.142 -1.078
160 2HG GLU 21 2HG GLU 21 8.021 -10.803 -0.932
161 H THR 22 H THR 22 5.730 -9.382 -1.802
162 HA THR 22 HA THR 22 3.743 -11.473 -1.467
163 HB THR 22 HB THR 22 3.380 -11.258 -3.887
164 HG1 THR 22 1HG THR 22 4.729 -9.708 -5.027
165 1HG2 THR 22 1HG2 THR 22 3.844 -8.556 -2.625
166 2HG2 THR 22 2HG2 THR 22 2.370 -9.512 -2.451
167 3HG2 THR 22 3HG2 THR 22 2.832 -8.862 -4.031
168 H SER 23 H SER 23 3.925 -13.378 -3.148
169 HA SER 23 HA SER 23 6.326 -14.779 -2.572
170 1HB SER 23 1HB SER 23 5.282 -16.570 -3.858
171 2HB SER 23 2HB SER 23 4.071 -15.415 -4.418
172 HG SER 23 HG SER 23 4.445 -15.578 -1.674
173 H ASP 24 H ASP 24 5.450 -12.580 -4.952
174 HA ASP 24 HA ASP 24 7.299 -13.595 -6.956
175 1HB ASP 24 1HB ASP 24 5.695 -11.037 -6.938
176 2HB ASP 24 2HB ASP 24 5.131 -12.551 -7.634
177 H GLY 25 H GLY 25 7.327 -11.697 -4.204
178 1HA GLY 25 1HA GLY 25 10.032 -10.785 -4.817
179 2HA GLY 25 2HA GLY 25 9.312 -10.901 -3.218
180 H THR 26 H THR 26 6.858 -9.519 -4.392
181 HA THR 26 HA THR 26 7.906 -6.859 -4.888
182 HB THR 26 HB THR 26 5.009 -7.698 -4.678
183 HG1 THR 26 1HG THR 26 6.920 -8.136 -6.674
184 1HG2 THR 26 1HG2 THR 26 4.667 -5.788 -6.183
185 2HG2 THR 26 2HG2 THR 26 6.403 -5.480 -6.198
186 3HG2 THR 26 3HG2 THR 26 5.486 -5.277 -4.707
187 H GLU 27 H GLU 27 8.076 -5.352 -3.249
188 HA GLU 27 HA GLU 27 6.943 -5.984 -0.673
189 1HB GLU 27 1HB GLU 27 8.014 -3.896 0.082
190 2HB GLU 27 2HB GLU 27 8.388 -3.455 -1.567
191 1HG GLU 27 1HG GLU 27 9.599 -5.828 -0.181
192 2HG GLU 27 2HG GLU 27 10.344 -4.235 -0.240
193 H VAL 28 H VAL 28 4.978 -5.237 -0.092
194 HA VAL 28 HA VAL 28 3.798 -2.953 -1.537
195 HB VAL 28 HB VAL 28 2.421 -5.630 -1.042
196 1HG1 VAL 28 1HG1 VAL 28 1.365 -3.233 -2.492
197 2HG1 VAL 28 2HG1 VAL 28 0.841 -3.835 -0.923
198 3HG1 VAL 28 3HG1 VAL 28 0.564 -4.800 -2.375
199 1HG2 VAL 28 1HG2 VAL 28 2.355 -5.921 -3.490
200 2HG2 VAL 28 2HG2 VAL 28 3.996 -5.900 -2.841
201 3HG2 VAL 28 3HG2 VAL 28 3.358 -4.477 -3.660
202 H LEU 29 H LEU 29 2.292 -1.842 -0.306
203 HA LEU 29 HA LEU 29 2.317 -2.325 2.592
204 1HB LEU 29 1HB LEU 29 1.504 0.066 0.900
205 2HB LEU 29 2HB LEU 29 3.077 -0.119 1.622
206 HG LEU 29 HG LEU 29 1.955 -0.031 3.899
207 1HD1 LEU 29 1HD1 LEU 29 1.724 2.342 2.056
208 2HD1 LEU 29 2HD1 LEU 29 3.151 1.856 2.967
209 3HD1 LEU 29 3HD1 LEU 29 1.708 2.408 3.816
210 1HD2 LEU 29 1HD2 LEU 29 -0.343 -0.513 3.261
211 2HD2 LEU 29 2HD2 LEU 29 -0.352 0.883 2.193
212 3HD2 LEU 29 3HD2 LEU 29 -0.251 1.126 3.931
213 H ILE 30 H ILE 30 0.633 -3.547 3.163
214 HA ILE 30 HA ILE 30 -1.819 -3.407 1.571
215 HB ILE 30 HB ILE 30 -1.146 -5.322 3.839
216 1HG1 ILE 30 1HG1 ILE 30 -0.674 -7.022 2.143
217 2HG1 ILE 30 2HG1 ILE 30 0.402 -5.649 1.927
218 1HG2 ILE 30 1HG2 ILE 30 -3.313 -5.415 1.735
219 2HG2 ILE 30 2HG2 ILE 30 -3.540 -5.039 3.441
220 3HG2 ILE 30 3HG2 ILE 30 -3.021 -6.654 2.958
221 1HD1 ILE 30 1HD1 ILE 30 -2.044 -6.198 0.281
222 2HD1 ILE 30 2HD1 ILE 30 -0.374 -6.503 -0.193
223 3HD1 ILE 30 3HD1 ILE 30 -0.927 -4.849 0.075
224 H VAL 31 H VAL 31 -3.354 -2.091 2.281
225 HA VAL 31 HA VAL 31 -3.391 -1.432 5.142
226 HB VAL 31 HB VAL 31 -2.788 0.563 3.712
227 1HG1 VAL 31 1HG1 VAL 31 -3.858 -0.041 1.693
228 2HG1 VAL 31 2HG1 VAL 31 -4.391 1.553 2.240
229 3HG1 VAL 31 3HG1 VAL 31 -5.441 0.149 2.447
230 1HG2 VAL 31 1HG2 VAL 31 -5.543 0.772 4.908
231 2HG2 VAL 31 2HG2 VAL 31 -4.432 2.112 4.634
232 3HG2 VAL 31 3HG2 VAL 31 -4.067 0.888 5.845
233 H ASN 32 H ASN 32 -5.233 -1.806 6.216
234 HA ASN 32 HA ASN 32 -7.609 -2.487 4.583
235 1HB ASN 32 1HB ASN 32 -7.055 -3.055 7.516
236 2HB ASN 32 2HB ASN 32 -6.753 -4.213 6.234
237 1HD2 ASN 32 1HD2 ASN 32 -8.133 -5.654 7.211
238 2HD2 ASN 32 2HD2 ASN 32 -9.851 -5.509 7.112
239 H SER 33 H SER 33 -8.570 -0.526 4.287
240 HA SER 33 HA SER 33 -8.872 1.201 6.610
241 1HB SER 33 1HB SER 33 -9.566 2.909 4.998
242 2HB SER 33 2HB SER 33 -9.467 1.727 3.692
243 HG SER 33 HG SER 33 -7.182 1.527 4.688
244 H GLU 34 H GLU 34 -10.924 1.703 7.375
245 HA GLU 34 HA GLU 34 -13.013 -0.150 6.700
246 1HB GLU 34 1HB GLU 34 -13.147 2.372 8.384
247 2HB GLU 34 2HB GLU 34 -12.591 0.839 9.011
248 1HG GLU 34 1HG GLU 34 -14.818 1.160 9.755
249 2HG GLU 34 2HG GLU 34 -14.835 -0.125 8.559
250 H GLU 35 H GLU 35 -12.428 3.300 6.410
251 HA GLU 35 HA GLU 35 -14.805 3.826 4.918
252 1HB GLU 35 1HB GLU 35 -13.886 6.102 4.769
253 2HB GLU 35 2HB GLU 35 -12.402 5.527 5.516
254 1HG GLU 35 1HG GLU 35 -13.757 4.821 7.479
255 2HG GLU 35 2HG GLU 35 -15.130 5.651 6.746
256 H HIS 36 H HIS 36 -11.350 3.756 4.116
257 HA HIS 36 HA HIS 36 -11.963 4.207 1.296
258 1HB HIS 36 1HB HIS 36 -9.301 4.037 2.753
259 2HB HIS 36 2HB HIS 36 -10.159 5.511 2.367
260 HD1 HIS 36 1HD HIS 36 -10.036 6.408 -0.090
261 HD2 HIS 36 2HD HIS 36 -7.750 3.035 0.687
262 HE1 HIS 36 1HE HIS 36 -8.407 6.257 -1.974
263 HE2 HIS 36 2HE HIS 36 -6.776 4.555 -1.120
264 H GLY 37 H GLY 37 -11.970 1.556 3.158
265 1HA GLY 37 1HA GLY 37 -11.863 -0.230 0.922
266 2HA GLY 37 2HA GLY 37 -12.156 -0.675 2.594
267 H VAL 38 H VAL 38 -10.779 -2.533 1.547
268 HA VAL 38 HA VAL 38 -8.114 -2.174 2.543
269 HB VAL 38 HB VAL 38 -9.293 -4.283 3.060
270 1HG1 VAL 38 1HG1 VAL 38 -9.724 -5.988 1.342
271 2HG1 VAL 38 2HG1 VAL 38 -9.311 -4.808 0.096
272 3HG1 VAL 38 3HG1 VAL 38 -10.699 -4.536 1.144
273 1HG2 VAL 38 1HG2 VAL 38 -6.921 -4.730 1.251
274 2HG2 VAL 38 2HG2 VAL 38 -7.552 -5.902 2.406
275 3HG2 VAL 38 3HG2 VAL 38 -6.869 -4.378 2.980
276 H LYS 39 H LYS 39 -6.373 -1.777 1.397
277 HA LYS 39 HA LYS 39 -6.505 -1.816 -1.564
278 1HB LYS 39 1HB LYS 39 -5.061 0.321 -1.380
279 2HB LYS 39 2HB LYS 39 -5.472 0.276 0.292
280 1HG LYS 39 1HG LYS 39 -6.785 1.948 -0.692
281 2HG LYS 39 2HG LYS 39 -7.843 0.647 -0.177
282 1HD LYS 39 1HD LYS 39 -6.950 0.932 -3.041
283 2HD LYS 39 2HD LYS 39 -8.378 1.745 -2.421
284 1HE LYS 39 1HE LYS 39 -9.399 -0.386 -1.854
285 2HE LYS 39 2HE LYS 39 -7.994 -1.251 -2.469
286 1HZ LYS 39 1HZ LYS 39 -9.729 0.487 -4.129
287 2HZ LYS 39 2HZ LYS 39 -9.781 -1.186 -4.052
288 3HZ LYS 39 3HZ LYS 39 -8.401 -0.434 -4.646
289 H ALA 40 H ALA 40 -4.639 -2.357 -2.584
290 HA ALA 40 HA ALA 40 -2.299 -2.995 -0.896
291 1HB ALA 40 1HB ALA 40 -3.343 -4.559 -3.261
292 2HB ALA 40 2HB ALA 40 -3.438 -5.064 -1.571
293 3HB ALA 40 3HB ALA 40 -1.868 -4.905 -2.359
294 H TYR 41 H TYR 41 -0.806 -1.568 -1.412
295 HA TYR 41 HA TYR 41 -0.283 -1.174 -4.233
296 1HB TYR 41 1HB TYR 41 -1.530 0.773 -3.919
297 2HB TYR 41 2HB TYR 41 0.123 1.332 -3.721
298 HD1 TYR 41 1HD TYR 41 -3.090 0.907 -2.137
299 HD2 TYR 41 2HD TYR 41 0.988 1.864 -1.422
300 HE1 TYR 41 1HE TYR 41 -3.701 1.861 0.040
301 HE2 TYR 41 2HE TYR 41 0.380 2.826 0.746
302 HH TYR 41 HH TYR 41 -1.549 3.745 1.884
303 H GLN 42 H GLN 42 1.813 -0.848 -4.828
304 HA GLN 42 HA GLN 42 3.796 -2.199 -3.523
305 1HB GLN 42 1HB GLN 42 5.413 -1.107 -4.952
306 2HB GLN 42 2HB GLN 42 4.401 0.268 -5.239
307 1HG GLN 42 1HG GLN 42 2.905 -1.060 -6.485
308 2HG GLN 42 2HG GLN 42 3.894 -2.488 -6.142
309 1HE2 GLN 42 1HE2 GLN 42 3.777 0.604 -7.752
310 2HE2 GLN 42 2HE2 GLN 42 5.148 0.314 -8.759
311 H ALA 43 H ALA 43 5.293 -1.883 -1.968
312 HA ALA 43 HA ALA 43 5.002 0.603 -0.481
313 1HB ALA 43 1HB ALA 43 6.185 -1.985 0.457
314 2HB ALA 43 2HB ALA 43 4.536 -1.457 0.774
315 3HB ALA 43 3HB ALA 43 5.904 -0.551 1.444
316 H MET 44 H MET 44 6.188 1.506 -1.954
317 HA MET 44 HA MET 44 9.045 1.216 -1.365
318 1HB MET 44 1HB MET 44 9.463 2.263 -3.768
319 2HB MET 44 2HB MET 44 7.924 1.430 -4.023
320 1HG MET 44 1HG MET 44 9.821 0.001 -4.542
321 2HG MET 44 2HG MET 44 8.865 -0.620 -3.190
322 1HE MET 44 1HE MET 44 12.468 -1.644 -2.129
323 2HE MET 44 2HE MET 44 11.737 -1.694 -3.743
324 3HE MET 44 3HE MET 44 10.792 -2.161 -2.322
325 H CYS 45 H CYS 45 10.339 2.562 -0.896
326 HA CYS 45 HA CYS 45 10.512 5.187 -1.708
327 1HB CYS 45 1HB CYS 45 9.520 4.786 1.143
328 2HB CYS 45 2HB CYS 45 8.898 5.901 -0.070
329 HA PRO 46 HA PRO 46 14.390 3.260 -0.409
330 1HB PRO 46 1HB PRO 46 14.945 2.478 -2.480
331 2HB PRO 46 2HB PRO 46 15.695 4.048 -2.755
332 1HG PRO 46 1HG PRO 46 13.340 2.973 -3.997
333 2HG PRO 46 2HG PRO 46 14.112 4.534 -4.284
334 1HD PRO 46 1HD PRO 46 11.630 4.165 -3.107
335 2HD PRO 46 2HD PRO 46 12.607 5.644 -2.998
336 H HIS 47 H HIS 47 13.336 5.971 0.063
337 HA HIS 47 HA HIS 47 15.551 7.787 -0.396
338 1HB HIS 47 1HB HIS 47 13.034 8.247 1.220
339 2HB HIS 47 2HB HIS 47 13.121 8.475 -0.515
340 HD2 HIS 47 2HD HIS 47 16.109 9.889 1.509
341 HE1 HIS 47 1HE HIS 47 13.673 13.123 0.348
342 HE2 HIS 47 2HE HIS 47 15.892 12.446 1.266
343 H GLN 48 H GLN 48 13.809 6.469 2.418
344 HA GLN 48 HA GLN 48 16.293 6.507 3.919
345 1HB GLN 48 1HB GLN 48 13.701 7.765 4.862
346 2HB GLN 48 2HB GLN 48 15.245 8.568 4.622
347 1HG GLN 48 1HG GLN 48 16.190 7.217 6.478
348 2HG GLN 48 2HG GLN 48 14.593 6.537 6.746
349 1HE2 GLN 48 1HE2 GLN 48 16.213 8.071 8.551
350 2HE2 GLN 48 2HE2 GLN 48 15.296 9.464 8.978
351 H GLU 49 H GLU 49 12.895 5.829 4.669
352 HA GLU 49 HA GLU 49 13.741 3.184 5.496
353 1HB GLU 49 1HB GLU 49 11.147 4.675 5.962
354 2HB GLU 49 2HB GLU 49 12.447 4.482 7.129
355 1HG GLU 49 1HG GLU 49 10.716 2.294 5.998
356 2HG GLU 49 2HG GLU 49 10.650 2.959 7.631
357 H ILE 50 H ILE 50 13.573 1.676 4.083
358 HA ILE 50 HA ILE 50 12.347 1.932 1.568
359 HB ILE 50 HB ILE 50 14.224 0.397 1.901
360 1HG1 ILE 50 1HG1 ILE 50 12.701 -0.098 0.035
361 2HG1 ILE 50 2HG1 ILE 50 11.715 -1.099 1.087
362 1HG2 ILE 50 1HG2 ILE 50 13.785 -0.339 4.161
363 2HG2 ILE 50 2HG2 ILE 50 13.982 -1.730 3.094
364 3HG2 ILE 50 3HG2 ILE 50 12.370 -1.241 3.615
365 1HD1 ILE 50 1HD1 ILE 50 13.577 -2.650 1.368
366 2HD1 ILE 50 2HD1 ILE 50 14.561 -1.656 0.288
367 3HD1 ILE 50 3HD1 ILE 50 13.124 -2.470 -0.325
368 H LEU 51 H LEU 51 11.189 0.789 4.597
369 HA LEU 51 HA LEU 51 8.822 -0.410 3.501
370 1HB LEU 51 1HB LEU 51 8.073 -0.618 5.820
371 2HB LEU 51 2HB LEU 51 9.409 0.377 6.355
372 HG LEU 51 HG LEU 51 10.993 -1.335 5.738
373 1HD1 LEU 51 1HD1 LEU 51 10.363 -3.046 7.382
374 2HD1 LEU 51 2HD1 LEU 51 8.720 -2.404 7.402
375 3HD1 LEU 51 3HD1 LEU 51 10.063 -1.410 7.968
376 1HD2 LEU 51 1HD2 LEU 51 8.594 -2.949 4.871
377 2HD2 LEU 51 2HD2 LEU 51 10.242 -3.560 4.999
378 3HD2 LEU 51 3HD2 LEU 51 9.858 -2.310 3.817
379 H LEU 52 H LEU 52 7.737 1.045 2.368
380 HA LEU 52 HA LEU 52 7.268 3.755 2.866
381 1HB LEU 52 1HB LEU 52 5.264 1.879 1.587
382 2HB LEU 52 2HB LEU 52 6.755 2.286 0.786
383 HG LEU 52 HG LEU 52 6.076 4.619 0.564
384 1HD1 LEU 52 1HD1 LEU 52 4.257 4.298 -1.019
385 2HD1 LEU 52 2HD1 LEU 52 3.997 2.682 -0.361
386 3HD1 LEU 52 3HD1 LEU 52 5.511 3.064 -1.180
387 1HD2 LEU 52 1HD2 LEU 52 4.667 4.841 2.546
388 2HD2 LEU 52 2HD2 LEU 52 3.479 3.760 1.806
389 3HD2 LEU 52 3HD2 LEU 52 3.813 5.342 1.080
390 H SER 53 H SER 53 5.831 0.892 4.161
391 HA SER 53 HA SER 53 3.442 1.767 5.221
392 1HB SER 53 1HB SER 53 4.020 -0.486 4.975
393 2HB SER 53 2HB SER 53 3.606 -0.201 6.631
394 HG SER 53 HG SER 53 5.743 -0.466 7.181
395 H GLU 54 H GLU 54 6.702 2.423 6.284
396 HA GLU 54 HA GLU 54 5.880 3.166 8.954
397 1HB GLU 54 1HB GLU 54 8.307 3.733 9.248
398 2HB GLU 54 2HB GLU 54 8.564 3.175 7.600
399 1HG GLU 54 1HG GLU 54 9.132 1.467 9.264
400 2HG GLU 54 2HG GLU 54 7.819 0.953 8.199
401 H GLY 55 H GLY 55 5.437 4.626 6.172
402 1HA GLY 55 1HA GLY 55 5.264 6.857 5.547
403 2HA GLY 55 2HA GLY 55 6.238 7.300 6.950
404 H SER 56 H SER 56 3.307 7.781 5.700
405 HA SER 56 HA SER 56 1.689 6.975 7.893
406 1HB SER 56 1HB SER 56 2.083 9.924 7.434
407 2HB SER 56 2HB SER 56 2.643 8.965 8.841
408 HG SER 56 HG SER 56 0.843 9.340 9.694
409 H TYR 57 H TYR 57 -0.317 7.291 7.566
410 HA TYR 57 HA TYR 57 -1.216 8.016 4.860
411 1HB TYR 57 1HB TYR 57 -2.089 5.518 6.325
412 2HB TYR 57 2HB TYR 57 -0.941 5.538 4.999
413 HD1 TYR 57 1HD TYR 57 -2.515 7.641 3.348
414 HD2 TYR 57 2HD TYR 57 -3.615 4.014 5.253
415 HE1 TYR 57 1HE TYR 57 -4.270 7.320 1.696
416 HE2 TYR 57 2HE TYR 57 -5.401 3.688 3.585
417 HH TYR 57 HH TYR 57 -5.501 5.445 0.745
418 H GLU 58 H GLU 58 -2.651 9.592 5.115
419 HA GLU 58 HA GLU 58 -4.344 9.501 7.529
420 1HB GLU 58 1HB GLU 58 -4.469 11.936 7.394
421 2HB GLU 58 2HB GLU 58 -3.476 11.916 5.946
422 1HG GLU 58 1HG GLU 58 -1.610 11.025 7.216
423 2HG GLU 58 2HG GLU 58 -2.598 11.011 8.673
424 H GLY 59 H GLY 59 -6.208 8.600 6.832
425 1HA GLY 59 1HA GLY 59 -8.006 10.082 5.230
426 2HA GLY 59 2HA GLY 59 -8.260 8.456 5.843
427 H GLY 60 H GLY 60 -6.586 10.227 3.404
428 1HA GLY 60 1HA GLY 60 -7.428 9.226 1.074
429 2HA GLY 60 2HA GLY 60 -6.411 7.902 1.635
430 H VAL 61 H VAL 61 -4.675 9.892 3.018
431 HA VAL 61 HA VAL 61 -3.242 10.870 0.653
432 HB VAL 61 HB VAL 61 -3.312 12.133 3.409
433 1HG1 VAL 61 1HG1 VAL 61 -2.033 13.961 2.381
434 2HG1 VAL 61 2HG1 VAL 61 -1.961 13.051 0.874
435 3HG1 VAL 61 3HG1 VAL 61 -1.161 12.429 2.316
436 1HG2 VAL 61 1HG2 VAL 61 -4.486 13.996 2.324
437 2HG2 VAL 61 2HG2 VAL 61 -5.407 12.497 2.221
438 3HG2 VAL 61 3HG2 VAL 61 -4.521 13.086 0.815
439 H ILE 62 H ILE 62 -1.382 9.884 0.394
440 HA ILE 62 HA ILE 62 -0.143 8.388 2.564
441 HB ILE 62 HB ILE 62 0.528 8.688 -0.371
442 1HG1 ILE 62 1HG1 ILE 62 -0.235 6.416 -0.668
443 2HG1 ILE 62 2HG1 ILE 62 -1.511 7.384 0.055
444 1HG2 ILE 62 1HG2 ILE 62 2.142 6.832 -0.075
445 2HG2 ILE 62 2HG2 ILE 62 1.822 6.859 1.660
446 3HG2 ILE 62 3HG2 ILE 62 2.578 8.248 0.887
447 1HD1 ILE 62 1HD1 ILE 62 -0.985 6.436 2.247
448 2HD1 ILE 62 2HD1 ILE 62 0.264 5.435 1.496
449 3HD1 ILE 62 3HD1 ILE 62 -1.433 5.224 1.050
450 H THR 63 H THR 63 1.703 9.080 3.540
451 HA THR 63 HA THR 63 3.051 11.372 2.345
452 HB THR 63 HB THR 63 2.680 10.866 5.320
453 HG1 THR 63 1HG THR 63 1.081 11.954 3.455
454 1HG2 THR 63 1HG2 THR 63 4.717 12.114 4.711
455 2HG2 THR 63 2HG2 THR 63 3.560 13.154 5.546
456 3HG2 THR 63 3HG2 THR 63 3.743 13.260 3.794
457 H CYS 64 H CYS 64 5.161 11.031 2.014
458 HA CYS 64 HA CYS 64 6.334 8.495 2.496
459 1HB CYS 64 1HB CYS 64 8.329 10.382 1.699
460 2HB CYS 64 2HB CYS 64 6.841 10.810 0.876
461 H ARG 65 H ARG 65 9.181 9.677 3.131
462 HA ARG 65 HA ARG 65 8.718 9.543 6.017
463 1HB ARG 65 1HB ARG 65 10.924 8.373 4.313
464 2HB ARG 65 2HB ARG 65 9.609 7.471 5.031
465 1HG ARG 65 1HG ARG 65 11.736 8.916 6.576
466 2HG ARG 65 2HG ARG 65 11.717 7.190 6.230
467 1HD ARG 65 1HD ARG 65 9.585 6.988 7.451
468 2HD ARG 65 2HD ARG 65 9.692 8.701 7.866
469 HE ARG 65 HE ARG 65 12.049 7.747 8.691
470 1HH1 ARG 65 1HH1 ARG 65 8.734 6.616 9.329
471 2HH1 ARG 65 2HH1 ARG 65 9.084 5.988 10.858
472 1HH2 ARG 65 1HH2 ARG 65 12.539 6.863 10.792
473 2HH2 ARG 65 2HH2 ARG 65 11.317 6.128 11.720
474 H ALA 66 H ALA 66 8.875 11.718 6.461
475 HA ALA 66 HA ALA 66 9.801 13.720 6.935
476 1HB ALA 66 1HB ALA 66 12.450 12.419 6.248
477 2HB ALA 66 2HB ALA 66 11.696 12.398 7.842
478 3HB ALA 66 3HB ALA 66 12.234 13.924 7.140
479 H HIS 67 H HIS 67 9.037 12.882 4.212
480 HA HIS 67 HA HIS 67 10.643 14.707 2.574
481 1HB HIS 67 1HB HIS 67 8.332 13.077 1.545
482 2HB HIS 67 2HB HIS 67 9.874 12.301 1.883
483 HD2 HIS 67 2HD HIS 67 9.584 15.745 0.008
484 HE1 HIS 67 1HE HIS 67 11.231 12.892 -2.622
485 HE2 HIS 67 2HE HIS 67 10.854 15.334 -2.171
486 H LEU 68 H LEU 68 7.707 14.480 4.280
487 HA LEU 68 HA LEU 68 6.158 15.932 4.872
488 1HB LEU 68 1HB LEU 68 6.297 18.374 4.072
489 2HB LEU 68 2HB LEU 68 7.841 17.918 3.397
490 HG LEU 68 HG LEU 68 7.128 17.814 6.331
491 1HD1 LEU 68 1HD1 LEU 68 9.478 17.395 6.716
492 2HD1 LEU 68 2HD1 LEU 68 9.762 17.321 4.977
493 3HD1 LEU 68 3HD1 LEU 68 8.755 16.101 5.761
494 1HD2 LEU 68 1HD2 LEU 68 8.877 19.695 4.781
495 2HD2 LEU 68 2HD2 LEU 68 8.699 19.669 6.532
496 3HD2 LEU 68 3HD2 LEU 68 7.320 20.079 5.512
497 H TRP 69 H TRP 69 6.704 16.219 1.400
498 HA TRP 69 HA TRP 69 4.035 17.179 1.057
499 1HB TRP 69 1HB TRP 69 5.783 16.175 -1.207
500 2HB TRP 69 2HB TRP 69 6.098 17.714 -0.426
501 HD1 TRP 69 HD TRP 69 2.478 17.628 -0.516
502 HE1 TRP 69 1HE TRP 69 1.532 18.834 -2.569
503 HE3 TRP 69 3HE TRP 69 6.749 17.982 -3.307
504 HZ2 TRP 69 2HZ TRP 69 2.456 19.826 -5.029
505 HZ3 TRP 69 3HZ TRP 69 6.626 19.090 -5.498
506 HH2 TRP 69 HH TRP 69 4.529 19.990 -6.338
507 H THR 70 H THR 70 2.786 15.850 -1.011
508 HA THR 70 HA THR 70 1.894 13.552 0.526
509 HB THR 70 HB THR 70 -0.235 13.997 -0.678
510 HG1 THR 70 1HG THR 70 0.243 16.525 -1.422
511 1HG2 THR 70 1HG2 THR 70 0.949 16.318 0.865
512 2HG2 THR 70 2HG2 THR 70 0.181 14.902 1.581
513 3HG2 THR 70 3HG2 THR 70 -0.771 16.027 0.610
514 H PHE 71 H PHE 71 1.065 11.742 -0.534
515 HA PHE 71 HA PHE 71 1.740 11.305 -3.342
516 1HB PHE 71 1HB PHE 71 2.140 9.320 -1.041
517 2HB PHE 71 2HB PHE 71 3.414 10.295 -1.711
518 HD1 PHE 71 1HD PHE 71 4.818 9.383 -3.191
519 HD2 PHE 71 2HD PHE 71 0.849 7.880 -2.960
520 HE1 PHE 71 1HE PHE 71 5.370 7.687 -4.862
521 HE2 PHE 71 2HE PHE 71 1.394 6.181 -4.635
522 HZ PHE 71 HZ PHE 71 3.682 6.089 -5.595
523 H ASN 72 H ASN 72 0.028 9.881 -4.356
524 HA ASN 72 HA ASN 72 -2.282 9.618 -2.587
525 1HB ASN 72 1HB ASN 72 -2.250 10.533 -5.463
526 2HB ASN 72 2HB ASN 72 -2.690 11.480 -4.052
527 1HD2 ASN 72 1HD2 ASN 72 -3.772 9.365 -6.438
528 2HD2 ASN 72 2HD2 ASN 72 -5.436 9.279 -5.952
529 H ASP 73 H ASP 73 -2.865 7.647 -2.196
530 HA ASP 73 HA ASP 73 -1.813 5.421 -3.654
531 1HB ASP 73 1HB ASP 73 -2.025 5.383 -1.211
532 2HB ASP 73 2HB ASP 73 -2.911 4.060 -1.957
533 H GLY 74 H GLY 74 -4.941 6.998 -3.409
534 1HA GLY 74 1HA GLY 74 -6.925 6.672 -4.482
535 2HA GLY 74 2HA GLY 74 -6.609 4.960 -4.272
536 H THR 75 H THR 75 -4.813 7.254 -6.189
537 HA THR 75 HA THR 75 -5.799 5.957 -8.619
538 HB THR 75 HB THR 75 -4.146 8.470 -8.352
539 HG1 THR 75 1HG THR 75 -6.506 9.285 -8.850
540 1HG2 THR 75 1HG2 THR 75 -5.078 8.999 -10.584
541 2HG2 THR 75 2HG2 THR 75 -5.926 7.452 -10.588
542 3HG2 THR 75 3HG2 THR 75 -4.164 7.493 -10.612
543 H GLY 76 H GLY 76 -3.170 5.982 -6.500
544 1HA GLY 76 1HA GLY 76 -1.725 4.087 -8.053
545 2HA GLY 76 2HA GLY 76 -1.269 4.714 -6.480
546 H HIS 77 H HIS 77 -1.120 7.479 -7.196
547 HA HIS 77 HA HIS 77 1.405 7.352 -8.663
548 1HB HIS 77 1HB HIS 77 0.868 9.407 -9.940
549 2HB HIS 77 2HB HIS 77 -0.758 9.399 -9.291
550 HD1 HIS 77 1HD HIS 77 -2.431 8.507 -10.824
551 HD2 HIS 77 2HD HIS 77 1.301 6.866 -11.558
552 HE1 HIS 77 1HE HIS 77 -2.746 6.982 -12.783
553 HE2 HIS 77 2HE HIS 77 -0.418 6.434 -13.439
554 H GLY 78 H GLY 78 2.935 8.828 -7.810
555 1HA GLY 78 1HA GLY 78 3.694 9.954 -5.990
556 2HA GLY 78 2HA GLY 78 2.054 10.017 -5.357
557 H ILE 79 H ILE 79 1.771 12.126 -4.968
558 HA ILE 79 HA ILE 79 1.799 13.988 -7.160
559 HB ILE 79 HB ILE 79 1.443 14.454 -4.161
560 1HG1 ILE 79 1HG1 ILE 79 -0.272 12.949 -5.118
561 2HG1 ILE 79 2HG1 ILE 79 -0.655 14.164 -6.326
562 1HG2 ILE 79 1HG2 ILE 79 2.097 16.495 -5.342
563 2HG2 ILE 79 2HG2 ILE 79 0.419 16.597 -4.810
564 3HG2 ILE 79 3HG2 ILE 79 0.787 16.259 -6.500
565 1HD1 ILE 79 1HD1 ILE 79 -1.414 15.683 -4.584
566 2HD1 ILE 79 2HD1 ILE 79 -1.034 14.467 -3.364
567 3HD1 ILE 79 3HD1 ILE 79 -2.298 14.157 -4.557
568 H ASN 80 H ASN 80 3.567 13.126 -4.319
569 HA ASN 80 HA ASN 80 6.033 14.137 -5.447
570 1HB ASN 80 1HB ASN 80 5.118 14.438 -2.584
571 2HB ASN 80 2HB ASN 80 5.229 15.774 -3.709
572 1HD2 ASN 80 1HD2 ASN 80 7.332 16.400 -4.424
573 2HD2 ASN 80 2HD2 ASN 80 8.729 16.037 -3.488
574 HA PRO 81 HA PRO 81 8.397 13.680 -5.062
575 1HB PRO 81 1HB PRO 81 10.092 12.422 -5.605
576 2HB PRO 81 2HB PRO 81 9.139 11.229 -6.498
577 1HG PRO 81 1HG PRO 81 9.549 11.482 -3.518
578 2HG PRO 81 2HG PRO 81 9.669 10.020 -4.518
579 1HD PRO 81 1HD PRO 81 7.470 10.500 -3.141
580 2HD PRO 81 2HD PRO 81 7.356 9.907 -4.816
581 H ASP 82 H ASP 82 6.310 11.671 -6.362
582 HA ASP 82 HA ASP 82 4.762 11.802 -8.180
583 1HB ASP 82 1HB ASP 82 6.623 13.871 -9.420
584 2HB ASP 82 2HB ASP 82 5.156 14.236 -8.523
585 H ASP 83 H ASP 83 8.162 11.689 -8.803
586 HA ASP 83 HA ASP 83 8.255 10.142 -11.105
587 1HB ASP 83 1HB ASP 83 10.425 9.271 -10.235
588 2HB ASP 83 2HB ASP 83 10.005 10.012 -8.696
589 H CYS 84 H CYS 84 7.582 9.231 -7.793
590 HA CYS 84 HA CYS 84 7.572 6.448 -8.517
591 1HB CYS 84 1HB CYS 84 7.313 6.037 -6.171
592 2HB CYS 84 2HB CYS 84 7.024 7.735 -5.883
593 HG CYS 84 HG CYS 84 9.977 6.783 -7.278
594 H CYS 85 H CYS 85 5.851 5.349 -8.470
595 HA CYS 85 HA CYS 85 3.249 6.428 -7.839
596 1HB CYS 85 1HB CYS 85 2.327 5.644 -9.940
597 2HB CYS 85 2HB CYS 85 3.900 5.155 -10.502
598 HG CYS 85 HG CYS 85 4.578 8.153 -9.984
599 H LEU 86 H LEU 86 1.676 4.515 -8.035
600 HA LEU 86 HA LEU 86 3.103 2.093 -7.228
601 1HB LEU 86 1HB LEU 86 1.526 1.740 -5.412
602 2HB LEU 86 2HB LEU 86 0.695 3.229 -5.809
603 HG LEU 86 HG LEU 86 2.618 4.531 -5.118
604 1HD1 LEU 86 1HD1 LEU 86 2.550 4.072 -2.739
605 2HD1 LEU 86 2HD1 LEU 86 1.847 2.493 -3.079
606 3HD1 LEU 86 3HD1 LEU 86 0.939 3.960 -3.461
607 1HD2 LEU 86 1HD2 LEU 86 4.400 2.936 -5.709
608 2HD2 LEU 86 2HD2 LEU 86 3.903 1.923 -4.338
609 3HD2 LEU 86 3HD2 LEU 86 4.545 3.533 -4.057
610 H ALA 87 H ALA 87 1.259 0.333 -6.920
611 HA ALA 87 HA ALA 87 -0.700 0.623 -9.037
612 1HB ALA 87 1HB ALA 87 1.145 -0.695 -9.958
613 2HB ALA 87 2HB ALA 87 -0.261 -1.723 -9.673
614 3HB ALA 87 3HB ALA 87 1.098 -1.757 -8.551
615 H GLU 88 H GLU 88 -2.575 0.386 -8.100
616 HA GLU 88 HA GLU 88 -2.732 -0.804 -5.479
617 1HB GLU 88 1HB GLU 88 -4.966 0.335 -7.161
618 2HB GLU 88 2HB GLU 88 -3.852 1.384 -6.318
619 1HG GLU 88 1HG GLU 88 -5.826 1.254 -5.032
620 2HG GLU 88 2HG GLU 88 -4.567 0.387 -4.175
621 H TYR 89 H TYR 89 -2.684 -2.893 -5.550
622 HA TYR 89 HA TYR 89 -3.553 -4.462 -7.809
623 1HB TYR 89 1HB TYR 89 -2.612 -6.343 -6.599
624 2HB TYR 89 2HB TYR 89 -2.468 -5.377 -5.141
625 HD1 TYR 89 1HD TYR 89 -1.397 -5.040 -8.691
626 HD2 TYR 89 2HD TYR 89 -0.314 -4.768 -4.608
627 HE1 TYR 89 1HE TYR 89 0.878 -4.448 -9.357
628 HE2 TYR 89 2HE TYR 89 1.978 -4.155 -5.261
629 HH TYR 89 HH TYR 89 3.416 -4.579 -7.286
630 HA PRO 90 HA PRO 90 -7.643 -5.402 -6.244
631 1HB PRO 90 1HB PRO 90 -8.492 -6.977 -7.700
632 2HB PRO 90 2HB PRO 90 -7.176 -8.110 -7.372
633 1HG PRO 90 1HG PRO 90 -7.266 -5.794 -9.259
634 2HG PRO 90 2HG PRO 90 -6.560 -7.401 -9.494
635 1HD PRO 90 1HD PRO 90 -5.063 -5.241 -8.919
636 2HD PRO 90 2HD PRO 90 -4.637 -6.866 -8.341
637 H VAL 91 H VAL 91 -7.874 -5.808 -4.144
638 HA VAL 91 HA VAL 91 -6.780 -8.246 -3.040
639 HB VAL 91 HB VAL 91 -5.236 -6.438 -2.451
640 1HG1 VAL 91 1HG1 VAL 91 -6.630 -4.520 -2.563
641 2HG1 VAL 91 2HG1 VAL 91 -5.923 -4.606 -0.952
642 3HG1 VAL 91 3HG1 VAL 91 -7.601 -5.088 -1.209
643 1HG2 VAL 91 1HG2 VAL 91 -6.855 -7.338 -0.082
644 2HG2 VAL 91 2HG2 VAL 91 -5.219 -6.686 -0.009
645 3HG2 VAL 91 3HG2 VAL 91 -5.527 -8.215 -0.834
646 H GLU 92 H GLU 92 -8.046 -9.197 -1.603
647 HA GLU 92 HA GLU 92 -10.608 -7.879 -1.044
648 1HB GLU 92 1HB GLU 92 -10.346 -10.710 -1.922
649 2HB GLU 92 2HB GLU 92 -10.682 -9.429 -3.033
650 1HG GLU 92 1HG GLU 92 -12.727 -8.928 -1.573
651 2HG GLU 92 2HG GLU 92 -12.353 -10.414 -0.708
652 H VAL 93 H VAL 93 -11.462 -8.322 0.789
653 HA VAL 93 HA VAL 93 -9.953 -9.996 2.646
654 HB VAL 93 HB VAL 93 -10.055 -7.678 3.369
655 1HG1 VAL 93 1HG1 VAL 93 -12.164 -6.571 3.952
656 2HG1 VAL 93 2HG1 VAL 93 -13.043 -7.935 3.257
657 3HG1 VAL 93 3HG1 VAL 93 -12.028 -6.926 2.229
658 1HG2 VAL 93 1HG2 VAL 93 -11.856 -9.410 5.065
659 2HG2 VAL 93 2HG2 VAL 93 -11.049 -7.940 5.613
660 3HG2 VAL 93 3HG2 VAL 93 -10.097 -9.345 5.146
661 H LYS 94 H LYS 94 -10.775 -11.740 3.451
662 HA LYS 94 HA LYS 94 -13.646 -12.338 3.157
663 1HB LYS 94 1HB LYS 94 -12.961 -14.723 3.091
664 2HB LYS 94 2HB LYS 94 -11.289 -14.252 3.119
665 1HG LYS 94 1HG LYS 94 -13.177 -13.810 0.837
666 2HG LYS 94 2HG LYS 94 -11.901 -15.016 0.925
667 1HD LYS 94 1HD LYS 94 -10.370 -12.909 1.304
668 2HD LYS 94 2HD LYS 94 -11.688 -12.091 0.480
669 1HE LYS 94 1HE LYS 94 -10.014 -14.363 -0.472
670 2HE LYS 94 2HE LYS 94 -10.125 -12.743 -1.154
671 1HZ LYS 94 1HZ LYS 94 -12.330 -13.164 -1.959
672 2HZ LYS 94 2HZ LYS 94 -12.419 -14.634 -1.187
673 3HZ LYS 94 3HZ LYS 94 -11.372 -14.451 -2.476
674 H GLY 95 H GLY 95 -14.072 -11.642 5.318
675 1HA GLY 95 1HA GLY 95 -13.488 -13.469 7.378
676 2HA GLY 95 2HA GLY 95 -14.135 -11.858 7.619
677 H ASP 96 H ASP 96 -11.569 -13.851 7.983
678 HA ASP 96 HA ASP 96 -9.879 -11.670 9.079
679 1HB ASP 96 1HB ASP 96 -8.661 -13.392 10.225
680 2HB ASP 96 2HB ASP 96 -9.536 -14.655 9.392
681 H ASP 97 H ASP 97 -10.173 -13.507 6.319
682 HA ASP 97 HA ASP 97 -7.257 -13.661 5.922
683 1HB ASP 97 1HB ASP 97 -7.833 -15.106 4.008
684 2HB ASP 97 2HB ASP 97 -9.521 -15.006 4.463
685 H ILE 98 H ILE 98 -6.231 -12.655 4.269
686 HA ILE 98 HA ILE 98 -7.897 -11.025 2.537
687 HB ILE 98 HB ILE 98 -5.468 -10.178 4.101
688 1HG1 ILE 98 1HG1 ILE 98 -7.732 -10.083 5.110
689 2HG1 ILE 98 2HG1 ILE 98 -8.207 -9.009 3.809
690 1HG2 ILE 98 1HG2 ILE 98 -6.798 -8.684 1.825
691 2HG2 ILE 98 2HG2 ILE 98 -5.175 -9.368 1.792
692 3HG2 ILE 98 3HG2 ILE 98 -5.543 -8.029 2.877
693 1HD1 ILE 98 1HD1 ILE 98 -7.746 -7.758 5.831
694 2HD1 ILE 98 2HD1 ILE 98 -6.681 -7.314 4.501
695 3HD1 ILE 98 3HD1 ILE 98 -6.076 -8.339 5.813
696 H TYR 99 H TYR 99 -7.573 -11.251 0.543
697 HA TYR 99 HA TYR 99 -5.188 -12.675 -0.440
698 1HB TYR 99 1HB TYR 99 -6.842 -13.320 -2.324
699 2HB TYR 99 2HB TYR 99 -8.034 -12.727 -1.219
700 HD1 TYR 99 1HD TYR 99 -6.013 -15.566 -2.056
701 HD2 TYR 99 2HD TYR 99 -8.259 -13.828 1.102
702 HE1 TYR 99 1HE TYR 99 -6.088 -17.737 -0.927
703 HE2 TYR 99 2HE TYR 99 -8.343 -16.004 2.239
704 HH TYR 99 HH TYR 99 -6.372 -18.589 1.323
705 H VAL 100 H VAL 100 -4.284 -11.976 -2.285
706 HA VAL 100 HA VAL 100 -5.336 -9.555 -3.540
707 HB VAL 100 HB VAL 100 -3.778 -8.787 -1.877
708 1HG1 VAL 100 1HG1 VAL 100 -1.351 -9.313 -1.998
709 2HG1 VAL 100 2HG1 VAL 100 -1.696 -10.472 -3.280
710 3HG1 VAL 100 3HG1 VAL 100 -2.338 -10.737 -1.659
711 1HG2 VAL 100 1HG2 VAL 100 -2.245 -7.450 -3.292
712 2HG2 VAL 100 2HG2 VAL 100 -3.898 -7.480 -3.908
713 3HG2 VAL 100 3HG2 VAL 100 -2.661 -8.478 -4.662
714 H SER 101 H SER 101 -4.840 -9.295 -5.561
715 HA SER 101 HA SER 101 -3.457 -11.494 -6.980
716 1HB SER 101 1HB SER 101 -4.799 -10.873 -8.948
717 2HB SER 101 2HB SER 101 -5.575 -9.592 -8.016
718 HG SER 101 HG SER 101 -5.564 -12.123 -6.943
719 H THR 102 H THR 102 -1.491 -10.916 -7.647
720 HA THR 102 HA THR 102 -1.151 -8.198 -8.682
721 HB THR 102 HB THR 102 -0.284 -8.139 -6.393
722 HG1 THR 102 1HG THR 102 1.511 -7.971 -8.543
723 1HG2 THR 102 1HG2 THR 102 1.637 -9.533 -5.712
724 2HG2 THR 102 2HG2 THR 102 1.537 -10.400 -7.247
725 3HG2 THR 102 3HG2 THR 102 0.218 -10.514 -6.083
726 H LYS 103 H LYS 103 -0.702 -11.522 -9.204
727 HA LYS 103 HA LYS 103 1.590 -11.074 -10.887
728 1HB LYS 103 1HB LYS 103 -0.050 -13.607 -10.644
729 2HB LYS 103 2HB LYS 103 1.318 -13.206 -9.605
730 1HG LYS 103 1HG LYS 103 2.798 -13.172 -11.513
731 2HG LYS 103 2HG LYS 103 1.447 -13.468 -12.600
732 1HD LYS 103 1HD LYS 103 2.300 -15.380 -10.450
733 2HD LYS 103 2HD LYS 103 2.849 -15.475 -12.113
734 1HE LYS 103 1HE LYS 103 0.437 -15.621 -12.808
735 2HE LYS 103 2HE LYS 103 0.014 -15.734 -11.101
736 1HZ LYS 103 1HZ LYS 103 0.163 -17.918 -12.113
737 2HZ LYS 103 2HZ LYS 103 1.378 -17.754 -10.955
738 3HZ LYS 103 3HZ LYS 103 1.748 -17.619 -12.582
739 H GLY 104 H GLY 104 1.063 -9.823 -12.516
740 1HA GLY 104 1HA GLY 104 -1.287 -10.514 -14.140
741 2HA GLY 104 2HA GLY 104 0.298 -10.363 -14.898
742 H ILE 105 H ILE 105 -0.801 -8.439 -12.236
743 HA ILE 105 HA ILE 105 -1.374 -6.185 -13.955
744 HB ILE 105 HB ILE 105 -2.889 -6.551 -11.999
745 1HG1 ILE 105 1HG1 ILE 105 -2.426 -4.196 -12.747
746 2HG1 ILE 105 2HG1 ILE 105 -1.173 -4.094 -11.522
747 1HG2 ILE 105 1HG2 ILE 105 -0.520 -6.266 -10.262
748 2HG2 ILE 105 2HG2 ILE 105 -1.402 -7.736 -10.658
749 3HG2 ILE 105 3HG2 ILE 105 -2.214 -6.451 -9.771
750 1HD1 ILE 105 1HD1 ILE 105 -3.183 -3.006 -10.762
751 2HD1 ILE 105 2HD1 ILE 105 -2.877 -4.437 -9.773
752 3HD1 ILE 105 3HD1 ILE 105 -4.110 -4.477 -11.023
753 H LEU 106 H LEU 106 -0.055 -4.350 -14.168
754 HA LEU 106 HA LEU 106 2.651 -4.907 -13.636
755 1HB LEU 106 1HB LEU 106 2.943 -2.747 -14.908
756 2HB LEU 106 2HB LEU 106 1.222 -2.772 -15.153
757 HG LEU 106 HG LEU 106 3.048 -4.966 -16.127
758 1HD1 LEU 106 1HD1 LEU 106 0.185 -4.358 -16.809
759 2HD1 LEU 106 2HD1 LEU 106 0.760 -5.702 -15.825
760 3HD1 LEU 106 3HD1 LEU 106 1.178 -5.620 -17.537
761 1HD2 LEU 106 1HD2 LEU 106 1.929 -2.613 -17.640
762 2HD2 LEU 106 2HD2 LEU 106 2.781 -3.983 -18.351
763 3HD2 LEU 106 3HD2 LEU 106 3.625 -2.900 -17.245
764 HA PRO 107 HA PRO 107 3.109 -2.149 -9.931
765 1HB PRO 107 1HB PRO 107 4.992 -3.085 -9.088
766 2HB PRO 107 2HB PRO 107 5.907 -2.719 -10.535
767 1HG PRO 107 1HG PRO 107 4.357 -5.158 -9.829
768 2HG PRO 107 2HG PRO 107 5.874 -4.952 -10.737
769 1HD PRO 107 1HD PRO 107 3.525 -5.468 -11.940
770 2HD PRO 107 2HD PRO 107 4.809 -4.503 -12.705
771 H ASN 108 H ASN 108 3.230 -0.046 -10.259
772 HA ASN 108 HA ASN 108 4.440 1.008 -12.616
773 1HB ASN 108 1HB ASN 108 3.738 3.231 -11.565
774 2HB ASN 108 2HB ASN 108 2.919 2.259 -10.355
775 1HD2 ASN 108 1HD2 ASN 108 1.029 1.179 -10.889
776 2HD2 ASN 108 2HD2 ASN 108 0.235 1.380 -12.398
777 H LYS 109 H LYS 109 5.764 3.164 -12.215
778 HA LYS 109 HA LYS 109 8.210 2.281 -11.370
779 1HB LYS 109 1HB LYS 109 8.958 4.644 -11.443
780 2HB LYS 109 2HB LYS 109 7.275 5.050 -11.705
781 1HG LYS 109 1HG LYS 109 8.535 4.955 -13.840
782 2HG LYS 109 2HG LYS 109 7.301 3.693 -13.786
783 1HD LYS 109 1HD LYS 109 9.006 2.059 -13.100
784 2HD LYS 109 2HD LYS 109 10.232 3.320 -13.157
785 1HE LYS 109 1HE LYS 109 9.842 3.605 -15.544
786 2HE LYS 109 2HE LYS 109 8.597 2.357 -15.494
787 1HZ LYS 109 1HZ LYS 109 10.282 0.769 -14.769
788 2HZ LYS 109 2HZ LYS 109 11.453 1.982 -14.831
789 3HZ LYS 109 3HZ LYS 109 10.738 1.461 -16.246
790 H ALA 110 H ALA 110 8.772 1.720 -9.800
791 HA ALA 110 HA ALA 110 9.338 2.842 -7.344
792 1HB ALA 110 1HB ALA 110 6.906 2.916 -6.901
793 2HB ALA 110 2HB ALA 110 7.652 1.663 -5.902
794 3HB ALA 110 3HB ALA 110 6.762 1.218 -7.354
795 H HIS 111 H HIS 111 8.241 0.211 -9.231
796 HA HIS 111 HA HIS 111 10.719 -1.256 -8.782
797 1HB HIS 111 1HB HIS 111 9.469 -3.423 -8.871
798 2HB HIS 111 2HB HIS 111 7.959 -2.539 -8.778
799 HD1 HIS 111 1HD HIS 111 6.993 -2.310 -6.629
800 HD2 HIS 111 2HD HIS 111 11.053 -3.011 -6.368
801 HE1 HIS 111 1HE HIS 111 7.468 -2.638 -4.156
802 HE2 HIS 111 2HE HIS 111 9.809 -3.489 -4.163
803 H SER 112 H SER 112 11.081 -2.719 -10.639
804 HA SER 112 HA SER 112 11.162 -3.237 -12.810
805 1HB SER 112 1HB SER 112 8.233 -2.427 -12.791
806 2HB SER 112 2HB SER 112 8.861 -4.045 -12.504
807 HG SER 112 HG SER 112 9.245 -2.576 -14.858
Start of MODEL 17
1 1H MET 1 1HT MET 1 -3.609 -18.109 -12.322
2 2H MET 1 2HT MET 1 -3.808 -16.429 -12.253
3 3H MET 1 3HT MET 1 -5.033 -17.438 -11.741
4 HA MET 1 HA MET 1 -3.816 -18.238 -9.917
5 1HB MET 1 1HB MET 1 -1.653 -16.274 -10.733
6 2HB MET 1 2HB MET 1 -1.570 -17.979 -11.114
7 1HG MET 1 1HG MET 1 -0.185 -17.554 -9.226
8 2HG MET 1 2HG MET 1 -1.564 -18.502 -8.696
9 1HE MET 1 1HE MET 1 -0.737 -16.425 -5.534
10 2HE MET 1 2HE MET 1 0.417 -17.054 -6.706
11 3HE MET 1 3HE MET 1 -0.961 -18.036 -6.213
12 H SER 2 H SER 2 -2.999 -14.844 -10.743
13 HA SER 2 HA SER 2 -3.652 -12.902 -10.033
14 1HB SER 2 1HB SER 2 -6.033 -12.542 -9.514
15 2HB SER 2 2HB SER 2 -6.264 -14.289 -9.446
16 HG SER 2 HG SER 2 -5.456 -12.712 -11.616
17 H PHE 3 H PHE 3 -5.436 -14.758 -7.626
18 HA PHE 3 HA PHE 3 -4.556 -12.870 -5.635
19 1HB PHE 3 1HB PHE 3 -6.232 -14.084 -4.185
20 2HB PHE 3 2HB PHE 3 -6.645 -15.007 -5.615
21 HD1 PHE 3 1HD PHE 3 -8.040 -14.135 -7.308
22 HD2 PHE 3 2HD PHE 3 -6.639 -11.598 -4.190
23 HE1 PHE 3 1HE PHE 3 -9.623 -12.386 -8.009
24 HE2 PHE 3 2HE PHE 3 -8.213 -9.863 -4.884
25 HZ PHE 3 HZ PHE 3 -9.705 -10.245 -6.788
26 H GLU 4 H GLU 4 -3.065 -13.168 -4.294
27 HA GLU 4 HA GLU 4 -2.171 -15.874 -3.561
28 1HB GLU 4 1HB GLU 4 -0.614 -13.281 -3.626
29 2HB GLU 4 2HB GLU 4 -0.560 -14.456 -4.919
30 1HG GLU 4 1HG GLU 4 0.409 -16.096 -3.407
31 2HG GLU 4 2HG GLU 4 0.348 -14.920 -2.091
32 H LYS 5 H LYS 5 -1.883 -16.148 -1.285
33 HA LYS 5 HA LYS 5 -3.261 -14.179 0.328
34 1HB LYS 5 1HB LYS 5 -1.913 -16.764 1.223
35 2HB LYS 5 2HB LYS 5 -3.566 -16.637 0.632
36 1HG LYS 5 1HG LYS 5 -3.633 -16.790 3.027
37 2HG LYS 5 2HG LYS 5 -4.170 -15.198 2.532
38 1HD LYS 5 1HD LYS 5 -2.789 -14.970 4.492
39 2HD LYS 5 2HD LYS 5 -1.958 -14.267 3.110
40 1HE LYS 5 1HE LYS 5 -0.584 -16.264 2.878
41 2HE LYS 5 2HE LYS 5 -1.436 -17.013 4.221
42 1HZ LYS 5 1HZ LYS 5 0.267 -14.574 4.393
43 2HZ LYS 5 2HZ LYS 5 0.644 -16.110 4.961
44 3HZ LYS 5 3HZ LYS 5 -0.616 -15.250 5.665
45 H ILE 6 H ILE 6 -2.278 -12.630 1.144
46 HA ILE 6 HA ILE 6 0.654 -12.794 1.486
47 HB ILE 6 HB ILE 6 0.008 -11.373 -0.375
48 1HG1 ILE 6 1HG1 ILE 6 2.068 -10.818 0.877
49 2HG1 ILE 6 2HG1 ILE 6 1.134 -9.738 1.907
50 1HG2 ILE 6 1HG2 ILE 6 -1.445 -9.708 1.630
51 2HG2 ILE 6 2HG2 ILE 6 -2.144 -10.665 0.331
52 3HG2 ILE 6 3HG2 ILE 6 -1.156 -9.245 -0.052
53 1HD1 ILE 6 1HD1 ILE 6 1.553 -9.405 -1.056
54 2HD1 ILE 6 2HD1 ILE 6 2.368 -8.500 0.220
55 3HD1 ILE 6 3HD1 ILE 6 0.627 -8.325 -0.012
56 H CYS 7 H CYS 7 -2.252 -11.368 2.733
57 HA CYS 7 HA CYS 7 -1.073 -11.383 5.392
58 1HB CYS 7 1HB CYS 7 -0.546 -9.155 4.804
59 2HB CYS 7 2HB CYS 7 -1.951 -9.089 5.839
60 HG CYS 7 HG CYS 7 -1.647 -7.518 3.150
61 H SER 8 H SER 8 -2.883 -10.277 6.863
62 HA SER 8 HA SER 8 -5.441 -11.510 6.160
63 1HB SER 8 1HB SER 8 -5.683 -12.513 8.237
64 2HB SER 8 2HB SER 8 -4.410 -11.689 9.026
65 HG SER 8 HG SER 8 -4.450 -14.002 7.558
66 H LEU 9 H LEU 9 -7.271 -10.441 7.099
67 HA LEU 9 HA LEU 9 -6.960 -7.632 7.614
68 1HB LEU 9 1HB LEU 9 -9.376 -9.337 8.151
69 2HB LEU 9 2HB LEU 9 -9.020 -8.892 6.525
70 HG LEU 9 HG LEU 9 -9.270 -6.412 7.387
71 1HD1 LEU 9 1HD1 LEU 9 -11.704 -6.508 7.149
72 2HD1 LEU 9 2HD1 LEU 9 -11.635 -8.267 7.308
73 3HD1 LEU 9 3HD1 LEU 9 -10.874 -7.472 5.928
74 1HD2 LEU 9 1HD2 LEU 9 -10.714 -7.884 9.601
75 2HD2 LEU 9 2HD2 LEU 9 -10.746 -6.141 9.319
76 3HD2 LEU 9 3HD2 LEU 9 -9.243 -6.928 9.794
77 H ASP 10 H ASP 10 -7.164 -10.538 9.422
78 HA ASP 10 HA ASP 10 -7.526 -9.337 11.981
79 1HB ASP 10 1HB ASP 10 -6.478 -12.049 11.149
80 2HB ASP 10 2HB ASP 10 -8.089 -11.619 11.737
81 H ASP 11 H ASP 11 -4.917 -9.567 9.852
82 HA ASP 11 HA ASP 11 -2.938 -9.073 11.921
83 1HB ASP 11 1HB ASP 11 -2.588 -9.037 8.910
84 2HB ASP 11 2HB ASP 11 -2.314 -10.451 9.925
85 H ILE 12 H ILE 12 -4.215 -7.422 9.004
86 HA ILE 12 HA ILE 12 -3.616 -4.961 10.437
87 HB ILE 12 HB ILE 12 -3.697 -3.713 8.373
88 1HG1 ILE 12 1HG1 ILE 12 -5.274 -5.217 7.135
89 2HG1 ILE 12 2HG1 ILE 12 -3.928 -6.326 6.872
90 1HG2 ILE 12 1HG2 ILE 12 -1.876 -6.092 8.237
91 2HG2 ILE 12 2HG2 ILE 12 -1.525 -4.528 9.014
92 3HG2 ILE 12 3HG2 ILE 12 -1.677 -4.644 7.258
93 1HD1 ILE 12 1HD1 ILE 12 -4.319 -4.902 4.935
94 2HD1 ILE 12 2HD1 ILE 12 -2.731 -4.590 5.674
95 3HD1 ILE 12 3HD1 ILE 12 -4.072 -3.486 5.966
96 H TRP 13 H TRP 13 -5.164 -4.194 11.407
97 HA TRP 13 HA TRP 13 -7.904 -4.823 10.872
98 1HB TRP 13 1HB TRP 13 -8.232 -3.363 12.896
99 2HB TRP 13 2HB TRP 13 -6.500 -3.112 12.882
100 HD1 TRP 13 HD TRP 13 -5.008 -5.511 12.992
101 HE1 TRP 13 1HE TRP 13 -5.384 -7.486 14.595
102 HE3 TRP 13 3HE TRP 13 -9.874 -4.608 14.227
103 HZ2 TRP 13 2HZ TRP 13 -7.492 -8.515 16.191
104 HZ3 TRP 13 3HZ TRP 13 -10.995 -6.134 15.798
105 HH2 TRP 13 HH TRP 13 -9.826 -8.042 16.755
106 H VAL 14 H VAL 14 -9.511 -2.935 10.941
107 HA VAL 14 HA VAL 14 -9.074 -1.257 8.766
108 HB VAL 14 HB VAL 14 -11.338 -1.786 9.641
109 1HG1 VAL 14 1HG1 VAL 14 -12.288 -0.569 11.536
110 2HG1 VAL 14 2HG1 VAL 14 -10.712 0.149 11.854
111 3HG1 VAL 14 3HG1 VAL 14 -10.931 -1.587 12.030
112 1HG2 VAL 14 1HG2 VAL 14 -10.752 1.161 9.457
113 2HG2 VAL 14 2HG2 VAL 14 -12.348 0.428 9.298
114 3HG2 VAL 14 3HG2 VAL 14 -11.089 0.069 8.113
115 H GLY 15 H GLY 15 -8.024 0.609 8.481
116 1HA GLY 15 1HA GLY 15 -7.407 2.318 10.757
117 2HA GLY 15 2HA GLY 15 -7.143 2.690 9.056
118 H GLU 16 H GLU 16 -6.100 -0.369 9.499
119 HA GLU 16 HA GLU 16 -3.434 0.490 10.229
120 1HB GLU 16 1HB GLU 16 -3.157 -2.052 10.895
121 2HB GLU 16 2HB GLU 16 -4.892 -2.049 10.753
122 1HG GLU 16 1HG GLU 16 -5.108 -0.324 12.356
123 2HG GLU 16 2HG GLU 16 -3.350 -0.161 12.439
124 H MET 17 H MET 17 -1.645 -0.488 9.250
125 HA MET 17 HA MET 17 -2.031 -1.506 6.556
126 1HB MET 17 1HB MET 17 -2.294 0.840 6.230
127 2HB MET 17 2HB MET 17 -0.674 0.379 5.685
128 1HG MET 17 1HG MET 17 0.288 1.208 7.717
129 2HG MET 17 2HG MET 17 -1.302 1.573 8.364
130 1HE MET 17 1HE MET 17 -0.701 3.881 9.039
131 2HE MET 17 2HE MET 17 0.046 5.079 7.989
132 3HE MET 17 3HE MET 17 0.957 3.642 8.469
133 H GLU 18 H GLU 18 -0.083 -2.343 5.689
134 HA GLU 18 HA GLU 18 2.359 -1.968 7.106
135 1HB GLU 18 1HB GLU 18 0.993 -4.660 7.052
136 2HB GLU 18 2HB GLU 18 1.377 -3.711 8.480
137 1HG GLU 18 1HG GLU 18 3.367 -5.051 6.668
138 2HG GLU 18 2HG GLU 18 2.884 -5.608 8.262
139 H THR 19 H THR 19 4.148 -2.714 5.844
140 HA THR 19 HA THR 19 3.536 -3.092 3.036
141 HB THR 19 HB THR 19 6.165 -2.754 4.474
142 HG1 THR 19 1HG THR 19 4.332 -1.022 3.332
143 1HG2 THR 19 1HG2 THR 19 5.596 -2.765 1.499
144 2HG2 THR 19 2HG2 THR 19 6.484 -4.000 2.390
145 3HG2 THR 19 3HG2 THR 19 7.154 -2.377 2.227
146 H PHE 20 H PHE 20 3.449 -4.985 2.270
147 HA PHE 20 HA PHE 20 4.824 -7.180 3.645
148 1HB PHE 20 1HB PHE 20 3.055 -8.699 2.749
149 2HB PHE 20 2HB PHE 20 2.163 -7.297 2.199
150 HD1 PHE 20 1HD PHE 20 3.356 -9.075 5.183
151 HD2 PHE 20 2HD PHE 20 0.768 -6.051 3.674
152 HE1 PHE 20 1HE PHE 20 2.199 -8.981 7.349
153 HE2 PHE 20 2HE PHE 20 -0.379 -5.948 5.826
154 HZ PHE 20 HZ PHE 20 0.329 -7.413 7.674
155 H GLU 21 H GLU 21 5.528 -8.856 2.243
156 HA GLU 21 HA GLU 21 6.135 -7.762 -0.387
157 1HB GLU 21 1HB GLU 21 7.658 -9.806 1.224
158 2HB GLU 21 2HB GLU 21 8.041 -8.094 1.181
159 1HG GLU 21 1HG GLU 21 8.482 -8.255 -1.216
160 2HG GLU 21 2HG GLU 21 8.146 -9.984 -1.146
161 H THR 22 H THR 22 5.837 -9.057 -2.118
162 HA THR 22 HA THR 22 3.864 -11.155 -1.799
163 HB THR 22 HB THR 22 3.771 -11.166 -4.234
164 HG1 THR 22 1HG THR 22 5.247 -9.921 -5.427
165 1HG2 THR 22 1HG2 THR 22 3.263 -8.817 -4.692
166 2HG2 THR 22 2HG2 THR 22 4.154 -8.337 -3.256
167 3HG2 THR 22 3HG2 THR 22 2.660 -9.273 -3.094
168 H SER 23 H SER 23 4.239 -13.309 -2.942
169 HA SER 23 HA SER 23 6.661 -14.462 -2.102
170 1HB SER 23 1HB SER 23 5.854 -16.463 -3.248
171 2HB SER 23 2HB SER 23 4.640 -15.464 -4.058
172 HG SER 23 HG SER 23 3.572 -15.182 -2.225
173 H ASP 24 H ASP 24 5.921 -12.634 -4.831
174 HA ASP 24 HA ASP 24 7.941 -13.780 -6.574
175 1HB ASP 24 1HB ASP 24 6.401 -11.202 -6.871
176 2HB ASP 24 2HB ASP 24 5.807 -12.762 -7.430
177 H GLY 25 H GLY 25 7.808 -11.589 -4.004
178 1HA GLY 25 1HA GLY 25 10.574 -10.749 -4.521
179 2HA GLY 25 2HA GLY 25 9.769 -10.722 -2.961
180 H THR 26 H THR 26 7.378 -9.431 -4.342
181 HA THR 26 HA THR 26 8.470 -6.809 -4.968
182 HB THR 26 HB THR 26 5.645 -7.860 -5.137
183 HG1 THR 26 1HG THR 26 7.866 -8.190 -6.717
184 1HG2 THR 26 1HG2 THR 26 6.987 -5.474 -6.402
185 2HG2 THR 26 2HG2 THR 26 5.847 -5.423 -5.057
186 3HG2 THR 26 3HG2 THR 26 5.316 -5.985 -6.644
187 H GLU 27 H GLU 27 8.371 -5.156 -3.486
188 HA GLU 27 HA GLU 27 6.834 -5.582 -1.084
189 1HB GLU 27 1HB GLU 27 8.912 -4.724 -0.381
190 2HB GLU 27 2HB GLU 27 7.854 -3.307 -0.401
191 1HG GLU 27 1HG GLU 27 9.943 -2.645 -1.224
192 2HG GLU 27 2HG GLU 27 8.755 -2.597 -2.523
193 H VAL 28 H VAL 28 5.037 -4.662 -0.534
194 HA VAL 28 HA VAL 28 3.869 -2.546 -2.254
195 HB VAL 28 HB VAL 28 2.488 -5.073 -1.293
196 1HG1 VAL 28 1HG1 VAL 28 1.564 -3.023 -3.267
197 2HG1 VAL 28 2HG1 VAL 28 0.946 -3.291 -1.637
198 3HG1 VAL 28 3HG1 VAL 28 0.729 -4.526 -2.881
199 1HG2 VAL 28 1HG2 VAL 28 2.557 -5.913 -3.599
200 2HG2 VAL 28 2HG2 VAL 28 4.161 -5.756 -2.886
201 3HG2 VAL 28 3HG2 VAL 28 3.588 -4.556 -4.044
202 H LEU 29 H LEU 29 2.334 -1.276 -1.094
203 HA LEU 29 HA LEU 29 2.444 -1.520 1.833
204 1HB LEU 29 1HB LEU 29 1.552 0.740 0.042
205 2HB LEU 29 2HB LEU 29 3.148 0.644 0.711
206 HG LEU 29 HG LEU 29 0.547 1.042 2.229
207 1HD1 LEU 29 1HD1 LEU 29 1.928 1.283 4.234
208 2HD1 LEU 29 2HD1 LEU 29 3.358 0.831 3.306
209 3HD1 LEU 29 3HD1 LEU 29 2.061 -0.338 3.556
210 1HD2 LEU 29 1HD2 LEU 29 1.487 3.221 2.781
211 2HD2 LEU 29 2HD2 LEU 29 1.403 3.028 1.025
212 3HD2 LEU 29 3HD2 LEU 29 2.937 2.841 1.862
213 H ILE 30 H ILE 30 0.756 -2.666 2.591
214 HA ILE 30 HA ILE 30 -1.762 -2.503 1.127
215 HB ILE 30 HB ILE 30 -0.900 -4.583 3.194
216 1HG1 ILE 30 1HG1 ILE 30 -1.261 -4.751 0.227
217 2HG1 ILE 30 2HG1 ILE 30 -1.137 -6.199 1.223
218 1HG2 ILE 30 1HG2 ILE 30 -3.289 -4.148 3.280
219 2HG2 ILE 30 2HG2 ILE 30 -2.974 -5.755 2.621
220 3HG2 ILE 30 3HG2 ILE 30 -3.418 -4.429 1.544
221 1HD1 ILE 30 1HD1 ILE 30 0.956 -5.785 0.139
222 2HD1 ILE 30 2HD1 ILE 30 1.155 -5.494 1.867
223 3HD1 ILE 30 3HD1 ILE 30 0.996 -4.141 0.757
224 H VAL 31 H VAL 31 -3.218 -1.236 1.928
225 HA VAL 31 HA VAL 31 -3.112 -0.591 4.802
226 HB VAL 31 HB VAL 31 -4.036 1.188 2.523
227 1HG1 VAL 31 1HG1 VAL 31 -3.811 1.819 5.473
228 2HG1 VAL 31 2HG1 VAL 31 -5.298 1.629 4.554
229 3HG1 VAL 31 3HG1 VAL 31 -4.210 2.967 4.198
230 1HG2 VAL 31 1HG2 VAL 31 -2.083 2.568 3.026
231 2HG2 VAL 31 2HG2 VAL 31 -1.605 0.935 2.552
232 3HG2 VAL 31 3HG2 VAL 31 -1.567 1.410 4.247
233 H ASN 32 H ASN 32 -4.892 -1.215 5.917
234 HA ASN 32 HA ASN 32 -7.272 -2.005 4.434
235 1HB ASN 32 1HB ASN 32 -6.692 -1.967 7.421
236 2HB ASN 32 2HB ASN 32 -6.394 -3.348 6.383
237 1HD2 ASN 32 1HD2 ASN 32 -7.725 -4.617 7.694
238 2HD2 ASN 32 2HD2 ASN 32 -9.444 -4.514 7.594
239 H SER 33 H SER 33 -8.357 -0.231 3.771
240 HA SER 33 HA SER 33 -8.597 2.025 5.583
241 1HB SER 33 1HB SER 33 -9.216 3.288 3.584
242 2HB SER 33 2HB SER 33 -9.206 1.797 2.636
243 HG SER 33 HG SER 33 -6.961 1.717 3.693
244 H GLU 34 H GLU 34 -10.641 2.776 6.188
245 HA GLU 34 HA GLU 34 -12.755 0.867 6.074
246 1HB GLU 34 1HB GLU 34 -12.772 3.742 7.008
247 2HB GLU 34 2HB GLU 34 -12.440 2.343 8.018
248 1HG GLU 34 1HG GLU 34 -14.691 1.513 7.625
249 2HG GLU 34 2HG GLU 34 -15.032 2.905 6.601
250 H GLU 35 H GLU 35 -12.154 4.047 4.685
251 HA GLU 35 HA GLU 35 -14.625 4.150 3.265
252 1HB GLU 35 1HB GLU 35 -13.711 6.183 2.232
253 2HB GLU 35 2HB GLU 35 -12.140 5.831 2.929
254 1HG GLU 35 1HG GLU 35 -13.082 6.069 5.175
255 2HG GLU 35 2HG GLU 35 -14.654 6.436 4.469
256 H HIS 36 H HIS 36 -11.313 3.343 2.397
257 HA HIS 36 HA HIS 36 -12.131 2.987 -0.424
258 1HB HIS 36 1HB HIS 36 -9.737 2.925 -0.970
259 2HB HIS 36 2HB HIS 36 -9.330 3.024 0.733
260 HD1 HIS 36 1HD HIS 36 -9.969 5.155 -2.192
261 HD2 HIS 36 2HD HIS 36 -9.955 5.554 1.950
262 HE1 HIS 36 1HE HIS 36 -9.841 7.604 -1.745
263 HE2 HIS 36 2HE HIS 36 -9.672 7.804 0.775
264 H GLY 37 H GLY 37 -12.073 1.097 2.218
265 1HA GLY 37 1HA GLY 37 -11.897 -1.348 0.768
266 2HA GLY 37 2HA GLY 37 -12.045 -1.178 2.515
267 H VAL 38 H VAL 38 -10.421 -3.153 1.659
268 HA VAL 38 HA VAL 38 -7.828 -2.252 2.549
269 HB VAL 38 HB VAL 38 -8.586 -4.987 1.461
270 1HG1 VAL 38 1HG1 VAL 38 -6.183 -4.587 1.522
271 2HG1 VAL 38 2HG1 VAL 38 -6.644 -5.788 2.726
272 3HG1 VAL 38 3HG1 VAL 38 -6.287 -4.135 3.224
273 1HG2 VAL 38 1HG2 VAL 38 -8.600 -4.041 4.330
274 2HG2 VAL 38 2HG2 VAL 38 -8.872 -5.700 3.797
275 3HG2 VAL 38 3HG2 VAL 38 -10.019 -4.432 3.361
276 H LYS 39 H LYS 39 -6.319 -1.457 1.233
277 HA LYS 39 HA LYS 39 -6.572 -2.015 -1.652
278 1HB LYS 39 1HB LYS 39 -5.511 0.215 -1.985
279 2HB LYS 39 2HB LYS 39 -5.616 0.482 -0.259
280 1HG LYS 39 1HG LYS 39 -7.405 1.697 -1.060
281 2HG LYS 39 2HG LYS 39 -8.158 0.196 -0.548
282 1HD LYS 39 1HD LYS 39 -7.412 0.809 -3.409
283 2HD LYS 39 2HD LYS 39 -9.001 1.085 -2.730
284 1HE LYS 39 1HE LYS 39 -7.703 -1.631 -3.070
285 2HE LYS 39 2HE LYS 39 -8.996 -0.935 -4.018
286 1HZ LYS 39 1HZ LYS 39 -9.925 -2.414 -2.464
287 2HZ LYS 39 2HZ LYS 39 -10.373 -0.853 -1.971
288 3HZ LYS 39 3HZ LYS 39 -9.138 -1.699 -1.177
289 H ALA 40 H ALA 40 -4.724 -2.438 -2.821
290 HA ALA 40 HA ALA 40 -2.204 -2.696 -1.324
291 1HB ALA 40 1HB ALA 40 -3.266 -4.465 -3.514
292 2HB ALA 40 2HB ALA 40 -3.220 -4.894 -1.801
293 3HB ALA 40 3HB ALA 40 -1.718 -4.640 -2.696
294 H TYR 41 H TYR 41 -0.756 -1.390 -2.087
295 HA TYR 41 HA TYR 41 -0.540 -1.025 -4.921
296 1HB TYR 41 1HB TYR 41 -1.738 0.898 -4.735
297 2HB TYR 41 2HB TYR 41 -0.139 1.515 -4.347
298 HD1 TYR 41 1HD TYR 41 -3.478 1.232 -3.265
299 HD2 TYR 41 2HD TYR 41 0.491 1.780 -1.853
300 HE1 TYR 41 1HE TYR 41 -4.362 2.190 -1.199
301 HE2 TYR 41 2HE TYR 41 -0.401 2.746 0.240
302 HH TYR 41 HH TYR 41 -2.425 3.875 0.971
303 H GLN 42 H GLN 42 1.433 -0.643 -5.704
304 HA GLN 42 HA GLN 42 3.594 -1.745 -4.535
305 1HB GLN 42 1HB GLN 42 4.988 -0.623 -6.196
306 2HB GLN 42 2HB GLN 42 3.722 0.466 -6.673
307 1HG GLN 42 1HG GLN 42 3.929 -1.329 -8.171
308 2HG GLN 42 2HG GLN 42 2.376 -1.415 -7.327
309 1HE2 GLN 42 1HE2 GLN 42 5.579 -2.680 -7.494
310 2HE2 GLN 42 2HE2 GLN 42 5.216 -4.176 -6.699
311 H ALA 43 H ALA 43 5.314 -1.244 -3.267
312 HA ALA 43 HA ALA 43 5.078 1.165 -1.698
313 1HB ALA 43 1HB ALA 43 5.630 -0.966 -0.584
314 2HB ALA 43 2HB ALA 43 6.893 0.241 -0.333
315 3HB ALA 43 3HB ALA 43 7.130 -1.052 -1.509
316 H MET 44 H MET 44 5.366 2.010 -3.788
317 HA MET 44 HA MET 44 7.993 2.504 -4.961
318 1HB MET 44 1HB MET 44 7.030 4.434 -6.170
319 2HB MET 44 2HB MET 44 5.519 4.156 -5.340
320 1HG MET 44 1HG MET 44 5.387 3.291 -7.567
321 2HG MET 44 2HG MET 44 5.308 1.973 -6.409
322 1HE MET 44 1HE MET 44 8.088 0.867 -5.597
323 2HE MET 44 2HE MET 44 8.509 -0.064 -7.010
324 3HE MET 44 3HE MET 44 6.869 -0.091 -6.424
325 H CYS 45 H CYS 45 9.404 2.946 -3.597
326 HA CYS 45 HA CYS 45 9.963 5.681 -3.259
327 1HB CYS 45 1HB CYS 45 10.450 5.206 -0.707
328 2HB CYS 45 2HB CYS 45 9.098 4.101 -0.891
329 HA PRO 46 HA PRO 46 13.744 3.138 -3.629
330 1HB PRO 46 1HB PRO 46 14.116 3.394 -5.852
331 2HB PRO 46 2HB PRO 46 14.722 5.021 -5.550
332 1HG PRO 46 1HG PRO 46 12.052 4.148 -6.477
333 2HG PRO 46 2HG PRO 46 12.861 5.707 -6.700
334 1HD PRO 46 1HD PRO 46 10.786 5.439 -5.051
335 2HD PRO 46 2HD PRO 46 12.144 6.520 -4.652
336 H HIS 47 H HIS 47 13.223 5.422 -1.685
337 HA HIS 47 HA HIS 47 16.029 6.189 -1.365
338 1HB HIS 47 1HB HIS 47 15.646 8.441 -1.570
339 2HB HIS 47 2HB HIS 47 14.468 8.354 -0.286
340 HD2 HIS 47 2HD HIS 47 14.359 8.163 -4.244
341 HE1 HIS 47 1HE HIS 47 10.673 9.629 -2.754
342 HE2 HIS 47 2HE HIS 47 12.136 9.350 -4.794
343 H GLN 48 H GLN 48 14.520 4.153 -0.381
344 HA GLN 48 HA GLN 48 13.057 4.286 1.887
345 1HB GLN 48 1HB GLN 48 14.957 2.150 0.959
346 2HB GLN 48 2HB GLN 48 13.326 2.367 0.391
347 1HG GLN 48 1HG GLN 48 13.166 0.535 1.766
348 2HG GLN 48 2HG GLN 48 12.575 1.851 2.764
349 1HE2 GLN 48 1HE2 GLN 48 12.941 0.604 4.547
350 2HE2 GLN 48 2HE2 GLN 48 14.521 0.391 5.228
351 H GLU 49 H GLU 49 13.359 4.903 3.865
352 HA GLU 49 HA GLU 49 15.977 5.057 5.205
353 1HB GLU 49 1HB GLU 49 14.661 5.962 7.096
354 2HB GLU 49 2HB GLU 49 13.182 5.672 6.217
355 1HG GLU 49 1HG GLU 49 13.564 7.957 6.072
356 2HG GLU 49 2HG GLU 49 13.968 7.248 4.507
357 H ILE 50 H ILE 50 12.747 3.867 5.930
358 HA ILE 50 HA ILE 50 13.599 1.318 6.926
359 HB ILE 50 HB ILE 50 13.780 2.881 8.897
360 1HG1 ILE 50 1HG1 ILE 50 11.424 0.986 9.118
361 2HG1 ILE 50 2HG1 ILE 50 12.281 1.681 10.483
362 1HG2 ILE 50 1HG2 ILE 50 10.870 3.447 8.411
363 2HG2 ILE 50 2HG2 ILE 50 12.212 4.578 8.247
364 3HG2 ILE 50 3HG2 ILE 50 11.777 3.947 9.839
365 1HD1 ILE 50 1HD1 ILE 50 13.443 -0.197 8.444
366 2HD1 ILE 50 2HD1 ILE 50 12.993 -0.592 10.102
367 3HD1 ILE 50 3HD1 ILE 50 14.324 0.526 9.790
368 H LEU 51 H LEU 51 11.311 0.173 7.484
369 HA LEU 51 HA LEU 51 9.648 0.594 5.247
370 1HB LEU 51 1HB LEU 51 8.039 -0.965 6.401
371 2HB LEU 51 2HB LEU 51 9.119 -0.996 7.767
372 HG LEU 51 HG LEU 51 9.242 -3.009 6.345
373 1HD1 LEU 51 1HD1 LEU 51 10.352 -1.181 4.243
374 2HD1 LEU 51 2HD1 LEU 51 8.818 -2.046 4.201
375 3HD1 LEU 51 3HD1 LEU 51 10.333 -2.944 4.179
376 1HD2 LEU 51 1HD2 LEU 51 11.803 -1.409 6.429
377 2HD2 LEU 51 2HD2 LEU 51 11.687 -3.154 6.199
378 3HD2 LEU 51 3HD2 LEU 51 11.172 -2.433 7.722
379 H LEU 52 H LEU 52 8.497 2.234 4.949
380 HA LEU 52 HA LEU 52 7.706 4.168 6.800
381 1HB LEU 52 1HB LEU 52 7.964 4.626 4.400
382 2HB LEU 52 2HB LEU 52 6.433 5.184 5.022
383 HG LEU 52 HG LEU 52 5.341 3.150 3.985
384 1HD1 LEU 52 1HD1 LEU 52 6.783 5.023 2.124
385 2HD1 LEU 52 2HD1 LEU 52 5.230 5.308 2.923
386 3HD1 LEU 52 3HD1 LEU 52 5.380 4.029 1.722
387 1HD2 LEU 52 1HD2 LEU 52 7.305 1.704 3.748
388 2HD2 LEU 52 2HD2 LEU 52 8.028 2.857 2.623
389 3HD2 LEU 52 3HD2 LEU 52 6.555 1.997 2.179
390 H SER 53 H SER 53 6.322 1.179 6.160
391 HA SER 53 HA SER 53 3.602 1.540 5.855
392 1HB SER 53 1HB SER 53 4.861 -0.325 5.319
393 2HB SER 53 2HB SER 53 3.564 -0.811 6.339
394 HG SER 53 HG SER 53 5.264 -1.719 7.381
395 H GLU 54 H GLU 54 5.358 1.736 8.876
396 HA GLU 54 HA GLU 54 2.823 1.429 10.281
397 1HB GLU 54 1HB GLU 54 4.189 1.316 12.338
398 2HB GLU 54 2HB GLU 54 5.641 1.574 11.382
399 1HG GLU 54 1HG GLU 54 5.116 -0.498 10.126
400 2HG GLU 54 2HG GLU 54 3.737 -0.759 11.189
401 H GLY 55 H GLY 55 4.165 3.801 8.735
402 1HA GLY 55 1HA GLY 55 4.473 6.073 10.174
403 2HA GLY 55 2HA GLY 55 2.722 5.834 10.166
404 H SER 56 H SER 56 1.651 5.785 8.108
405 HA SER 56 HA SER 56 3.084 7.116 5.934
406 1HB SER 56 1HB SER 56 2.035 5.457 4.324
407 2HB SER 56 2HB SER 56 1.588 4.598 5.782
408 HG SER 56 HG SER 56 4.074 4.963 6.112
409 H TYR 57 H TYR 57 0.016 5.578 6.147
410 HA TYR 57 HA TYR 57 -1.139 7.820 4.667
411 1HB TYR 57 1HB TYR 57 -2.287 5.119 5.387
412 2HB TYR 57 2HB TYR 57 -1.472 5.501 3.889
413 HD1 TYR 57 1HD TYR 57 -2.567 6.772 2.130
414 HD2 TYR 57 2HD TYR 57 -4.601 5.852 5.752
415 HE1 TYR 57 1HE TYR 57 -4.696 7.332 1.065
416 HE2 TYR 57 2HE TYR 57 -6.743 6.415 4.687
417 HH TYR 57 HH TYR 57 -7.528 7.793 2.828
418 H GLU 58 H GLU 58 -1.897 9.421 5.782
419 HA GLU 58 HA GLU 58 -3.603 8.893 8.106
420 1HB GLU 58 1HB GLU 58 -3.100 11.227 8.809
421 2HB GLU 58 2HB GLU 58 -1.967 11.351 7.474
422 1HG GLU 58 1HG GLU 58 -0.656 9.534 8.422
423 2HG GLU 58 2HG GLU 58 -1.768 9.444 9.788
424 H GLY 59 H GLY 59 -5.609 8.879 7.329
425 1HA GLY 59 1HA GLY 59 -6.775 11.293 6.313
426 2HA GLY 59 2HA GLY 59 -7.599 9.761 6.540
427 H GLY 60 H GLY 60 -5.162 11.176 4.469
428 1HA GLY 60 1HA GLY 60 -6.317 11.120 2.014
429 2HA GLY 60 2HA GLY 60 -5.811 9.447 2.234
430 H VAL 61 H VAL 61 -3.641 11.314 3.938
431 HA VAL 61 HA VAL 61 -1.912 11.808 1.623
432 HB VAL 61 HB VAL 61 -1.697 12.879 4.458
433 1HG1 VAL 61 1HG1 VAL 61 0.462 12.797 3.340
434 2HG1 VAL 61 2HG1 VAL 61 -0.069 14.467 3.531
435 3HG1 VAL 61 3HG1 VAL 61 -0.202 13.673 1.961
436 1HG2 VAL 61 1HG2 VAL 61 -2.740 14.221 1.973
437 2HG2 VAL 61 2HG2 VAL 61 -2.438 15.027 3.510
438 3HG2 VAL 61 3HG2 VAL 61 -3.673 13.771 3.399
439 H ILE 62 H ILE 62 0.095 10.847 1.570
440 HA ILE 62 HA ILE 62 0.583 8.894 3.710
441 HB ILE 62 HB ILE 62 1.406 8.655 0.827
442 1HG1 ILE 62 1HG1 ILE 62 -0.955 8.217 1.102
443 2HG1 ILE 62 2HG1 ILE 62 -0.620 7.168 2.477
444 1HG2 ILE 62 1HG2 ILE 62 1.858 6.811 3.112
445 2HG2 ILE 62 2HG2 ILE 62 3.110 7.681 2.201
446 3HG2 ILE 62 3HG2 ILE 62 2.153 6.398 1.424
447 1HD1 ILE 62 1HD1 ILE 62 -1.182 5.916 0.424
448 2HD1 ILE 62 2HD1 ILE 62 0.401 5.538 1.085
449 3HD1 ILE 62 3HD1 ILE 62 0.280 6.575 -0.330
450 H THR 63 H THR 63 2.140 9.187 4.885
451 HA THR 63 HA THR 63 4.313 11.038 4.369
452 HB THR 63 HB THR 63 3.473 9.424 6.758
453 HG1 THR 63 1HG THR 63 2.128 11.039 7.112
454 1HG2 THR 63 1HG2 THR 63 5.471 11.704 6.559
455 2HG2 THR 63 2HG2 THR 63 5.850 10.021 6.905
456 3HG2 THR 63 3HG2 THR 63 4.934 10.977 8.071
457 H CYS 64 H CYS 64 6.487 10.386 4.412
458 HA CYS 64 HA CYS 64 7.272 7.662 5.013
459 1HB CYS 64 1HB CYS 64 7.810 8.886 2.292
460 2HB CYS 64 2HB CYS 64 6.618 7.623 2.591
461 H ARG 65 H ARG 65 7.701 10.156 6.251
462 HA ARG 65 HA ARG 65 9.156 11.639 7.037
463 1HB ARG 65 1HB ARG 65 11.371 10.055 5.648
464 2HB ARG 65 2HB ARG 65 10.792 9.734 7.277
465 1HG ARG 65 1HG ARG 65 11.536 11.935 7.995
466 2HG ARG 65 2HG ARG 65 12.087 12.303 6.367
467 1HD ARG 65 1HD ARG 65 13.745 10.520 6.493
468 2HD ARG 65 2HD ARG 65 13.186 10.109 8.120
469 HE ARG 65 HE ARG 65 13.758 12.721 8.330
470 1HH1 ARG 65 1HH1 ARG 65 15.810 9.981 7.173
471 2HH1 ARG 65 2HH1 ARG 65 17.224 10.785 7.603
472 1HH2 ARG 65 1HH2 ARG 65 15.759 13.692 8.914
473 2HH2 ARG 65 2HH2 ARG 65 17.222 12.869 8.623
474 H ALA 66 H ALA 66 9.066 10.963 3.716
475 HA ALA 66 HA ALA 66 8.841 12.227 1.918
476 1HB ALA 66 1HB ALA 66 8.473 14.626 2.050
477 2HB ALA 66 2HB ALA 66 9.033 14.644 3.721
478 3HB ALA 66 3HB ALA 66 7.541 13.804 3.304
479 H HIS 67 H HIS 67 10.587 11.668 0.834
480 HA HIS 67 HA HIS 67 12.989 13.299 1.363
481 1HB HIS 67 1HB HIS 67 14.191 11.788 -0.158
482 2HB HIS 67 2HB HIS 67 12.702 10.897 -0.453
483 HD2 HIS 67 2HD HIS 67 15.034 11.599 2.641
484 HE1 HIS 67 1HE HIS 67 13.015 7.903 3.063
485 HE2 HIS 67 2HE HIS 67 15.043 9.243 3.699
486 H LEU 68 H LEU 68 10.329 13.451 -0.303
487 HA LEU 68 HA LEU 68 11.337 15.511 -2.068
488 1HB LEU 68 1HB LEU 68 9.848 14.707 -3.928
489 2HB LEU 68 2HB LEU 68 9.622 13.217 -3.047
490 HG LEU 68 HG LEU 68 12.018 12.700 -3.299
491 1HD1 LEU 68 1HD1 LEU 68 10.583 13.342 -5.865
492 2HD1 LEU 68 2HD1 LEU 68 10.399 11.867 -4.907
493 3HD1 LEU 68 3HD1 LEU 68 11.941 12.230 -5.688
494 1HD2 LEU 68 1HD2 LEU 68 12.051 15.188 -5.005
495 2HD2 LEU 68 2HD2 LEU 68 13.369 14.022 -4.858
496 3HD2 LEU 68 3HD2 LEU 68 12.877 14.979 -3.460
497 H TRP 69 H TRP 69 8.438 13.643 -1.133
498 HA TRP 69 HA TRP 69 7.212 15.839 0.128
499 1HB TRP 69 1HB TRP 69 5.868 15.025 -2.483
500 2HB TRP 69 2HB TRP 69 7.033 16.342 -2.447
501 HD1 TRP 69 HD TRP 69 3.396 15.605 -1.699
502 HE1 TRP 69 1HE TRP 69 2.232 17.746 -0.928
503 HE3 TRP 69 3HE TRP 69 7.504 18.589 -1.103
504 HZ2 TRP 69 2HZ TRP 69 2.939 20.365 -0.174
505 HZ3 TRP 69 3HZ TRP 69 7.167 20.909 -0.356
506 HH2 TRP 69 HH TRP 69 4.932 21.778 0.096
507 H THR 70 H THR 70 4.591 14.597 -0.890
508 HA THR 70 HA THR 70 4.571 12.091 0.603
509 HB THR 70 HB THR 70 2.389 12.881 1.618
510 HG1 THR 70 1HG THR 70 3.364 15.308 0.582
511 1HG2 THR 70 1HG2 THR 70 4.450 12.865 2.961
512 2HG2 THR 70 2HG2 THR 70 3.439 14.248 3.386
513 3HG2 THR 70 3HG2 THR 70 4.856 14.472 2.359
514 H PHE 71 H PHE 71 2.403 10.958 0.163
515 HA PHE 71 HA PHE 71 1.656 11.402 -2.671
516 1HB PHE 71 1HB PHE 71 0.282 9.407 -2.415
517 2HB PHE 71 2HB PHE 71 0.729 9.225 -0.769
518 HD1 PHE 71 1HD PHE 71 3.296 8.728 -0.303
519 HD2 PHE 71 2HD PHE 71 1.303 8.208 -4.026
520 HE1 PHE 71 1HE PHE 71 4.957 7.025 -0.967
521 HE2 PHE 71 2HE PHE 71 2.912 6.540 -4.705
522 HZ PHE 71 HZ PHE 71 4.782 5.928 -3.166
523 H ASN 72 H ASN 72 -0.335 12.177 -3.131
524 HA ASN 72 HA ASN 72 -2.254 12.538 -0.927
525 1HB ASN 72 1HB ASN 72 -2.237 13.870 -3.672
526 2HB ASN 72 2HB ASN 72 -1.573 14.623 -2.227
527 1HD2 ASN 72 1HD2 ASN 72 -2.935 15.446 -0.680
528 2HD2 ASN 72 2HD2 ASN 72 -4.625 15.625 -0.926
529 H ASP 73 H ASP 73 -3.749 10.953 -0.952
530 HA ASP 73 HA ASP 73 -4.363 8.886 -1.526
531 1HB ASP 73 1HB ASP 73 -6.304 10.148 -2.342
532 2HB ASP 73 2HB ASP 73 -6.003 8.701 -3.259
533 H GLY 74 H GLY 74 -2.381 8.519 -1.311
534 1HA GLY 74 1HA GLY 74 -0.521 7.295 -1.906
535 2HA GLY 74 2HA GLY 74 -0.899 7.664 -3.586
536 H THR 75 H THR 75 -2.863 6.728 -4.213
537 HA THR 75 HA THR 75 -2.858 3.846 -3.803
538 HB THR 75 HB THR 75 -5.210 5.676 -4.128
539 HG1 THR 75 1HG THR 75 -3.858 4.729 -1.919
540 1HG2 THR 75 1HG2 THR 75 -5.597 3.443 -5.064
541 2HG2 THR 75 2HG2 THR 75 -6.566 3.653 -3.602
542 3HG2 THR 75 3HG2 THR 75 -5.086 2.699 -3.547
543 H GLY 76 H GLY 76 -3.971 6.746 -5.490
544 1HA GLY 76 1HA GLY 76 -4.746 6.326 -7.883
545 2HA GLY 76 2HA GLY 76 -3.298 5.358 -7.993
546 H HIS 77 H HIS 77 -2.552 7.976 -6.083
547 HA HIS 77 HA HIS 77 -1.185 9.218 -8.381
548 1HB HIS 77 1HB HIS 77 -1.716 11.473 -7.510
549 2HB HIS 77 2HB HIS 77 -2.760 10.740 -6.305
550 HD1 HIS 77 1HD HIS 77 -5.139 10.505 -6.870
551 HD2 HIS 77 2HD HIS 77 -2.732 10.969 -10.212
552 HE1 HIS 77 1HE HIS 77 -6.719 10.766 -8.791
553 HE2 HIS 77 2HE HIS 77 -5.217 10.578 -10.777
554 H GLY 78 H GLY 78 0.986 9.976 -7.838
555 1HA GLY 78 1HA GLY 78 2.560 9.454 -5.958
556 2HA GLY 78 2HA GLY 78 1.368 10.274 -4.979
557 H ILE 79 H ILE 79 2.142 12.190 -4.409
558 HA ILE 79 HA ILE 79 3.173 13.963 -6.475
559 HB ILE 79 HB ILE 79 2.917 14.500 -3.479
560 1HG1 ILE 79 1HG1 ILE 79 0.715 13.939 -4.476
561 2HG1 ILE 79 2HG1 ILE 79 0.955 15.192 -5.687
562 1HG2 ILE 79 1HG2 ILE 79 2.969 16.861 -4.158
563 2HG2 ILE 79 2HG2 ILE 79 3.156 16.381 -5.846
564 3HG2 ILE 79 3HG2 ILE 79 4.429 16.018 -4.677
565 1HD1 ILE 79 1HD1 ILE 79 0.962 16.894 -3.941
566 2HD1 ILE 79 2HD1 ILE 79 0.713 15.645 -2.720
567 3HD1 ILE 79 3HD1 ILE 79 -0.530 15.956 -3.930
568 H ASN 80 H ASN 80 4.110 11.924 -3.908
569 HA ASN 80 HA ASN 80 6.813 11.949 -4.902
570 1HB ASN 80 1HB ASN 80 5.982 11.935 -2.036
571 2HB ASN 80 2HB ASN 80 6.946 13.200 -2.801
572 1HD2 ASN 80 1HD2 ASN 80 7.489 11.531 -0.486
573 2HD2 ASN 80 2HD2 ASN 80 8.905 10.615 -0.737
574 HA PRO 81 HA PRO 81 7.923 10.668 -5.697
575 1HB PRO 81 1HB PRO 81 8.911 8.928 -6.783
576 2HB PRO 81 2HB PRO 81 7.415 8.575 -7.635
577 1HG PRO 81 1HG PRO 81 8.403 7.524 -5.022
578 2HG PRO 81 2HG PRO 81 7.445 6.703 -6.268
579 1HD PRO 81 1HD PRO 81 6.326 7.579 -4.000
580 2HD PRO 81 2HD PRO 81 5.461 7.678 -5.549
581 H ASP 82 H ASP 82 7.353 12.243 -7.092
582 HA ASP 82 HA ASP 82 4.726 12.517 -8.222
583 1HB ASP 82 1HB ASP 82 6.039 14.512 -7.623
584 2HB ASP 82 2HB ASP 82 5.648 14.548 -9.340
585 H ASP 83 H ASP 83 7.395 10.895 -9.095
586 HA ASP 83 HA ASP 83 7.283 10.952 -11.912
587 1HB ASP 83 1HB ASP 83 8.492 9.041 -9.985
588 2HB ASP 83 2HB ASP 83 9.318 10.418 -10.691
589 H CYS 84 H CYS 84 5.315 9.255 -9.490
590 HA CYS 84 HA CYS 84 4.066 7.780 -11.616
591 1HB CYS 84 1HB CYS 84 4.263 5.621 -10.487
592 2HB CYS 84 2HB CYS 84 5.364 6.326 -9.328
593 HG CYS 84 HG CYS 84 6.639 7.095 -12.076
594 H CYS 85 H CYS 85 2.191 6.820 -10.995
595 HA CYS 85 HA CYS 85 0.937 7.584 -8.505
596 1HB CYS 85 1HB CYS 85 -0.393 7.683 -10.558
597 2HB CYS 85 2HB CYS 85 -0.969 6.408 -9.515
598 HG CYS 85 HG CYS 85 -0.797 5.908 -12.469
599 H LEU 86 H LEU 86 -0.468 5.294 -8.060
600 HA LEU 86 HA LEU 86 1.676 3.304 -7.806
601 1HB LEU 86 1HB LEU 86 0.604 2.449 -5.807
602 2HB LEU 86 2HB LEU 86 -0.569 3.752 -5.844
603 HG LEU 86 HG LEU 86 1.236 5.373 -5.462
604 1HD1 LEU 86 1HD1 LEU 86 1.770 4.751 -3.172
605 2HD1 LEU 86 2HD1 LEU 86 1.256 3.098 -3.494
606 3HD1 LEU 86 3HD1 LEU 86 0.080 4.414 -3.545
607 1HD2 LEU 86 1HD2 LEU 86 3.481 4.562 -4.878
608 2HD2 LEU 86 2HD2 LEU 86 3.061 4.227 -6.550
609 3HD2 LEU 86 3HD2 LEU 86 3.002 2.933 -5.348
610 H ALA 87 H ALA 87 1.244 1.230 -8.312
611 HA ALA 87 HA ALA 87 -1.134 0.852 -9.853
612 1HB ALA 87 1HB ALA 87 0.973 -1.166 -9.071
613 2HB ALA 87 2HB ALA 87 0.985 -0.199 -10.544
614 3HB ALA 87 3HB ALA 87 -0.282 -1.396 -10.288
615 H GLU 88 H GLU 88 -2.678 1.229 -8.267
616 HA GLU 88 HA GLU 88 -2.932 -0.600 -6.103
617 1HB GLU 88 1HB GLU 88 -4.009 1.650 -6.053
618 2HB GLU 88 2HB GLU 88 -5.099 0.348 -5.630
619 1HG GLU 88 1HG GLU 88 -6.319 1.911 -6.932
620 2HG GLU 88 2HG GLU 88 -6.094 0.465 -7.895
621 H TYR 89 H TYR 89 -3.617 -2.601 -6.105
622 HA TYR 89 HA TYR 89 -5.293 -3.398 -8.287
623 1HB TYR 89 1HB TYR 89 -3.372 -4.314 -9.053
624 2HB TYR 89 2HB TYR 89 -4.062 -5.680 -8.203
625 HD1 TYR 89 1HD TYR 89 -3.199 -6.025 -5.738
626 HD2 TYR 89 2HD TYR 89 -1.191 -3.793 -8.731
627 HE1 TYR 89 1HE TYR 89 -1.045 -6.397 -4.594
628 HE2 TYR 89 2HE TYR 89 0.936 -4.150 -7.600
629 HH TYR 89 HH TYR 89 1.801 -4.722 -5.481
630 HA PRO 90 HA PRO 90 -8.358 -5.155 -5.919
631 1HB PRO 90 1HB PRO 90 -9.519 -6.646 -7.180
632 2HB PRO 90 2HB PRO 90 -8.184 -7.805 -7.212
633 1HG PRO 90 1HG PRO 90 -8.622 -5.365 -8.893
634 2HG PRO 90 2HG PRO 90 -8.102 -6.986 -9.398
635 1HD PRO 90 1HD PRO 90 -6.305 -5.052 -9.135
636 2HD PRO 90 2HD PRO 90 -5.963 -6.687 -8.544
637 H VAL 91 H VAL 91 -8.595 -5.835 -4.012
638 HA VAL 91 HA VAL 91 -6.952 -7.989 -2.909
639 HB VAL 91 HB VAL 91 -8.260 -5.617 -1.533
640 1HG1 VAL 91 1HG1 VAL 91 -7.018 -6.323 0.460
641 2HG1 VAL 91 2HG1 VAL 91 -6.480 -7.764 -0.407
642 3HG1 VAL 91 3HG1 VAL 91 -8.191 -7.524 -0.073
643 1HG2 VAL 91 1HG2 VAL 91 -6.355 -4.897 -2.848
644 2HG2 VAL 91 2HG2 VAL 91 -5.344 -6.133 -2.107
645 3HG2 VAL 91 3HG2 VAL 91 -5.974 -4.806 -1.130
646 H GLU 92 H GLU 92 -8.118 -9.563 -1.767
647 HA GLU 92 HA GLU 92 -11.028 -9.231 -1.693
648 1HB GLU 92 1HB GLU 92 -9.571 -11.774 -2.419
649 2HB GLU 92 2HB GLU 92 -10.434 -10.698 -3.534
650 1HG GLU 92 1HG GLU 92 -12.519 -11.185 -2.527
651 2HG GLU 92 2HG GLU 92 -11.745 -12.107 -1.244
652 H VAL 93 H VAL 93 -11.891 -9.761 0.111
653 HA VAL 93 HA VAL 93 -10.118 -10.672 2.243
654 HB VAL 93 HB VAL 93 -11.092 -8.508 2.732
655 1HG1 VAL 93 1HG1 VAL 93 -13.780 -9.823 2.484
656 2HG1 VAL 93 2HG1 VAL 93 -13.103 -8.594 1.409
657 3HG1 VAL 93 3HG1 VAL 93 -13.496 -8.189 3.079
658 1HG2 VAL 93 1HG2 VAL 93 -10.714 -9.952 4.649
659 2HG2 VAL 93 2HG2 VAL 93 -12.312 -10.661 4.459
660 3HG2 VAL 93 3HG2 VAL 93 -12.153 -8.965 4.919
661 H LYS 94 H LYS 94 -10.353 -12.529 3.295
662 HA LYS 94 HA LYS 94 -12.887 -13.935 2.928
663 1HB LYS 94 1HB LYS 94 -11.866 -15.997 2.588
664 2HB LYS 94 2HB LYS 94 -10.425 -15.551 3.458
665 1HG LYS 94 1HG LYS 94 -10.988 -14.395 0.752
666 2HG LYS 94 2HG LYS 94 -10.242 -15.984 0.934
667 1HD LYS 94 1HD LYS 94 -9.257 -13.488 2.238
668 2HD LYS 94 2HD LYS 94 -8.551 -13.948 0.754
669 1HE LYS 94 1HE LYS 94 -8.475 -15.267 3.488
670 2HE LYS 94 2HE LYS 94 -7.124 -14.784 2.480
671 1HZ LYS 94 1HZ LYS 94 -8.877 -17.116 1.914
672 2HZ LYS 94 2HZ LYS 94 -7.398 -17.179 2.635
673 3HZ LYS 94 3HZ LYS 94 -7.488 -16.709 1.045
674 H GLY 95 H GLY 95 -13.604 -13.175 4.921
675 1HA GLY 95 1HA GLY 95 -12.807 -14.565 7.234
676 2HA GLY 95 2HA GLY 95 -13.860 -13.160 7.212
677 H ASP 96 H ASP 96 -11.024 -14.348 8.231
678 HA ASP 96 HA ASP 96 -10.003 -11.719 9.135
679 1HB ASP 96 1HB ASP 96 -8.514 -13.039 10.552
680 2HB ASP 96 2HB ASP 96 -9.126 -14.511 9.876
681 H ASP 97 H ASP 97 -9.512 -13.778 6.555
682 HA ASP 97 HA ASP 97 -6.723 -12.984 6.485
683 1HB ASP 97 1HB ASP 97 -6.438 -14.947 4.908
684 2HB ASP 97 2HB ASP 97 -8.032 -15.469 5.453
685 H ILE 98 H ILE 98 -5.740 -12.655 4.323
686 HA ILE 98 HA ILE 98 -7.692 -11.351 2.552
687 HB ILE 98 HB ILE 98 -5.051 -10.329 3.558
688 1HG1 ILE 98 1HG1 ILE 98 -6.291 -8.428 4.298
689 2HG1 ILE 98 2HG1 ILE 98 -6.901 -9.885 5.076
690 1HG2 ILE 98 1HG2 ILE 98 -5.341 -8.354 2.150
691 2HG2 ILE 98 2HG2 ILE 98 -6.727 -9.129 1.379
692 3HG2 ILE 98 3HG2 ILE 98 -5.119 -9.837 1.218
693 1HD1 ILE 98 1HD1 ILE 98 -8.700 -8.388 4.471
694 2HD1 ILE 98 2HD1 ILE 98 -8.797 -9.885 3.550
695 3HD1 ILE 98 3HD1 ILE 98 -8.177 -8.414 2.785
696 H TYR 99 H TYR 99 -7.492 -11.740 0.458
697 HA TYR 99 HA TYR 99 -5.001 -12.842 -0.651
698 1HB TYR 99 1HB TYR 99 -6.469 -12.877 -2.748
699 2HB TYR 99 2HB TYR 99 -7.819 -12.747 -1.667
700 HD1 TYR 99 1HD TYR 99 -4.767 -14.884 -1.785
701 HD2 TYR 99 2HD TYR 99 -8.993 -14.688 -1.472
702 HE1 TYR 99 1HE TYR 99 -4.867 -17.332 -1.747
703 HE2 TYR 99 2HE TYR 99 -9.108 -17.132 -1.408
704 HH TYR 99 HH TYR 99 -6.369 -19.090 -0.973
705 H VAL 100 H VAL 100 -4.046 -11.693 -2.240
706 HA VAL 100 HA VAL 100 -5.309 -9.225 -3.180
707 HB VAL 100 HB VAL 100 -2.382 -9.463 -2.349
708 1HG1 VAL 100 1HG1 VAL 100 -2.634 -8.060 -4.299
709 2HG1 VAL 100 2HG1 VAL 100 -2.221 -7.084 -2.885
710 3HG1 VAL 100 3HG1 VAL 100 -3.879 -7.118 -3.481
711 1HG2 VAL 100 1HG2 VAL 100 -2.883 -7.739 -0.678
712 2HG2 VAL 100 2HG2 VAL 100 -3.829 -9.205 -0.410
713 3HG2 VAL 100 3HG2 VAL 100 -4.582 -7.793 -1.147
714 H SER 101 H SER 101 -4.624 -8.722 -5.349
715 HA SER 101 HA SER 101 -3.807 -11.144 -6.749
716 1HB SER 101 1HB SER 101 -4.408 -9.921 -8.748
717 2HB SER 101 2HB SER 101 -4.533 -8.418 -7.831
718 HG SER 101 HG SER 101 -6.145 -9.647 -6.560
719 H THR 102 H THR 102 -1.727 -11.488 -6.922
720 HA THR 102 HA THR 102 0.049 -9.167 -7.181
721 HB THR 102 HB THR 102 1.735 -10.481 -5.902
722 HG1 THR 102 1HG THR 102 1.218 -12.458 -5.153
723 1HG2 THR 102 1HG2 THR 102 0.322 -8.817 -4.735
724 2HG2 THR 102 2HG2 THR 102 0.688 -10.192 -3.691
725 3HG2 THR 102 3HG2 THR 102 -0.896 -10.063 -4.456
726 H LYS 103 H LYS 103 -0.508 -12.562 -7.950
727 HA LYS 103 HA LYS 103 1.502 -12.282 -10.055
728 1HB LYS 103 1HB LYS 103 0.317 -14.847 -8.963
729 2HB LYS 103 2HB LYS 103 1.824 -14.147 -8.404
730 1HG LYS 103 1HG LYS 103 1.449 -14.896 -11.289
731 2HG LYS 103 2HG LYS 103 1.920 -16.095 -10.098
732 1HD LYS 103 1HD LYS 103 3.894 -15.267 -11.244
733 2HD LYS 103 2HD LYS 103 3.952 -14.798 -9.555
734 1HE LYS 103 1HE LYS 103 3.328 -12.556 -10.076
735 2HE LYS 103 2HE LYS 103 3.126 -12.945 -11.789
736 1HZ LYS 103 1HZ LYS 103 5.537 -13.439 -11.866
737 2HZ LYS 103 2HZ LYS 103 5.714 -12.990 -10.261
738 3HZ LYS 103 3HZ LYS 103 5.227 -11.866 -11.387
739 H GLY 104 H GLY 104 0.364 -11.302 -11.525
740 1HA GLY 104 1HA GLY 104 -2.327 -12.127 -12.242
741 2HA GLY 104 2HA GLY 104 -1.083 -12.377 -13.478
742 H ILE 105 H ILE 105 -1.348 -9.959 -11.029
743 HA ILE 105 HA ILE 105 -1.758 -7.764 -12.874
744 HB ILE 105 HB ILE 105 -1.022 -7.813 -9.922
745 1HG1 ILE 105 1HG1 ILE 105 -3.314 -7.357 -9.380
746 2HG1 ILE 105 2HG1 ILE 105 -3.288 -8.769 -10.426
747 1HG2 ILE 105 1HG2 ILE 105 -1.951 -5.514 -11.636
748 2HG2 ILE 105 2HG2 ILE 105 -0.336 -5.743 -10.963
749 3HG2 ILE 105 3HG2 ILE 105 -1.709 -5.461 -9.891
750 1HD1 ILE 105 1HD1 ILE 105 -5.115 -7.321 -11.007
751 2HD1 ILE 105 2HD1 ILE 105 -3.943 -7.356 -12.336
752 3HD1 ILE 105 3HD1 ILE 105 -4.002 -5.980 -11.218
753 H LEU 106 H LEU 106 -0.005 -6.447 -13.518
754 HA LEU 106 HA LEU 106 2.604 -7.493 -12.777
755 1HB LEU 106 1HB LEU 106 1.839 -5.510 -14.928
756 2HB LEU 106 2HB LEU 106 2.195 -7.207 -15.169
757 HG LEU 106 HG LEU 106 4.169 -5.093 -14.286
758 1HD1 LEU 106 1HD1 LEU 106 4.580 -8.025 -14.852
759 2HD1 LEU 106 2HD1 LEU 106 4.702 -7.240 -13.276
760 3HD1 LEU 106 3HD1 LEU 106 5.857 -6.850 -14.546
761 1HD2 LEU 106 1HD2 LEU 106 5.193 -5.488 -16.468
762 2HD2 LEU 106 2HD2 LEU 106 3.536 -4.912 -16.635
763 3HD2 LEU 106 3HD2 LEU 106 3.905 -6.621 -16.870
764 HA PRO 107 HA PRO 107 2.632 -3.887 -9.869
765 1HB PRO 107 1HB PRO 107 3.039 -5.068 -7.975
766 2HB PRO 107 2HB PRO 107 4.665 -5.411 -8.550
767 1HG PRO 107 1HG PRO 107 2.212 -7.069 -8.748
768 2HG PRO 107 2HG PRO 107 3.913 -7.549 -8.574
769 1HD PRO 107 1HD PRO 107 2.638 -7.791 -10.879
770 2HD PRO 107 2HD PRO 107 4.353 -7.301 -10.822
771 H ASN 108 H ASN 108 3.890 -2.220 -10.109
772 HA ASN 108 HA ASN 108 6.308 -2.568 -11.538
773 1HB ASN 108 1HB ASN 108 5.353 -0.593 -12.254
774 2HB ASN 108 2HB ASN 108 6.506 -0.051 -11.030
775 1HD2 ASN 108 1HD2 ASN 108 3.157 -0.261 -11.761
776 2HD2 ASN 108 2HD2 ASN 108 2.645 0.753 -10.471
777 H LYS 109 H LYS 109 8.067 -3.028 -10.747
778 HA LYS 109 HA LYS 109 8.488 -3.184 -7.930
779 1HB LYS 109 1HB LYS 109 10.423 -3.620 -10.222
780 2HB LYS 109 2HB LYS 109 9.443 -4.851 -9.443
781 1HG LYS 109 1HG LYS 109 10.669 -4.465 -7.339
782 2HG LYS 109 2HG LYS 109 11.694 -3.305 -8.182
783 1HD LYS 109 1HD LYS 109 12.852 -5.426 -8.046
784 2HD LYS 109 2HD LYS 109 12.415 -5.103 -9.724
785 1HE LYS 109 1HE LYS 109 10.500 -6.593 -9.543
786 2HE LYS 109 2HE LYS 109 10.870 -6.876 -7.844
787 1HZ LYS 109 1HZ LYS 109 12.977 -7.897 -8.524
788 2HZ LYS 109 2HZ LYS 109 12.573 -7.684 -10.148
789 3HZ LYS 109 3HZ LYS 109 11.652 -8.688 -9.180
790 H ALA 110 H ALA 110 9.116 -1.014 -10.330
791 HA ALA 110 HA ALA 110 9.536 1.173 -8.619
792 1HB ALA 110 1HB ALA 110 11.822 0.229 -8.405
793 2HB ALA 110 2HB ALA 110 11.812 1.808 -9.183
794 3HB ALA 110 3HB ALA 110 12.019 0.352 -10.155
795 H HIS 111 H HIS 111 8.053 2.271 -9.775
796 HA HIS 111 HA HIS 111 7.388 3.784 -11.363
797 1HB HIS 111 1HB HIS 111 10.059 3.160 -12.659
798 2HB HIS 111 2HB HIS 111 9.610 4.612 -11.786
799 HD1 HIS 111 1HD HIS 111 10.049 3.414 -15.141
800 HD2 HIS 111 2HD HIS 111 7.593 6.224 -13.330
801 HE1 HIS 111 1HE HIS 111 9.262 4.897 -16.978
802 HE2 HIS 111 2HE HIS 111 8.110 6.765 -15.793
803 H SER 112 H SER 112 8.866 1.297 -13.312
804 HA SER 112 HA SER 112 6.262 0.398 -14.177
805 1HB SER 112 1HB SER 112 6.704 0.768 -16.573
806 2HB SER 112 2HB SER 112 8.225 1.568 -16.177
807 HG SER 112 HG SER 112 6.041 2.564 -14.858
Start of MODEL 18
1 1H MET 1 1HT MET 1 -0.260 -16.913 -9.126
2 2H MET 1 2HT MET 1 -0.249 -18.526 -8.666
3 3H MET 1 3HT MET 1 -1.227 -17.410 -7.833
4 HA MET 1 HA MET 1 -1.520 -18.131 -10.685
5 1HB MET 1 1HB MET 1 -3.192 -18.937 -8.290
6 2HB MET 1 2HB MET 1 -2.150 -19.999 -9.228
7 1HG MET 1 1HG MET 1 -3.569 -19.659 -11.193
8 2HG MET 1 2HG MET 1 -4.610 -18.593 -10.257
9 1HE MET 1 1HE MET 1 -2.892 -21.976 -9.073
10 2HE MET 1 2HE MET 1 -3.336 -22.273 -10.753
11 3HE MET 1 3HE MET 1 -4.168 -23.131 -9.460
12 H SER 2 H SER 2 -3.345 -16.814 -7.916
13 HA SER 2 HA SER 2 -3.898 -14.308 -8.887
14 1HB SER 2 1HB SER 2 -6.109 -16.341 -9.459
15 2HB SER 2 2HB SER 2 -5.181 -15.495 -10.693
16 HG SER 2 HG SER 2 -6.156 -13.621 -10.199
17 H PHE 3 H PHE 3 -4.797 -13.243 -7.141
18 HA PHE 3 HA PHE 3 -5.050 -12.927 -4.984
19 1HB PHE 3 1HB PHE 3 -7.064 -14.032 -3.939
20 2HB PHE 3 2HB PHE 3 -7.199 -15.021 -5.389
21 HD1 PHE 3 1HD PHE 3 -7.261 -11.533 -4.154
22 HD2 PHE 3 2HD PHE 3 -8.251 -14.193 -7.320
23 HE1 PHE 3 1HE PHE 3 -8.569 -9.752 -5.231
24 HE2 PHE 3 2HE PHE 3 -9.566 -12.413 -8.407
25 HZ PHE 3 HZ PHE 3 -9.723 -10.191 -7.362
26 H GLU 4 H GLU 4 -3.176 -13.411 -4.161
27 HA GLU 4 HA GLU 4 -2.660 -16.162 -3.308
28 1HB GLU 4 1HB GLU 4 -0.336 -15.458 -3.234
29 2HB GLU 4 2HB GLU 4 -0.789 -13.798 -3.563
30 1HG GLU 4 1HG GLU 4 0.162 -14.772 -5.536
31 2HG GLU 4 2HG GLU 4 -1.543 -14.446 -5.814
32 H LYS 5 H LYS 5 -2.225 -16.525 -1.180
33 HA LYS 5 HA LYS 5 -3.238 -14.735 0.818
34 1HB LYS 5 1HB LYS 5 -1.509 -17.172 0.999
35 2HB LYS 5 2HB LYS 5 -3.267 -17.151 1.149
36 1HG LYS 5 1HG LYS 5 -1.330 -15.823 3.023
37 2HG LYS 5 2HG LYS 5 -2.102 -17.367 3.325
38 1HD LYS 5 1HD LYS 5 -4.291 -16.294 3.345
39 2HD LYS 5 2HD LYS 5 -3.548 -14.740 2.954
40 1HE LYS 5 1HE LYS 5 -4.020 -14.886 5.330
41 2HE LYS 5 2HE LYS 5 -2.287 -14.815 5.044
42 1HZ LYS 5 1HZ LYS 5 -3.879 -17.215 5.703
43 2HZ LYS 5 2HZ LYS 5 -2.779 -16.433 6.710
44 3HZ LYS 5 3HZ LYS 5 -2.223 -17.261 5.336
45 H ILE 6 H ILE 6 -2.405 -13.053 1.406
46 HA ILE 6 HA ILE 6 0.490 -12.937 1.430
47 HB ILE 6 HB ILE 6 -0.507 -11.215 0.080
48 1HG1 ILE 6 1HG1 ILE 6 1.580 -10.680 1.295
49 2HG1 ILE 6 2HG1 ILE 6 0.630 -9.968 2.591
50 1HG2 ILE 6 1HG2 ILE 6 -1.982 -10.243 2.515
51 2HG2 ILE 6 2HG2 ILE 6 -2.684 -10.964 1.068
52 3HG2 ILE 6 3HG2 ILE 6 -1.894 -9.390 0.973
53 1HD1 ILE 6 1HD1 ILE 6 -0.206 -8.275 1.066
54 2HD1 ILE 6 2HD1 ILE 6 0.716 -8.997 -0.249
55 3HD1 ILE 6 3HD1 ILE 6 1.558 -8.271 1.120
56 H CYS 7 H CYS 7 -2.245 -11.924 3.358
57 HA CYS 7 HA CYS 7 -0.986 -12.782 5.808
58 1HB CYS 7 1HB CYS 7 -1.113 -10.548 6.935
59 2HB CYS 7 2HB CYS 7 -1.424 -9.821 5.367
60 HG CYS 7 HG CYS 7 1.177 -11.376 4.667
61 H SER 8 H SER 8 -2.444 -11.723 7.749
62 HA SER 8 HA SER 8 -5.127 -12.541 7.035
63 1HB SER 8 1HB SER 8 -4.245 -13.943 8.704
64 2HB SER 8 2HB SER 8 -5.312 -12.806 9.509
65 HG SER 8 HG SER 8 -3.324 -13.018 10.613
66 H LEU 9 H LEU 9 -6.898 -11.427 7.735
67 HA LEU 9 HA LEU 9 -6.732 -8.565 8.029
68 1HB LEU 9 1HB LEU 9 -9.041 -10.427 8.583
69 2HB LEU 9 2HB LEU 9 -8.614 -9.962 6.960
70 HG LEU 9 HG LEU 9 -9.222 -7.587 7.512
71 1HD1 LEU 9 1HD1 LEU 9 -11.359 -9.665 7.909
72 2HD1 LEU 9 2HD1 LEU 9 -10.740 -9.078 6.365
73 3HD1 LEU 9 3HD1 LEU 9 -11.607 -7.981 7.443
74 1HD2 LEU 9 1HD2 LEU 9 -10.629 -7.167 9.467
75 2HD2 LEU 9 2HD2 LEU 9 -9.015 -7.693 9.954
76 3HD2 LEU 9 3HD2 LEU 9 -10.369 -8.824 10.018
77 H ASP 10 H ASP 10 -6.818 -11.340 9.972
78 HA ASP 10 HA ASP 10 -7.541 -10.370 12.499
79 1HB ASP 10 1HB ASP 10 -5.658 -12.610 11.741
80 2HB ASP 10 2HB ASP 10 -7.397 -12.764 11.906
81 H ASP 11 H ASP 11 -4.606 -10.095 10.631
82 HA ASP 11 HA ASP 11 -3.097 -9.193 12.935
83 1HB ASP 11 1HB ASP 11 -2.198 -9.334 10.051
84 2HB ASP 11 2HB ASP 11 -1.957 -10.611 11.237
85 H ILE 12 H ILE 12 -4.236 -7.842 9.797
86 HA ILE 12 HA ILE 12 -3.677 -5.270 11.016
87 HB ILE 12 HB ILE 12 -3.901 -4.169 8.885
88 1HG1 ILE 12 1HG1 ILE 12 -5.441 -5.764 7.765
89 2HG1 ILE 12 2HG1 ILE 12 -4.112 -6.907 7.602
90 1HG2 ILE 12 1HG2 ILE 12 -1.839 -5.037 7.812
91 2HG2 ILE 12 2HG2 ILE 12 -1.932 -6.445 8.872
92 3HG2 ILE 12 3HG2 ILE 12 -1.702 -4.832 9.559
93 1HD1 ILE 12 1HD1 ILE 12 -4.488 -5.689 5.530
94 2HD1 ILE 12 2HD1 ILE 12 -2.903 -5.303 6.230
95 3HD1 ILE 12 3HD1 ILE 12 -4.237 -4.172 6.402
96 H TRP 13 H TRP 13 -5.073 -4.369 11.972
97 HA TRP 13 HA TRP 13 -7.844 -4.944 11.738
98 1HB TRP 13 1HB TRP 13 -7.872 -3.152 13.593
99 2HB TRP 13 2HB TRP 13 -6.141 -3.217 13.432
100 HD1 TRP 13 HD TRP 13 -5.129 -5.899 13.558
101 HE1 TRP 13 1HE TRP 13 -5.665 -7.648 15.376
102 HE3 TRP 13 3HE TRP 13 -9.490 -3.906 15.319
103 HZ2 TRP 13 2HZ TRP 13 -7.680 -8.099 17.321
104 HZ3 TRP 13 3HZ TRP 13 -10.656 -5.050 17.156
105 HH2 TRP 13 HH TRP 13 -9.767 -7.101 18.135
106 H VAL 14 H VAL 14 -9.391 -3.121 11.803
107 HA VAL 14 HA VAL 14 -9.324 -1.551 9.490
108 HB VAL 14 HB VAL 14 -10.970 -1.130 12.014
109 1HG1 VAL 14 1HG1 VAL 14 -12.464 0.234 10.619
110 2HG1 VAL 14 2HG1 VAL 14 -11.349 0.064 9.264
111 3HG1 VAL 14 3HG1 VAL 14 -10.849 0.940 10.712
112 1HG2 VAL 14 1HG2 VAL 14 -11.392 -3.279 10.913
113 2HG2 VAL 14 2HG2 VAL 14 -11.666 -2.445 9.386
114 3HG2 VAL 14 3HG2 VAL 14 -12.774 -2.198 10.733
115 H GLY 15 H GLY 15 -8.063 0.059 9.042
116 1HA GLY 15 1HA GLY 15 -7.496 2.066 11.101
117 2HA GLY 15 2HA GLY 15 -7.317 2.292 9.363
118 H GLU 16 H GLU 16 -6.103 -0.692 9.971
119 HA GLU 16 HA GLU 16 -3.452 0.333 10.557
120 1HB GLU 16 1HB GLU 16 -2.917 -2.176 10.987
121 2HB GLU 16 2HB GLU 16 -4.607 -2.429 10.725
122 1HG GLU 16 1HG GLU 16 -5.229 -1.272 12.630
123 2HG GLU 16 2HG GLU 16 -3.623 -0.548 12.752
124 H MET 17 H MET 17 -1.737 -0.120 9.269
125 HA MET 17 HA MET 17 -2.195 -1.462 6.749
126 1HB MET 17 1HB MET 17 -2.635 0.904 6.265
127 2HB MET 17 2HB MET 17 -1.197 0.336 5.457
128 1HG MET 17 1HG MET 17 -0.773 2.547 6.236
129 2HG MET 17 2HG MET 17 0.184 1.436 7.206
130 1HE MET 17 1HE MET 17 -0.290 4.453 8.048
131 2HE MET 17 2HE MET 17 0.662 3.294 8.965
132 3HE MET 17 3HE MET 17 -0.581 4.252 9.779
133 H GLU 18 H GLU 18 -0.339 -2.386 5.931
134 HA GLU 18 HA GLU 18 2.155 -1.791 7.219
135 1HB GLU 18 1HB GLU 18 0.845 -4.491 7.525
136 2HB GLU 18 2HB GLU 18 1.232 -3.344 8.807
137 1HG GLU 18 1HG GLU 18 3.231 -4.886 7.171
138 2HG GLU 18 2HG GLU 18 2.777 -5.216 8.837
139 H THR 19 H THR 19 3.927 -2.596 6.115
140 HA THR 19 HA THR 19 3.447 -3.250 3.342
141 HB THR 19 HB THR 19 5.915 -2.580 4.888
142 HG1 THR 19 1HG THR 19 4.039 -1.159 3.461
143 1HG2 THR 19 1HG2 THR 19 5.604 -3.014 1.911
144 2HG2 THR 19 2HG2 THR 19 6.524 -4.027 3.025
145 3HG2 THR 19 3HG2 THR 19 7.055 -2.380 2.687
146 H PHE 20 H PHE 20 3.522 -5.149 2.668
147 HA PHE 20 HA PHE 20 5.061 -7.219 4.053
148 1HB PHE 20 1HB PHE 20 3.255 -8.860 3.382
149 2HB PHE 20 2HB PHE 20 2.300 -7.484 2.867
150 HD1 PHE 20 1HD PHE 20 0.718 -6.640 4.288
151 HD2 PHE 20 2HD PHE 20 4.098 -8.661 5.912
152 HE1 PHE 20 1HE PHE 20 -0.237 -6.423 6.531
153 HE2 PHE 20 2HE PHE 20 3.140 -8.444 8.172
154 HZ PHE 20 HZ PHE 20 0.964 -7.324 8.477
155 H GLU 21 H GLU 21 5.554 -9.045 2.581
156 HA GLU 21 HA GLU 21 6.198 -7.948 -0.039
157 1HB GLU 21 1HB GLU 21 7.389 -10.276 1.480
158 2HB GLU 21 2HB GLU 21 8.059 -8.661 1.402
159 1HG GLU 21 1HG GLU 21 8.405 -8.901 -0.994
160 2HG GLU 21 2HG GLU 21 7.741 -10.533 -0.916
161 H THR 22 H THR 22 5.615 -9.018 -1.854
162 HA THR 22 HA THR 22 3.391 -10.845 -1.631
163 HB THR 22 HB THR 22 3.225 -10.628 -4.063
164 HG1 THR 22 1HG THR 22 4.789 -9.220 -5.098
165 1HG2 THR 22 1HG2 THR 22 2.920 -8.217 -4.247
166 2HG2 THR 22 2HG2 THR 22 3.909 -7.976 -2.817
167 3HG2 THR 22 3HG2 THR 22 2.333 -8.773 -2.671
168 H SER 23 H SER 23 3.407 -12.790 -3.129
169 HA SER 23 HA SER 23 5.476 -14.547 -2.546
170 1HB SER 23 1HB SER 23 4.326 -16.039 -4.071
171 2HB SER 23 2HB SER 23 3.453 -14.657 -4.737
172 HG SER 23 HG SER 23 2.602 -16.124 -2.827
173 H ASP 24 H ASP 24 5.349 -12.089 -4.877
174 HA ASP 24 HA ASP 24 7.255 -13.376 -6.703
175 1HB ASP 24 1HB ASP 24 5.994 -10.643 -6.889
176 2HB ASP 24 2HB ASP 24 5.290 -12.084 -7.600
177 H GLY 25 H GLY 25 7.227 -11.366 -3.982
178 1HA GLY 25 1HA GLY 25 10.057 -10.729 -4.403
179 2HA GLY 25 2HA GLY 25 9.233 -10.761 -2.854
180 H THR 26 H THR 26 6.998 -9.172 -4.296
181 HA THR 26 HA THR 26 8.298 -6.559 -4.541
182 HB THR 26 HB THR 26 5.388 -7.298 -4.934
183 HG1 THR 26 1HG THR 26 7.627 -7.692 -6.537
184 1HG2 THR 26 1HG2 THR 26 5.864 -4.891 -4.710
185 2HG2 THR 26 2HG2 THR 26 5.352 -5.287 -6.353
186 3HG2 THR 26 3HG2 THR 26 7.058 -5.007 -6.003
187 H GLU 27 H GLU 27 7.938 -4.911 -2.925
188 HA GLU 27 HA GLU 27 6.440 -5.848 -0.659
189 1HB GLU 27 1HB GLU 27 8.572 -4.819 -0.099
190 2HB GLU 27 2HB GLU 27 7.270 -3.820 0.508
191 1HG GLU 27 1HG GLU 27 8.895 -2.337 -0.341
192 2HG GLU 27 2HG GLU 27 7.576 -2.358 -1.518
193 H VAL 28 H VAL 28 4.579 -5.041 -0.024
194 HA VAL 28 HA VAL 28 3.341 -2.844 -1.564
195 HB VAL 28 HB VAL 28 2.090 -5.547 -0.917
196 1HG1 VAL 28 1HG1 VAL 28 0.847 -3.219 -2.343
197 2HG1 VAL 28 2HG1 VAL 28 0.426 -3.817 -0.742
198 3HG1 VAL 28 3HG1 VAL 28 0.129 -4.817 -2.164
199 1HG2 VAL 28 1HG2 VAL 28 2.796 -4.379 -3.597
200 2HG2 VAL 28 2HG2 VAL 28 1.915 -5.884 -3.340
201 3HG2 VAL 28 3HG2 VAL 28 3.589 -5.736 -2.801
202 H LEU 29 H LEU 29 1.924 -1.687 -0.417
203 HA LEU 29 HA LEU 29 2.028 -2.017 2.515
204 1HB LEU 29 1HB LEU 29 1.294 0.423 0.880
205 2HB LEU 29 2HB LEU 29 2.944 0.072 1.308
206 HG LEU 29 HG LEU 29 2.372 0.314 3.709
207 1HD1 LEU 29 1HD1 LEU 29 1.668 2.657 1.965
208 2HD1 LEU 29 2HD1 LEU 29 3.289 2.165 2.455
209 3HD1 LEU 29 3HD1 LEU 29 2.138 2.741 3.662
210 1HD2 LEU 29 1HD2 LEU 29 0.258 1.375 4.341
211 2HD2 LEU 29 2HD2 LEU 29 -0.023 -0.209 3.613
212 3HD2 LEU 29 3HD2 LEU 29 -0.306 1.258 2.674
213 H ILE 30 H ILE 30 0.242 -3.060 3.153
214 HA ILE 30 HA ILE 30 -2.210 -2.696 1.606
215 HB ILE 30 HB ILE 30 -1.587 -4.845 3.677
216 1HG1 ILE 30 1HG1 ILE 30 -1.731 -4.997 0.667
217 2HG1 ILE 30 2HG1 ILE 30 -1.762 -6.424 1.700
218 1HG2 ILE 30 1HG2 ILE 30 -3.950 -4.318 3.637
219 2HG2 ILE 30 2HG2 ILE 30 -3.673 -5.914 2.940
220 3HG2 ILE 30 3HG2 ILE 30 -3.995 -4.536 1.887
221 1HD1 ILE 30 1HD1 ILE 30 0.470 -5.905 2.509
222 2HD1 ILE 30 2HD1 ILE 30 0.506 -4.473 1.487
223 3HD1 ILE 30 3HD1 ILE 30 0.436 -6.075 0.756
224 H VAL 31 H VAL 31 -3.720 -1.491 2.380
225 HA VAL 31 HA VAL 31 -3.716 -0.859 5.251
226 HB VAL 31 HB VAL 31 -3.304 1.143 3.754
227 1HG1 VAL 31 1HG1 VAL 31 -4.420 0.463 1.791
228 2HG1 VAL 31 2HG1 VAL 31 -5.011 2.038 2.334
229 3HG1 VAL 31 3HG1 VAL 31 -5.984 0.590 2.598
230 1HG2 VAL 31 1HG2 VAL 31 -5.987 1.217 5.131
231 2HG2 VAL 31 2HG2 VAL 31 -5.014 2.622 4.697
232 3HG2 VAL 31 3HG2 VAL 31 -4.443 1.502 5.924
233 H ASN 32 H ASN 32 -5.454 -1.681 6.386
234 HA ASN 32 HA ASN 32 -7.766 -2.447 4.728
235 1HB ASN 32 1HB ASN 32 -7.020 -3.203 7.572
236 2HB ASN 32 2HB ASN 32 -6.873 -4.234 6.161
237 1HD2 ASN 32 1HD2 ASN 32 -8.305 -4.723 8.598
238 2HD2 ASN 32 2HD2 ASN 32 -9.952 -4.996 8.184
239 H SER 33 H SER 33 -8.876 -0.667 4.464
240 HA SER 33 HA SER 33 -9.631 0.911 6.781
241 1HB SER 33 1HB SER 33 -10.349 2.569 5.143
242 2HB SER 33 2HB SER 33 -9.932 1.461 3.836
243 HG SER 33 HG SER 33 -8.086 2.389 5.776
244 H GLU 34 H GLU 34 -11.740 0.992 7.437
245 HA GLU 34 HA GLU 34 -13.568 -0.900 6.305
246 1HB GLU 34 1HB GLU 34 -13.947 1.214 8.439
247 2HB GLU 34 2HB GLU 34 -13.626 -0.494 8.699
248 1HG GLU 34 1HG GLU 34 -15.786 -1.034 7.655
249 2HG GLU 34 2HG GLU 34 -16.115 0.693 7.521
250 H GLU 35 H GLU 35 -13.080 2.555 6.218
251 HA GLU 35 HA GLU 35 -15.488 2.963 4.624
252 1HB GLU 35 1HB GLU 35 -15.027 5.343 4.908
253 2HB GLU 35 2HB GLU 35 -13.473 4.967 5.643
254 1HG GLU 35 1HG GLU 35 -14.632 3.825 7.476
255 2HG GLU 35 2HG GLU 35 -16.179 4.247 6.749
256 H HIS 36 H HIS 36 -11.976 3.510 4.309
257 HA HIS 36 HA HIS 36 -12.200 4.319 1.541
258 1HB HIS 36 1HB HIS 36 -9.742 3.632 3.190
259 2HB HIS 36 2HB HIS 36 -10.461 5.221 3.078
260 HD1 HIS 36 1HD HIS 36 -9.880 6.684 1.100
261 HD2 HIS 36 2HD HIS 36 -8.164 2.903 0.891
262 HE1 HIS 36 1HE HIS 36 -8.134 6.838 -0.688
263 HE2 HIS 36 2HE HIS 36 -6.892 4.702 -0.542
264 H GLY 37 H GLY 37 -12.153 1.366 3.124
265 1HA GLY 37 1HA GLY 37 -11.897 -0.073 0.631
266 2HA GLY 37 2HA GLY 37 -12.399 -0.744 2.176
267 H VAL 38 H VAL 38 -10.960 -2.533 1.737
268 HA VAL 38 HA VAL 38 -8.335 -2.071 2.710
269 HB VAL 38 HB VAL 38 -9.488 -4.190 3.228
270 1HG1 VAL 38 1HG1 VAL 38 -9.759 -5.931 1.507
271 2HG1 VAL 38 2HG1 VAL 38 -9.362 -4.734 0.274
272 3HG1 VAL 38 3HG1 VAL 38 -10.806 -4.534 1.271
273 1HG2 VAL 38 1HG2 VAL 38 -7.026 -4.614 1.533
274 2HG2 VAL 38 2HG2 VAL 38 -7.683 -5.777 2.684
275 3HG2 VAL 38 3HG2 VAL 38 -7.061 -4.230 3.256
276 H LYS 39 H LYS 39 -6.619 -1.578 1.607
277 HA LYS 39 HA LYS 39 -6.693 -1.919 -1.292
278 1HB LYS 39 1HB LYS 39 -5.385 0.326 -1.358
279 2HB LYS 39 2HB LYS 39 -5.946 0.474 0.272
280 1HG LYS 39 1HG LYS 39 -7.407 1.695 -1.305
281 2HG LYS 39 2HG LYS 39 -8.246 0.453 -0.380
282 1HD LYS 39 1HD LYS 39 -8.180 -1.076 -2.255
283 2HD LYS 39 2HD LYS 39 -7.208 0.053 -3.195
284 1HE LYS 39 1HE LYS 39 -9.991 0.591 -2.209
285 2HE LYS 39 2HE LYS 39 -9.588 0.028 -3.830
286 1HZ LYS 39 1HZ LYS 39 -8.639 2.598 -2.660
287 2HZ LYS 39 2HZ LYS 39 -9.899 2.447 -3.737
288 3HZ LYS 39 3HZ LYS 39 -8.337 2.026 -4.210
289 H ALA 40 H ALA 40 -4.974 -2.499 -2.265
290 HA ALA 40 HA ALA 40 -2.515 -2.852 -0.716
291 1HB ALA 40 1HB ALA 40 -3.624 -5.019 -1.030
292 2HB ALA 40 2HB ALA 40 -2.119 -4.940 -1.946
293 3HB ALA 40 3HB ALA 40 -3.666 -4.745 -2.771
294 H TYR 41 H TYR 41 -1.106 -1.497 -1.519
295 HA TYR 41 HA TYR 41 -0.788 -1.303 -4.401
296 1HB TYR 41 1HB TYR 41 -2.051 0.662 -3.955
297 2HB TYR 41 2HB TYR 41 -0.374 1.188 -4.070
298 HD1 TYR 41 1HD TYR 41 0.813 2.026 -2.098
299 HD2 TYR 41 2HD TYR 41 -3.217 0.700 -1.830
300 HE1 TYR 41 1HE TYR 41 0.610 3.079 0.117
301 HE2 TYR 41 2HE TYR 41 -3.430 1.745 0.375
302 HH TYR 41 HH TYR 41 -2.028 2.431 2.186
303 H GLN 42 H GLN 42 1.320 -0.852 -5.071
304 HA GLN 42 HA GLN 42 3.361 -2.094 -3.614
305 1HB GLN 42 1HB GLN 42 3.671 -1.814 -5.985
306 2HB GLN 42 2HB GLN 42 4.961 -0.987 -5.145
307 1HG GLN 42 1HG GLN 42 3.921 1.135 -5.506
308 2HG GLN 42 2HG GLN 42 2.523 0.357 -6.245
309 1HE2 GLN 42 1HE2 GLN 42 5.836 -0.675 -6.785
310 2HE2 GLN 42 2HE2 GLN 42 5.895 -0.194 -8.442
311 H ALA 43 H ALA 43 4.956 -1.709 -2.425
312 HA ALA 43 HA ALA 43 4.308 0.431 -0.682
313 1HB ALA 43 1HB ALA 43 4.641 -1.786 0.231
314 2HB ALA 43 2HB ALA 43 5.691 -0.565 0.947
315 3HB ALA 43 3HB ALA 43 6.342 -1.708 -0.219
316 H MET 44 H MET 44 4.861 1.935 -1.510
317 HA MET 44 HA MET 44 6.031 4.015 -1.291
318 1HB MET 44 1HB MET 44 6.820 3.096 0.862
319 2HB MET 44 2HB MET 44 7.965 4.206 0.132
320 1HG MET 44 1HG MET 44 9.340 2.327 -0.621
321 2HG MET 44 2HG MET 44 8.188 1.195 0.065
322 1HE MET 44 1HE MET 44 11.254 0.994 0.622
323 2HE MET 44 2HE MET 44 10.043 -0.096 1.282
324 3HE MET 44 3HE MET 44 11.245 0.633 2.350
325 H CYS 45 H CYS 45 8.159 5.090 -1.598
326 HA CYS 45 HA CYS 45 9.356 4.435 -4.119
327 1HB CYS 45 1HB CYS 45 8.800 6.679 -4.027
328 2HB CYS 45 2HB CYS 45 10.453 6.745 -3.404
329 HA PRO 46 HA PRO 46 12.499 2.555 -1.481
330 1HB PRO 46 1HB PRO 46 12.039 0.794 -2.952
331 2HB PRO 46 2HB PRO 46 13.737 1.155 -3.309
332 1HG PRO 46 1HG PRO 46 12.038 1.156 -5.310
333 2HG PRO 46 2HG PRO 46 13.177 2.494 -5.129
334 1HD PRO 46 1HD PRO 46 10.252 2.415 -4.504
335 2HD PRO 46 2HD PRO 46 11.222 3.736 -5.192
336 H HIS 47 H HIS 47 12.978 5.373 -2.423
337 HA HIS 47 HA HIS 47 15.737 5.173 -3.364
338 1HB HIS 47 1HB HIS 47 15.828 7.593 -3.310
339 2HB HIS 47 2HB HIS 47 14.336 7.688 -2.406
340 HD2 HIS 47 2HD HIS 47 15.083 6.350 -6.072
341 HE1 HIS 47 1HE HIS 47 11.678 8.882 -5.980
342 HE2 HIS 47 2HE HIS 47 13.452 7.780 -7.435
343 H GLN 48 H GLN 48 13.926 6.699 -0.668
344 HA GLN 48 HA GLN 48 16.131 5.939 1.065
345 1HB GLN 48 1HB GLN 48 15.082 7.527 2.667
346 2HB GLN 48 2HB GLN 48 13.894 7.940 1.441
347 1HG GLN 48 1HG GLN 48 15.662 9.610 1.580
348 2HG GLN 48 2HG GLN 48 15.646 8.814 0.005
349 1HE2 GLN 48 1HE2 GLN 48 17.355 9.187 2.998
350 2HE2 GLN 48 2HE2 GLN 48 18.816 8.424 2.478
351 H GLU 49 H GLU 49 15.812 4.152 2.092
352 HA GLU 49 HA GLU 49 13.201 3.056 2.238
353 1HB GLU 49 1HB GLU 49 14.864 1.413 1.820
354 2HB GLU 49 2HB GLU 49 14.272 1.113 3.440
355 1HG GLU 49 1HG GLU 49 16.625 0.774 3.450
356 2HG GLU 49 2HG GLU 49 16.281 2.243 4.357
357 H ILE 50 H ILE 50 12.160 4.474 3.288
358 HA ILE 50 HA ILE 50 12.672 5.363 5.928
359 HB ILE 50 HB ILE 50 11.372 6.767 4.543
360 1HG1 ILE 50 1HG1 ILE 50 10.665 6.867 6.873
361 2HG1 ILE 50 2HG1 ILE 50 9.549 5.532 6.634
362 1HG2 ILE 50 1HG2 ILE 50 10.530 5.217 2.932
363 2HG2 ILE 50 2HG2 ILE 50 9.185 6.160 3.576
364 3HG2 ILE 50 3HG2 ILE 50 9.447 4.501 4.122
365 1HD1 ILE 50 1HD1 ILE 50 8.376 7.652 6.733
366 2HD1 ILE 50 2HD1 ILE 50 8.186 6.893 5.158
367 3HD1 ILE 50 3HD1 ILE 50 9.289 8.249 5.347
368 H LEU 51 H LEU 51 10.852 2.718 4.585
369 HA LEU 51 HA LEU 51 9.473 1.133 5.421
370 1HB LEU 51 1HB LEU 51 10.865 1.516 8.113
371 2HB LEU 51 2HB LEU 51 11.653 0.676 6.805
372 HG LEU 51 HG LEU 51 10.786 -0.918 8.414
373 1HD1 LEU 51 1HD1 LEU 51 8.062 0.211 7.863
374 2HD1 LEU 51 2HD1 LEU 51 8.965 0.317 9.377
375 3HD1 LEU 51 3HD1 LEU 51 8.410 -1.250 8.783
376 1HD2 LEU 51 1HD2 LEU 51 9.479 -2.339 6.923
377 2HD2 LEU 51 2HD2 LEU 51 10.843 -1.596 6.092
378 3HD2 LEU 51 3HD2 LEU 51 9.213 -0.970 5.846
379 H LEU 52 H LEU 52 8.042 2.699 5.008
380 HA LEU 52 HA LEU 52 7.224 4.719 6.830
381 1HB LEU 52 1HB LEU 52 7.350 5.033 4.396
382 2HB LEU 52 2HB LEU 52 5.829 5.508 5.107
383 HG LEU 52 HG LEU 52 4.718 3.560 4.198
384 1HD1 LEU 52 1HD1 LEU 52 4.787 5.522 2.857
385 2HD1 LEU 52 2HD1 LEU 52 4.845 4.079 1.846
386 3HD1 LEU 52 3HD1 LEU 52 6.315 5.018 2.129
387 1HD2 LEU 52 1HD2 LEU 52 5.826 2.035 2.611
388 2HD2 LEU 52 2HD2 LEU 52 6.512 1.911 4.226
389 3HD2 LEU 52 3HD2 LEU 52 7.379 2.796 2.971
390 H SER 53 H SER 53 6.241 1.501 6.459
391 HA SER 53 HA SER 53 3.514 1.677 6.129
392 1HB SER 53 1HB SER 53 4.794 -0.188 5.624
393 2HB SER 53 2HB SER 53 3.559 -0.682 6.734
394 HG SER 53 HG SER 53 5.334 -1.520 7.583
395 H GLU 54 H GLU 54 5.172 2.109 9.206
396 HA GLU 54 HA GLU 54 2.696 1.591 10.628
397 1HB GLU 54 1HB GLU 54 5.337 2.664 11.695
398 2HB GLU 54 2HB GLU 54 4.849 0.975 11.686
399 1HG GLU 54 1HG GLU 54 2.981 1.528 13.206
400 2HG GLU 54 2HG GLU 54 3.570 3.185 13.280
401 H GLY 55 H GLY 55 3.961 4.139 8.913
402 1HA GLY 55 1HA GLY 55 3.379 6.488 10.115
403 2HA GLY 55 2HA GLY 55 1.789 5.871 9.668
404 H SER 56 H SER 56 1.361 5.504 7.403
405 HA SER 56 HA SER 56 3.152 6.948 5.555
406 1HB SER 56 1HB SER 56 2.725 5.373 3.917
407 2HB SER 56 2HB SER 56 1.311 4.758 4.749
408 HG SER 56 HG SER 56 3.635 4.496 6.162
409 H TYR 57 H TYR 57 0.069 5.576 5.988
410 HA TYR 57 HA TYR 57 -1.192 7.366 4.083
411 1HB TYR 57 1HB TYR 57 -2.031 4.866 5.525
412 2HB TYR 57 2HB TYR 57 -1.574 5.022 3.844
413 HD1 TYR 57 1HD TYR 57 -3.122 5.903 2.180
414 HD2 TYR 57 2HD TYR 57 -4.245 5.465 6.255
415 HE1 TYR 57 1HE TYR 57 -5.493 6.107 1.556
416 HE2 TYR 57 2HE TYR 57 -6.600 5.674 5.641
417 HH TYR 57 HH TYR 57 -7.891 6.674 3.826
418 H GLU 58 H GLU 58 -1.802 9.234 4.908
419 HA GLU 58 HA GLU 58 -3.528 9.144 7.278
420 1HB GLU 58 1HB GLU 58 -2.129 11.620 6.229
421 2HB GLU 58 2HB GLU 58 -1.369 10.580 7.419
422 1HG GLU 58 1HG GLU 58 -2.374 12.529 8.479
423 2HG GLU 58 2HG GLU 58 -3.149 11.048 9.019
424 H GLY 59 H GLY 59 -5.541 8.960 6.381
425 1HA GLY 59 1HA GLY 59 -6.590 11.128 4.832
426 2HA GLY 59 2HA GLY 59 -7.460 9.683 5.317
427 H GLY 60 H GLY 60 -4.718 10.307 3.248
428 1HA GLY 60 1HA GLY 60 -5.888 9.859 0.759
429 2HA GLY 60 2HA GLY 60 -5.384 8.280 1.352
430 H VAL 61 H VAL 61 -3.419 10.789 2.507
431 HA VAL 61 HA VAL 61 -1.600 10.704 0.255
432 HB VAL 61 HB VAL 61 -1.461 12.270 2.853
433 1HG1 VAL 61 1HG1 VAL 61 0.211 13.646 1.721
434 2HG1 VAL 61 2HG1 VAL 61 0.141 12.575 0.318
435 3HG1 VAL 61 3HG1 VAL 61 0.741 11.969 1.863
436 1HG2 VAL 61 1HG2 VAL 61 -2.152 14.211 1.510
437 2HG2 VAL 61 2HG2 VAL 61 -3.383 12.949 1.526
438 3HG2 VAL 61 3HG2 VAL 61 -2.350 13.155 0.111
439 H ILE 62 H ILE 62 0.435 9.804 0.375
440 HA ILE 62 HA ILE 62 0.985 8.035 2.643
441 HB ILE 62 HB ILE 62 1.984 7.993 -0.208
442 1HG1 ILE 62 1HG1 ILE 62 0.623 5.948 -0.482
443 2HG1 ILE 62 2HG1 ILE 62 -0.357 7.364 -0.128
444 1HG2 ILE 62 1HG2 ILE 62 2.428 6.001 2.004
445 2HG2 ILE 62 2HG2 ILE 62 3.642 7.069 1.298
446 3HG2 ILE 62 3HG2 ILE 62 2.929 5.780 0.330
447 1HD1 ILE 62 1HD1 ILE 62 -1.147 5.413 1.070
448 2HD1 ILE 62 2HD1 ILE 62 -0.587 6.664 2.176
449 3HD1 ILE 62 3HD1 ILE 62 0.422 5.252 1.858
450 H THR 63 H THR 63 2.711 8.464 3.833
451 HA THR 63 HA THR 63 4.207 10.868 3.337
452 HB THR 63 HB THR 63 4.293 8.915 5.636
453 HG1 THR 63 1HG THR 63 2.647 9.952 6.404
454 1HG2 THR 63 1HG2 THR 63 6.287 10.372 5.538
455 2HG2 THR 63 2HG2 THR 63 5.246 10.823 6.891
456 3HG2 THR 63 3HG2 THR 63 5.242 11.789 5.418
457 H CYS 64 H CYS 64 6.147 10.935 2.345
458 HA CYS 64 HA CYS 64 7.971 8.650 2.567
459 1HB CYS 64 1HB CYS 64 7.879 10.935 0.547
460 2HB CYS 64 2HB CYS 64 7.820 9.202 0.219
461 H ARG 65 H ARG 65 10.234 9.155 3.098
462 HA ARG 65 HA ARG 65 10.357 11.198 5.164
463 1HB ARG 65 1HB ARG 65 12.256 8.979 4.419
464 2HB ARG 65 2HB ARG 65 11.116 8.958 5.755
465 1HG ARG 65 1HG ARG 65 12.341 10.803 6.815
466 2HG ARG 65 2HG ARG 65 13.509 10.764 5.491
467 1HD ARG 65 1HD ARG 65 14.361 9.522 7.405
468 2HD ARG 65 2HD ARG 65 14.051 8.443 6.042
469 HE ARG 65 HE ARG 65 11.789 8.580 7.685
470 1HH1 ARG 65 1HH1 ARG 65 15.053 7.200 7.672
471 2HH1 ARG 65 2HH1 ARG 65 14.656 5.923 8.732
472 1HH2 ARG 65 1HH2 ARG 65 11.250 6.783 9.139
473 2HH2 ARG 65 2HH2 ARG 65 12.467 5.681 9.562
474 H ALA 66 H ALA 66 11.047 13.129 4.621
475 HA ALA 66 HA ALA 66 12.379 14.806 4.003
476 1HB ALA 66 1HB ALA 66 14.204 13.390 4.833
477 2HB ALA 66 2HB ALA 66 14.709 14.465 3.525
478 3HB ALA 66 3HB ALA 66 14.416 12.754 3.201
479 H HIS 67 H HIS 67 12.160 12.341 1.507
480 HA HIS 67 HA HIS 67 12.782 14.197 -0.588
481 1HB HIS 67 1HB HIS 67 11.709 12.439 -2.130
482 2HB HIS 67 2HB HIS 67 11.584 11.439 -0.691
483 HD2 HIS 67 2HD HIS 67 14.831 13.017 -0.170
484 HE1 HIS 67 1HE HIS 67 15.729 9.807 -2.759
485 HE2 HIS 67 2HE HIS 67 16.645 11.744 -1.462
486 H LEU 68 H LEU 68 11.684 15.798 -1.183
487 HA LEU 68 HA LEU 68 10.098 17.278 -1.413
488 1HB LEU 68 1HB LEU 68 8.550 14.983 -2.662
489 2HB LEU 68 2HB LEU 68 9.893 15.763 -3.443
490 HG LEU 68 HG LEU 68 7.867 16.517 -4.469
491 1HD1 LEU 68 1HD1 LEU 68 6.161 17.814 -3.339
492 2HD1 LEU 68 2HD1 LEU 68 6.948 17.484 -1.790
493 3HD1 LEU 68 3HD1 LEU 68 6.257 16.163 -2.729
494 1HD2 LEU 68 1HD2 LEU 68 9.051 18.688 -2.766
495 2HD2 LEU 68 2HD2 LEU 68 8.094 18.924 -4.229
496 3HD2 LEU 68 3HD2 LEU 68 9.660 18.116 -4.319
497 H TRP 69 H TRP 69 7.488 14.941 -1.029
498 HA TRP 69 HA TRP 69 7.107 15.425 1.755
499 1HB TRP 69 1HB TRP 69 4.830 16.549 1.547
500 2HB TRP 69 2HB TRP 69 5.265 16.981 -0.089
501 HD1 TRP 69 HD TRP 69 6.913 17.533 3.376
502 HE1 TRP 69 1HE TRP 69 7.742 19.951 3.471
503 HE3 TRP 69 3HE TRP 69 5.486 19.055 -1.292
504 HZ2 TRP 69 2HZ TRP 69 7.770 22.231 1.795
505 HZ3 TRP 69 3HZ TRP 69 5.941 21.375 -1.962
506 HH2 TRP 69 HH TRP 69 7.057 22.929 -0.452
507 H THR 70 H THR 70 5.623 14.369 -1.299
508 HA THR 70 HA THR 70 3.655 12.811 0.261
509 HB THR 70 HB THR 70 1.980 13.677 -1.373
510 HG1 THR 70 1HG THR 70 4.043 14.615 -2.503
511 1HG2 THR 70 1HG2 THR 70 2.103 14.423 0.997
512 2HG2 THR 70 2HG2 THR 70 1.619 15.733 -0.077
513 3HG2 THR 70 3HG2 THR 70 3.273 15.657 0.528
514 H PHE 71 H PHE 71 3.320 10.860 -0.548
515 HA PHE 71 HA PHE 71 3.404 10.413 -3.445
516 1HB PHE 71 1HB PHE 71 3.629 8.419 -1.122
517 2HB PHE 71 2HB PHE 71 5.009 9.073 -1.965
518 HD1 PHE 71 1HD PHE 71 2.928 6.312 -1.770
519 HD2 PHE 71 2HD PHE 71 4.963 8.767 -4.582
520 HE1 PHE 71 1HE PHE 71 2.941 4.455 -3.383
521 HE2 PHE 71 2HE PHE 71 4.973 6.917 -6.202
522 HZ PHE 71 HZ PHE 71 3.971 4.762 -5.602
523 H ASN 72 H ASN 72 1.188 9.564 -4.200
524 HA ASN 72 HA ASN 72 -0.734 9.970 -1.997
525 1HB ASN 72 1HB ASN 72 -1.031 11.094 -4.776
526 2HB ASN 72 2HB ASN 72 -0.614 11.999 -3.327
527 1HD2 ASN 72 1HD2 ASN 72 -2.866 12.331 -5.142
528 2HD2 ASN 72 2HD2 ASN 72 -4.271 12.242 -4.159
529 H ASP 73 H ASP 73 -1.979 8.298 -1.602
530 HA ASP 73 HA ASP 73 -2.527 6.301 -3.609
531 1HB ASP 73 1HB ASP 73 -3.490 6.604 -0.748
532 2HB ASP 73 2HB ASP 73 -2.262 5.490 -1.343
533 H GLY 74 H GLY 74 -4.123 8.992 -2.128
534 1HA GLY 74 1HA GLY 74 -6.027 10.157 -2.713
535 2HA GLY 74 2HA GLY 74 -6.793 8.577 -2.642
536 H THR 75 H THR 75 -4.566 10.197 -4.888
537 HA THR 75 HA THR 75 -6.536 9.886 -6.981
538 HB THR 75 HB THR 75 -3.762 11.113 -7.109
539 HG1 THR 75 1HG THR 75 -6.264 12.031 -6.250
540 1HG2 THR 75 1HG2 THR 75 -4.685 10.511 -9.314
541 2HG2 THR 75 2HG2 THR 75 -4.637 12.260 -9.107
542 3HG2 THR 75 3HG2 THR 75 -6.164 11.395 -8.937
543 H GLY 76 H GLY 76 -3.383 8.545 -6.040
544 1HA GLY 76 1HA GLY 76 -3.622 6.578 -8.226
545 2HA GLY 76 2HA GLY 76 -2.937 6.248 -6.641
546 H HIS 77 H HIS 77 -2.423 9.137 -8.503
547 HA HIS 77 HA HIS 77 0.203 8.390 -9.374
548 1HB HIS 77 1HB HIS 77 -1.298 11.024 -9.462
549 2HB HIS 77 2HB HIS 77 -1.196 9.843 -10.761
550 HD1 HIS 77 1HD HIS 77 0.257 12.943 -9.796
551 HD2 HIS 77 2HD HIS 77 1.654 9.467 -11.557
552 HE1 HIS 77 1HE HIS 77 2.388 13.589 -10.947
553 HE2 HIS 77 2HE HIS 77 3.290 11.458 -11.892
554 H GLY 78 H GLY 78 2.134 8.984 -8.410
555 1HA GLY 78 1HA GLY 78 3.338 9.389 -6.459
556 2HA GLY 78 2HA GLY 78 1.900 10.134 -5.758
557 H ILE 79 H ILE 79 2.822 12.078 -5.140
558 HA ILE 79 HA ILE 79 3.364 13.934 -7.258
559 HB ILE 79 HB ILE 79 3.613 14.271 -4.238
560 1HG1 ILE 79 1HG1 ILE 79 1.512 15.306 -6.166
561 2HG1 ILE 79 2HG1 ILE 79 1.648 15.848 -4.504
562 1HG2 ILE 79 1HG2 ILE 79 3.933 16.380 -6.363
563 2HG2 ILE 79 2HG2 ILE 79 5.190 15.757 -5.296
564 3HG2 ILE 79 3HG2 ILE 79 3.850 16.690 -4.628
565 1HD1 ILE 79 1HD1 ILE 79 1.023 13.046 -5.370
566 2HD1 ILE 79 2HD1 ILE 79 -0.118 14.231 -4.733
567 3HD1 ILE 79 3HD1 ILE 79 1.171 13.606 -3.704
568 H ASN 80 H ASN 80 5.185 12.293 -4.705
569 HA ASN 80 HA ASN 80 7.396 12.410 -6.506
570 1HB ASN 80 1HB ASN 80 7.902 14.088 -4.782
571 2HB ASN 80 2HB ASN 80 8.985 12.723 -4.623
572 1HD2 ASN 80 1HD2 ASN 80 9.012 11.404 -2.797
573 2HD2 ASN 80 2HD2 ASN 80 8.151 11.916 -1.410
574 HA PRO 81 HA PRO 81 8.707 11.358 -7.368
575 1HB PRO 81 1HB PRO 81 10.049 9.707 -8.114
576 2HB PRO 81 2HB PRO 81 8.669 8.977 -8.935
577 1HG PRO 81 1HG PRO 81 9.911 8.227 -6.360
578 2HG PRO 81 2HG PRO 81 8.881 7.275 -7.431
579 1HD PRO 81 1HD PRO 81 8.016 8.221 -5.051
580 2HD PRO 81 2HD PRO 81 6.943 8.007 -6.449
581 H ASP 82 H ASP 82 7.694 12.430 -8.929
582 HA ASP 82 HA ASP 82 4.919 11.925 -9.518
583 1HB ASP 82 1HB ASP 82 5.793 14.251 -9.446
584 2HB ASP 82 2HB ASP 82 4.948 13.898 -10.944
585 H ASP 83 H ASP 83 7.730 10.780 -10.794
586 HA ASP 83 HA ASP 83 7.022 10.494 -13.523
587 1HB ASP 83 1HB ASP 83 8.906 8.900 -13.604
588 2HB ASP 83 2HB ASP 83 8.970 8.998 -11.848
589 H CYS 84 H CYS 84 6.016 8.843 -10.686
590 HA CYS 84 HA CYS 84 4.876 6.754 -12.337
591 1HB CYS 84 1HB CYS 84 6.907 5.790 -11.479
592 2HB CYS 84 2HB CYS 84 5.531 5.068 -10.652
593 HG CYS 84 HG CYS 84 6.361 7.561 -8.780
594 H CYS 85 H CYS 85 3.519 5.360 -10.789
595 HA CYS 85 HA CYS 85 1.953 6.966 -8.911
596 1HB CYS 85 1HB CYS 85 -0.072 5.983 -9.880
597 2HB CYS 85 2HB CYS 85 0.889 5.077 -11.036
598 HG CYS 85 HG CYS 85 -0.066 6.942 -12.672
599 H LEU 86 H LEU 86 0.475 5.214 -7.723
600 HA LEU 86 HA LEU 86 2.201 2.926 -7.413
601 1HB LEU 86 1HB LEU 86 2.156 3.778 -5.240
602 2HB LEU 86 2HB LEU 86 1.078 2.424 -5.184
603 HG LEU 86 HG LEU 86 0.259 4.164 -3.769
604 1HD1 LEU 86 1HD1 LEU 86 1.239 6.086 -4.761
605 2HD1 LEU 86 2HD1 LEU 86 -0.494 6.313 -4.555
606 3HD1 LEU 86 3HD1 LEU 86 0.162 5.963 -6.152
607 1HD2 LEU 86 1HD2 LEU 86 -1.445 2.812 -4.854
608 2HD2 LEU 86 2HD2 LEU 86 -1.495 3.941 -6.208
609 3HD2 LEU 86 3HD2 LEU 86 -2.005 4.461 -4.601
610 H ALA 87 H ALA 87 1.737 1.000 -7.843
611 HA ALA 87 HA ALA 87 -0.604 0.539 -9.379
612 1HB ALA 87 1HB ALA 87 0.255 -1.730 -9.647
613 2HB ALA 87 2HB ALA 87 1.469 -1.423 -8.403
614 3HB ALA 87 3HB ALA 87 1.519 -0.535 -9.926
615 H GLU 88 H GLU 88 -2.473 0.240 -8.553
616 HA GLU 88 HA GLU 88 -2.872 -0.832 -5.890
617 1HB GLU 88 1HB GLU 88 -4.812 0.150 -8.001
618 2HB GLU 88 2HB GLU 88 -4.161 1.121 -6.697
619 1HG GLU 88 1HG GLU 88 -5.304 -0.280 -5.061
620 2HG GLU 88 2HG GLU 88 -5.974 -1.249 -6.372
621 H TYR 89 H TYR 89 -3.052 -2.946 -5.627
622 HA TYR 89 HA TYR 89 -3.436 -4.638 -7.977
623 1HB TYR 89 1HB TYR 89 -2.552 -6.441 -6.599
624 2HB TYR 89 2HB TYR 89 -2.598 -5.414 -5.173
625 HD1 TYR 89 1HD TYR 89 -0.778 -4.095 -4.594
626 HD2 TYR 89 2HD TYR 89 -0.971 -5.739 -8.510
627 HE1 TYR 89 1HE TYR 89 1.508 -3.332 -5.015
628 HE2 TYR 89 2HE TYR 89 1.332 -4.976 -8.943
629 HH TYR 89 HH TYR 89 3.393 -3.938 -6.486
630 HA PRO 90 HA PRO 90 -7.547 -5.806 -6.601
631 1HB PRO 90 1HB PRO 90 -8.215 -7.319 -8.196
632 2HB PRO 90 2HB PRO 90 -7.095 -8.537 -7.584
633 1HG PRO 90 1HG PRO 90 -6.641 -6.394 -9.615
634 2HG PRO 90 2HG PRO 90 -6.035 -8.061 -9.590
635 1HD PRO 90 1HD PRO 90 -4.440 -6.040 -8.948
636 2HD PRO 90 2HD PRO 90 -4.376 -7.558 -8.037
637 H VAL 91 H VAL 91 -7.983 -6.207 -4.555
638 HA VAL 91 HA VAL 91 -6.626 -8.463 -3.300
639 HB VAL 91 HB VAL 91 -5.679 -6.380 -2.473
640 1HG1 VAL 91 1HG1 VAL 91 -6.993 -4.774 -1.168
641 2HG1 VAL 91 2HG1 VAL 91 -8.459 -5.661 -1.593
642 3HG1 VAL 91 3HG1 VAL 91 -7.512 -4.870 -2.853
643 1HG2 VAL 91 1HG2 VAL 91 -7.407 -7.711 -0.393
644 2HG2 VAL 91 2HG2 VAL 91 -6.005 -6.696 -0.055
645 3HG2 VAL 91 3HG2 VAL 91 -5.803 -8.230 -0.904
646 H GLU 92 H GLU 92 -7.790 -9.793 -2.080
647 HA GLU 92 HA GLU 92 -10.647 -9.223 -1.952
648 1HB GLU 92 1HB GLU 92 -9.339 -11.948 -2.134
649 2HB GLU 92 2HB GLU 92 -10.098 -11.053 -3.462
650 1HG GLU 92 1HG GLU 92 -11.510 -11.981 -0.989
651 2HG GLU 92 2HG GLU 92 -11.589 -12.755 -2.576
652 H VAL 93 H VAL 93 -11.554 -9.379 -0.099
653 HA VAL 93 HA VAL 93 -9.759 -9.891 2.140
654 HB VAL 93 HB VAL 93 -10.440 -7.578 2.030
655 1HG1 VAL 93 1HG1 VAL 93 -12.751 -6.850 2.434
656 2HG1 VAL 93 2HG1 VAL 93 -13.270 -8.533 2.348
657 3HG1 VAL 93 3HG1 VAL 93 -12.579 -7.754 0.927
658 1HG2 VAL 93 1HG2 VAL 93 -11.681 -9.009 4.363
659 2HG2 VAL 93 2HG2 VAL 93 -11.289 -7.289 4.323
660 3HG2 VAL 93 3HG2 VAL 93 -10.002 -8.491 4.220
661 H LYS 94 H LYS 94 -10.099 -11.575 3.358
662 HA LYS 94 HA LYS 94 -12.772 -12.434 3.691
663 1HB LYS 94 1HB LYS 94 -10.367 -14.040 2.847
664 2HB LYS 94 2HB LYS 94 -11.988 -14.079 2.189
665 1HG LYS 94 1HG LYS 94 -11.997 -16.053 3.256
666 2HG LYS 94 2HG LYS 94 -12.545 -15.020 4.588
667 1HD LYS 94 1HD LYS 94 -10.056 -14.734 5.102
668 2HD LYS 94 2HD LYS 94 -9.851 -16.082 3.993
669 1HE LYS 94 1HE LYS 94 -11.464 -16.148 6.512
670 2HE LYS 94 2HE LYS 94 -9.874 -16.851 6.272
671 1HZ LYS 94 1HZ LYS 94 -10.784 -18.336 4.612
672 2HZ LYS 94 2HZ LYS 94 -12.318 -17.679 4.782
673 3HZ LYS 94 3HZ LYS 94 -11.602 -18.526 6.073
674 H GLY 95 H GLY 95 -13.217 -13.296 5.711
675 1HA GLY 95 1HA GLY 95 -13.099 -13.376 8.007
676 2HA GLY 95 2HA GLY 95 -12.673 -11.688 7.743
677 H ASP 96 H ASP 96 -10.870 -14.535 7.448
678 HA ASP 96 HA ASP 96 -9.019 -13.296 9.409
679 1HB ASP 96 1HB ASP 96 -8.188 -15.464 10.024
680 2HB ASP 96 2HB ASP 96 -9.301 -16.242 8.931
681 H ASP 97 H ASP 97 -9.097 -13.802 6.159
682 HA ASP 97 HA ASP 97 -6.218 -13.991 6.004
683 1HB ASP 97 1HB ASP 97 -6.384 -15.655 4.249
684 2HB ASP 97 2HB ASP 97 -8.072 -15.910 4.604
685 H ILE 98 H ILE 98 -5.490 -12.803 4.375
686 HA ILE 98 HA ILE 98 -7.518 -11.766 2.577
687 HB ILE 98 HB ILE 98 -5.166 -10.397 3.835
688 1HG1 ILE 98 1HG1 ILE 98 -7.006 -10.515 5.284
689 2HG1 ILE 98 2HG1 ILE 98 -8.170 -10.071 4.086
690 1HG2 ILE 98 1HG2 ILE 98 -5.280 -9.710 1.514
691 2HG2 ILE 98 2HG2 ILE 98 -5.796 -8.376 2.550
692 3HG2 ILE 98 3HG2 ILE 98 -6.998 -9.329 1.670
693 1HD1 ILE 98 1HD1 ILE 98 -7.125 -7.785 4.034
694 2HD1 ILE 98 2HD1 ILE 98 -6.029 -8.311 5.318
695 3HD1 ILE 98 3HD1 ILE 98 -7.770 -8.237 5.613
696 H TYR 99 H TYR 99 -7.195 -11.929 0.537
697 HA TYR 99 HA TYR 99 -4.623 -13.030 -0.425
698 1HB TYR 99 1HB TYR 99 -5.870 -14.127 -2.180
699 2HB TYR 99 2HB TYR 99 -7.353 -13.336 -1.675
700 HD1 TYR 99 1HD TYR 99 -8.652 -14.206 0.163
701 HD2 TYR 99 2HD TYR 99 -4.875 -15.923 -0.783
702 HE1 TYR 99 1HE TYR 99 -9.144 -16.096 1.653
703 HE2 TYR 99 2HE TYR 99 -5.364 -17.819 0.703
704 HH TYR 99 HH TYR 99 -8.456 -18.427 1.927
705 H VAL 100 H VAL 100 -3.678 -12.074 -2.206
706 HA VAL 100 HA VAL 100 -5.112 -9.897 -3.543
707 HB VAL 100 HB VAL 100 -3.867 -8.843 -1.769
708 1HG1 VAL 100 1HG1 VAL 100 -1.386 -10.010 -3.033
709 2HG1 VAL 100 2HG1 VAL 100 -2.053 -10.424 -1.457
710 3HG1 VAL 100 3HG1 VAL 100 -1.382 -8.816 -1.735
711 1HG2 VAL 100 1HG2 VAL 100 -4.146 -7.549 -3.786
712 2HG2 VAL 100 2HG2 VAL 100 -2.677 -8.239 -4.471
713 3HG2 VAL 100 3HG2 VAL 100 -2.579 -7.174 -3.067
714 H SER 101 H SER 101 -4.430 -9.431 -5.560
715 HA SER 101 HA SER 101 -2.752 -11.503 -6.819
716 1HB SER 101 1HB SER 101 -3.834 -10.867 -8.934
717 2HB SER 101 2HB SER 101 -4.768 -9.638 -8.085
718 HG SER 101 HG SER 101 -5.908 -11.545 -8.410
719 H THR 102 H THR 102 -0.710 -10.850 -7.086
720 HA THR 102 HA THR 102 -0.187 -8.106 -7.996
721 HB THR 102 HB THR 102 1.777 -10.310 -7.225
722 HG1 THR 102 1HG THR 102 0.154 -8.778 -5.725
723 1HG2 THR 102 1HG2 THR 102 3.374 -8.445 -6.954
724 2HG2 THR 102 2HG2 THR 102 2.121 -7.301 -7.437
725 3HG2 THR 102 3HG2 THR 102 2.733 -8.477 -8.599
726 H LYS 103 H LYS 103 -0.535 -11.333 -8.921
727 HA LYS 103 HA LYS 103 0.850 -11.195 -11.432
728 1HB LYS 103 1HB LYS 103 -1.129 -13.173 -10.273
729 2HB LYS 103 2HB LYS 103 0.613 -13.313 -10.188
730 1HG LYS 103 1HG LYS 103 -0.827 -13.337 -12.811
731 2HG LYS 103 2HG LYS 103 -0.609 -14.793 -11.867
732 1HD LYS 103 1HD LYS 103 1.113 -14.758 -13.521
733 2HD LYS 103 2HD LYS 103 1.857 -14.463 -11.964
734 1HE LYS 103 1HE LYS 103 2.123 -12.157 -12.401
735 2HE LYS 103 2HE LYS 103 1.201 -12.258 -13.906
736 1HZ LYS 103 1HZ LYS 103 2.933 -13.680 -14.807
737 2HZ LYS 103 2HZ LYS 103 3.798 -13.618 -13.370
738 3HZ LYS 103 3HZ LYS 103 3.603 -12.230 -14.281
739 H GLY 104 H GLY 104 0.000 -9.818 -12.892
740 1HA GLY 104 1HA GLY 104 -2.927 -9.680 -13.127
741 2HA GLY 104 2HA GLY 104 -1.927 -9.980 -14.548
742 H ILE 105 H ILE 105 -1.047 -7.902 -11.897
743 HA ILE 105 HA ILE 105 -1.243 -5.647 -13.741
744 HB ILE 105 HB ILE 105 -1.706 -5.618 -10.743
745 1HG1 ILE 105 1HG1 ILE 105 -3.663 -6.328 -11.963
746 2HG1 ILE 105 2HG1 ILE 105 -3.500 -5.007 -13.107
747 1HG2 ILE 105 1HG2 ILE 105 -1.561 -3.249 -12.633
748 2HG2 ILE 105 2HG2 ILE 105 -0.396 -3.639 -11.371
749 3HG2 ILE 105 3HG2 ILE 105 -2.041 -3.173 -10.937
750 1HD1 ILE 105 1HD1 ILE 105 -4.145 -4.666 -10.190
751 2HD1 ILE 105 2HD1 ILE 105 -5.311 -4.641 -11.508
752 3HD1 ILE 105 3HD1 ILE 105 -4.063 -3.400 -11.411
753 H LEU 106 H LEU 106 0.587 -4.595 -14.148
754 HA LEU 106 HA LEU 106 2.950 -5.543 -12.920
755 1HB LEU 106 1HB LEU 106 3.975 -3.978 -14.585
756 2HB LEU 106 2HB LEU 106 2.371 -3.624 -15.153
757 HG LEU 106 HG LEU 106 3.567 -6.393 -15.268
758 1HD1 LEU 106 1HD1 LEU 106 1.157 -5.245 -16.653
759 2HD1 LEU 106 2HD1 LEU 106 1.145 -6.395 -15.316
760 3HD1 LEU 106 3HD1 LEU 106 1.807 -6.870 -16.879
761 1HD2 LEU 106 1HD2 LEU 106 4.905 -4.905 -16.634
762 2HD2 LEU 106 2HD2 LEU 106 3.452 -4.300 -17.432
763 3HD2 LEU 106 3HD2 LEU 106 3.945 -5.978 -17.653
764 HA PRO 107 HA PRO 107 3.060 -2.117 -9.971
765 1HB PRO 107 1HB PRO 107 4.847 -2.681 -8.625
766 2HB PRO 107 2HB PRO 107 5.956 -2.767 -9.996
767 1HG PRO 107 1HG PRO 107 4.077 -4.838 -8.946
768 2HG PRO 107 2HG PRO 107 5.738 -5.021 -9.530
769 1HD PRO 107 1HD PRO 107 3.611 -5.670 -11.035
770 2HD PRO 107 2HD PRO 107 5.095 -4.997 -11.746
771 H ASN 108 H ASN 108 3.786 0.095 -10.134
772 HA ASN 108 HA ASN 108 4.829 0.822 -12.680
773 1HB ASN 108 1HB ASN 108 4.685 3.120 -11.738
774 2HB ASN 108 2HB ASN 108 4.111 2.441 -10.229
775 1HD2 ASN 108 1HD2 ASN 108 2.032 1.767 -10.047
776 2HD2 ASN 108 2HD2 ASN 108 0.828 2.055 -11.260
777 H LYS 109 H LYS 109 6.665 2.456 -12.628
778 HA LYS 109 HA LYS 109 8.745 1.040 -11.347
779 1HB LYS 109 1HB LYS 109 10.274 2.556 -12.588
780 2HB LYS 109 2HB LYS 109 8.782 3.310 -13.161
781 1HG LYS 109 1HG LYS 109 8.104 1.269 -14.256
782 2HG LYS 109 2HG LYS 109 9.419 0.375 -13.507
783 1HD LYS 109 1HD LYS 109 11.040 1.690 -14.799
784 2HD LYS 109 2HD LYS 109 9.699 2.520 -15.600
785 1HE LYS 109 1HE LYS 109 10.571 0.670 -16.969
786 2HE LYS 109 2HE LYS 109 8.901 0.392 -16.492
787 1HZ LYS 109 1HZ LYS 109 11.283 -0.834 -15.180
788 2HZ LYS 109 2HZ LYS 109 10.203 -1.632 -16.197
789 3HZ LYS 109 3HZ LYS 109 9.691 -1.069 -14.726
790 H ALA 110 H ALA 110 8.017 1.511 -9.516
791 HA ALA 110 HA ALA 110 9.396 3.764 -8.188
792 1HB ALA 110 1HB ALA 110 7.239 1.910 -7.104
793 2HB ALA 110 2HB ALA 110 7.023 3.614 -7.503
794 3HB ALA 110 3HB ALA 110 8.062 3.149 -6.158
795 H HIS 111 H HIS 111 8.471 0.497 -7.461
796 HA HIS 111 HA HIS 111 11.258 -0.317 -7.557
797 1HB HIS 111 1HB HIS 111 9.399 -1.274 -5.381
798 2HB HIS 111 2HB HIS 111 10.548 0.008 -5.078
799 HD1 HIS 111 1HD HIS 111 10.255 -3.296 -4.244
800 HD2 HIS 111 2HD HIS 111 13.265 -1.234 -6.209
801 HE1 HIS 111 1HE HIS 111 12.302 -4.709 -4.001
802 HE2 HIS 111 2HE HIS 111 13.969 -3.629 -5.490
803 H SER 112 H SER 112 11.393 -1.966 -8.907
804 HA SER 112 HA SER 112 9.342 -3.933 -9.036
805 1HB SER 112 1HB SER 112 10.062 -2.281 -11.491
806 2HB SER 112 2HB SER 112 8.554 -2.111 -10.599
807 HG SER 112 HG SER 112 8.478 -4.531 -11.023
Start of MODEL 19
1 1H MET 1 1HT MET 1 2.837 -15.430 -7.225
2 2H MET 1 2HT MET 1 1.649 -16.505 -6.701
3 3H MET 1 3HT MET 1 1.562 -14.902 -6.248
4 HA MET 1 HA MET 1 1.309 -14.294 -8.625
5 1HB MET 1 1HB MET 1 0.615 -16.145 -10.157
6 2HB MET 1 2HB MET 1 1.144 -17.298 -8.949
7 1HG MET 1 1HG MET 1 3.444 -16.438 -9.152
8 2HG MET 1 2HG MET 1 2.888 -15.338 -10.402
9 1HE MET 1 1HE MET 1 0.737 -17.182 -11.951
10 2HE MET 1 2HE MET 1 1.757 -17.831 -13.232
11 3HE MET 1 3HE MET 1 1.904 -16.139 -12.760
12 H SER 2 H SER 2 -0.777 -14.119 -9.552
13 HA SER 2 HA SER 2 -3.046 -13.907 -9.510
14 1HB SER 2 1HB SER 2 -4.312 -15.943 -8.985
15 2HB SER 2 2HB SER 2 -2.891 -16.636 -8.195
16 HG SER 2 HG SER 2 -3.535 -16.461 -10.844
17 H PHE 3 H PHE 3 -5.003 -14.761 -7.571
18 HA PHE 3 HA PHE 3 -4.520 -12.859 -5.487
19 1HB PHE 3 1HB PHE 3 -6.731 -13.652 -4.602
20 2HB PHE 3 2HB PHE 3 -6.790 -14.835 -5.892
21 HD1 PHE 3 1HD PHE 3 -7.101 -14.145 -8.230
22 HD2 PHE 3 2HD PHE 3 -7.292 -11.374 -5.003
23 HE1 PHE 3 1HE PHE 3 -8.252 -12.526 -9.689
24 HE2 PHE 3 2HE PHE 3 -8.439 -9.754 -6.455
25 HZ PHE 3 HZ PHE 3 -8.920 -10.330 -8.804
26 H GLU 4 H GLU 4 -2.918 -13.501 -4.190
27 HA GLU 4 HA GLU 4 -3.161 -16.166 -3.032
28 1HB GLU 4 1HB GLU 4 -1.049 -15.904 -4.165
29 2HB GLU 4 2HB GLU 4 -0.768 -15.971 -2.432
30 1HG GLU 4 1HG GLU 4 -0.472 -13.556 -2.361
31 2HG GLU 4 2HG GLU 4 -0.759 -13.467 -4.100
32 H LYS 5 H LYS 5 -3.112 -16.447 -0.852
33 HA LYS 5 HA LYS 5 -4.008 -14.172 0.688
34 1HB LYS 5 1HB LYS 5 -3.500 -17.026 1.501
35 2HB LYS 5 2HB LYS 5 -5.065 -16.329 1.092
36 1HG LYS 5 1HG LYS 5 -4.852 -14.810 3.024
37 2HG LYS 5 2HG LYS 5 -3.319 -15.575 3.431
38 1HD LYS 5 1HD LYS 5 -4.517 -17.742 3.636
39 2HD LYS 5 2HD LYS 5 -6.030 -16.865 3.397
40 1HE LYS 5 1HE LYS 5 -5.512 -15.474 5.365
41 2HE LYS 5 2HE LYS 5 -4.033 -16.386 5.593
42 1HZ LYS 5 1HZ LYS 5 -6.784 -17.490 5.734
43 2HZ LYS 5 2HZ LYS 5 -5.745 -17.259 7.047
44 3HZ LYS 5 3HZ LYS 5 -5.378 -18.404 5.894
45 H ILE 6 H ILE 6 -2.820 -12.905 1.686
46 HA ILE 6 HA ILE 6 -0.053 -13.622 2.184
47 HB ILE 6 HB ILE 6 -1.518 -11.010 2.444
48 1HG1 ILE 6 1HG1 ILE 6 -0.177 -10.268 0.545
49 2HG1 ILE 6 2HG1 ILE 6 -1.089 -11.713 0.133
50 1HG2 ILE 6 1HG2 ILE 6 0.180 -11.139 4.130
51 2HG2 ILE 6 2HG2 ILE 6 0.671 -9.985 2.885
52 3HG2 ILE 6 3HG2 ILE 6 1.389 -11.604 2.936
53 1HD1 ILE 6 1HD1 ILE 6 0.902 -13.081 0.389
54 2HD1 ILE 6 2HD1 ILE 6 1.832 -11.640 0.821
55 3HD1 ILE 6 3HD1 ILE 6 1.146 -11.793 -0.793
56 H CYS 7 H CYS 7 -2.890 -12.333 3.900
57 HA CYS 7 HA CYS 7 -2.093 -13.645 6.330
58 1HB CYS 7 1HB CYS 7 -1.945 -11.512 7.671
59 2HB CYS 7 2HB CYS 7 -1.871 -10.629 6.158
60 HG CYS 7 HG CYS 7 0.387 -12.815 5.830
61 H SER 8 H SER 8 -3.439 -12.392 8.202
62 HA SER 8 HA SER 8 -6.190 -12.452 7.340
63 1HB SER 8 1HB SER 8 -4.894 -12.864 10.030
64 2HB SER 8 2HB SER 8 -5.614 -14.124 9.009
65 HG SER 8 HG SER 8 -7.258 -13.739 10.192
66 H LEU 9 H LEU 9 -7.518 -10.956 8.163
67 HA LEU 9 HA LEU 9 -6.647 -8.239 8.375
68 1HB LEU 9 1HB LEU 9 -9.229 -9.386 9.411
69 2HB LEU 9 2HB LEU 9 -8.966 -9.120 7.717
70 HG LEU 9 HG LEU 9 -8.723 -6.603 8.303
71 1HD1 LEU 9 1HD1 LEU 9 -10.701 -7.518 7.227
72 2HD1 LEU 9 2HD1 LEU 9 -11.143 -6.270 8.393
73 3HD1 LEU 9 3HD1 LEU 9 -11.363 -7.972 8.797
74 1HD2 LEU 9 1HD2 LEU 9 -9.816 -5.867 10.369
75 2HD2 LEU 9 2HD2 LEU 9 -8.412 -6.867 10.738
76 3HD2 LEU 9 3HD2 LEU 9 -10.034 -7.547 10.861
77 H ASP 10 H ASP 10 -6.962 -10.815 10.580
78 HA ASP 10 HA ASP 10 -6.861 -9.442 13.074
79 1HB ASP 10 1HB ASP 10 -5.632 -12.142 12.435
80 2HB ASP 10 2HB ASP 10 -7.346 -11.911 12.742
81 H ASP 11 H ASP 11 -4.547 -9.956 10.588
82 HA ASP 11 HA ASP 11 -2.213 -9.175 12.200
83 1HB ASP 11 1HB ASP 11 -0.921 -9.488 10.099
84 2HB ASP 11 2HB ASP 11 -2.401 -9.812 9.229
85 H ILE 12 H ILE 12 -4.234 -8.106 9.532
86 HA ILE 12 HA ILE 12 -3.001 -5.464 9.667
87 HB ILE 12 HB ILE 12 -2.382 -6.252 7.712
88 1HG1 ILE 12 1HG1 ILE 12 -4.824 -4.621 7.084
89 2HG1 ILE 12 2HG1 ILE 12 -3.623 -5.032 5.885
90 1HG2 ILE 12 1HG2 ILE 12 -3.835 -7.339 5.963
91 2HG2 ILE 12 2HG2 ILE 12 -5.141 -7.300 7.155
92 3HG2 ILE 12 3HG2 ILE 12 -3.687 -8.248 7.472
93 1HD1 ILE 12 1HD1 ILE 12 -3.101 -3.483 8.419
94 2HD1 ILE 12 2HD1 ILE 12 -3.232 -2.800 6.799
95 3HD1 ILE 12 3HD1 ILE 12 -1.900 -3.887 7.195
96 H TRP 13 H TRP 13 -4.129 -4.029 10.490
97 HA TRP 13 HA TRP 13 -7.028 -4.348 10.717
98 1HB TRP 13 1HB TRP 13 -6.786 -2.856 12.698
99 2HB TRP 13 2HB TRP 13 -5.046 -2.896 12.432
100 HD1 TRP 13 HD TRP 13 -3.868 -5.388 12.606
101 HE1 TRP 13 1HE TRP 13 -4.476 -7.362 14.142
102 HE3 TRP 13 3HE TRP 13 -8.639 -4.025 13.830
103 HZ2 TRP 13 2HZ TRP 13 -6.685 -8.232 15.656
104 HZ3 TRP 13 3HZ TRP 13 -9.934 -5.487 15.315
105 HH2 TRP 13 HH TRP 13 -8.977 -7.548 16.205
106 H VAL 14 H VAL 14 -8.235 -2.267 11.083
107 HA VAL 14 HA VAL 14 -8.015 -0.716 8.709
108 HB VAL 14 HB VAL 14 -9.781 -0.211 11.121
109 1HG1 VAL 14 1HG1 VAL 14 -10.001 0.757 8.278
110 2HG1 VAL 14 2HG1 VAL 14 -9.602 1.740 9.688
111 3HG1 VAL 14 3HG1 VAL 14 -11.204 1.018 9.538
112 1HG2 VAL 14 1HG2 VAL 14 -10.362 -1.758 8.596
113 2HG2 VAL 14 2HG2 VAL 14 -11.530 -1.392 9.866
114 3HG2 VAL 14 3HG2 VAL 14 -10.157 -2.443 10.206
115 H GLY 15 H GLY 15 -6.912 1.046 8.363
116 1HA GLY 15 1HA GLY 15 -6.229 2.840 10.575
117 2HA GLY 15 2HA GLY 15 -6.160 3.223 8.855
118 H GLU 16 H GLU 16 -5.019 0.168 9.448
119 HA GLU 16 HA GLU 16 -2.272 1.033 9.888
120 1HB GLU 16 1HB GLU 16 -1.926 -1.386 10.494
121 2HB GLU 16 2HB GLU 16 -3.638 -1.615 10.235
122 1HG GLU 16 1HG GLU 16 -3.092 -1.404 12.607
123 2HG GLU 16 2HG GLU 16 -4.207 -0.161 12.048
124 H MET 17 H MET 17 -0.645 0.133 8.595
125 HA MET 17 HA MET 17 -1.336 -1.486 6.314
126 1HB MET 17 1HB MET 17 -1.698 0.725 5.442
127 2HB MET 17 2HB MET 17 -0.224 0.062 4.746
128 1HG MET 17 1HG MET 17 1.090 1.380 6.350
129 2HG MET 17 2HG MET 17 -0.410 2.065 6.971
130 1HE MET 17 1HE MET 17 1.130 5.092 5.189
131 2HE MET 17 2HE MET 17 1.959 3.821 6.083
132 3HE MET 17 3HE MET 17 0.422 4.445 6.667
133 H GLU 18 H GLU 18 0.429 -2.692 5.615
134 HA GLU 18 HA GLU 18 3.037 -1.893 6.391
135 1HB GLU 18 1HB GLU 18 2.493 -2.854 8.495
136 2HB GLU 18 2HB GLU 18 3.654 -3.894 7.695
137 1HG GLU 18 1HG GLU 18 1.880 -5.440 7.086
138 2HG GLU 18 2HG GLU 18 0.706 -4.398 7.896
139 H THR 19 H THR 19 4.722 -3.103 5.593
140 HA THR 19 HA THR 19 4.263 -4.195 3.011
141 HB THR 19 HB THR 19 6.713 -4.073 4.739
142 HG1 THR 19 1HG THR 19 5.480 -2.391 2.888
143 1HG2 THR 19 1HG2 THR 19 6.511 -4.689 1.777
144 2HG2 THR 19 2HG2 THR 19 6.972 -5.827 3.037
145 3HG2 THR 19 3HG2 THR 19 8.017 -4.453 2.667
146 H PHE 20 H PHE 20 4.135 -6.229 2.363
147 HA PHE 20 HA PHE 20 5.012 -8.424 4.074
148 1HB PHE 20 1HB PHE 20 3.064 -9.756 3.195
149 2HB PHE 20 2HB PHE 20 2.433 -8.280 2.500
150 HD1 PHE 20 1HD PHE 20 3.370 -9.778 5.760
151 HD2 PHE 20 2HD PHE 20 0.994 -6.927 3.690
152 HE1 PHE 20 1HE PHE 20 2.111 -9.334 7.826
153 HE2 PHE 20 2HE PHE 20 -0.268 -6.479 5.745
154 HZ PHE 20 HZ PHE 20 0.291 -7.683 7.821
155 H GLU 21 H GLU 21 5.458 -10.363 2.738
156 HA GLU 21 HA GLU 21 6.412 -9.565 0.078
157 1HB GLU 21 1HB GLU 21 7.275 -11.829 1.895
158 2HB GLU 21 2HB GLU 21 8.128 -10.314 1.625
159 1HG GLU 21 1HG GLU 21 8.563 -10.889 -0.659
160 2HG GLU 21 2HG GLU 21 7.625 -12.374 -0.496
161 H THR 22 H THR 22 5.678 -10.608 -1.649
162 HA THR 22 HA THR 22 3.472 -12.488 -1.333
163 HB THR 22 HB THR 22 3.280 -12.424 -3.777
164 HG1 THR 22 1HG THR 22 4.812 -11.010 -4.894
165 1HG2 THR 22 1HG2 THR 22 2.874 -10.033 -4.101
166 2HG2 THR 22 2HG2 THR 22 3.864 -9.673 -2.699
167 3HG2 THR 22 3HG2 THR 22 2.324 -10.523 -2.491
168 H SER 23 H SER 23 3.540 -14.444 -2.918
169 HA SER 23 HA SER 23 5.610 -16.177 -2.174
170 1HB SER 23 1HB SER 23 4.577 -17.719 -3.770
171 2HB SER 23 2HB SER 23 3.644 -16.362 -4.407
172 HG SER 23 HG SER 23 2.669 -16.120 -2.435
173 H ASP 24 H ASP 24 5.354 -13.896 -4.694
174 HA ASP 24 HA ASP 24 7.468 -15.156 -6.262
175 1HB ASP 24 1HB ASP 24 7.027 -13.409 -7.935
176 2HB ASP 24 2HB ASP 24 5.853 -12.677 -6.845
177 H GLY 25 H GLY 25 7.405 -13.389 -3.619
178 1HA GLY 25 1HA GLY 25 10.088 -12.480 -3.992
179 2HA GLY 25 2HA GLY 25 9.119 -12.282 -2.538
180 H THR 26 H THR 26 6.944 -10.968 -3.969
181 HA THR 26 HA THR 26 8.179 -8.454 -4.773
182 HB THR 26 HB THR 26 5.254 -9.243 -4.734
183 HG1 THR 26 1HG THR 26 7.321 -9.707 -6.585
184 1HG2 THR 26 1HG2 THR 26 5.716 -6.820 -4.921
185 2HG2 THR 26 2HG2 THR 26 5.020 -7.465 -6.406
186 3HG2 THR 26 3HG2 THR 26 6.748 -7.133 -6.316
187 H GLU 27 H GLU 27 8.079 -6.675 -3.403
188 HA GLU 27 HA GLU 27 6.994 -7.173 -0.760
189 1HB GLU 27 1HB GLU 27 8.034 -4.991 -0.193
190 2HB GLU 27 2HB GLU 27 8.508 -4.784 -1.868
191 1HG GLU 27 1HG GLU 27 10.403 -5.478 -0.598
192 2HG GLU 27 2HG GLU 27 9.931 -6.780 -1.686
193 H VAL 28 H VAL 28 5.016 -6.496 -0.254
194 HA VAL 28 HA VAL 28 3.812 -4.381 -1.889
195 HB VAL 28 HB VAL 28 2.462 -6.932 -0.960
196 1HG1 VAL 28 1HG1 VAL 28 1.276 -4.667 -2.549
197 2HG1 VAL 28 2HG1 VAL 28 0.865 -5.118 -0.893
198 3HG1 VAL 28 3HG1 VAL 28 0.487 -6.213 -2.226
199 1HG2 VAL 28 1HG2 VAL 28 3.912 -7.328 -2.858
200 2HG2 VAL 28 2HG2 VAL 28 3.140 -6.016 -3.752
201 3HG2 VAL 28 3HG2 VAL 28 2.225 -7.468 -3.350
202 H LEU 29 H LEU 29 2.527 -3.034 -0.865
203 HA LEU 29 HA LEU 29 2.540 -2.987 2.067
204 1HB LEU 29 1HB LEU 29 2.119 -0.860 -0.047
205 2HB LEU 29 2HB LEU 29 3.462 -1.030 1.080
206 HG LEU 29 HG LEU 29 0.686 -0.300 1.909
207 1HD1 LEU 29 1HD1 LEU 29 3.277 -0.380 3.412
208 2HD1 LEU 29 2HD1 LEU 29 1.893 -1.452 3.647
209 3HD1 LEU 29 3HD1 LEU 29 1.759 0.266 4.024
210 1HD2 LEU 29 1HD2 LEU 29 1.617 1.936 2.263
211 2HD2 LEU 29 2HD2 LEU 29 1.685 1.463 0.568
212 3HD2 LEU 29 3HD2 LEU 29 3.146 1.411 1.556
213 H ILE 30 H ILE 30 0.743 -3.907 2.843
214 HA ILE 30 HA ILE 30 -1.721 -3.608 1.327
215 HB ILE 30 HB ILE 30 -1.161 -5.290 3.796
216 1HG1 ILE 30 1HG1 ILE 30 0.008 -6.109 1.829
217 2HG1 ILE 30 2HG1 ILE 30 -1.463 -5.993 0.887
218 1HG2 ILE 30 1HG2 ILE 30 -3.369 -6.300 3.364
219 2HG2 ILE 30 2HG2 ILE 30 -3.619 -5.183 2.025
220 3HG2 ILE 30 3HG2 ILE 30 -3.515 -4.567 3.671
221 1HD1 ILE 30 1HD1 ILE 30 -2.478 -7.759 2.243
222 2HD1 ILE 30 2HD1 ILE 30 -1.003 -7.873 3.205
223 3HD1 ILE 30 3HD1 ILE 30 -0.980 -8.307 1.493
224 H VAL 31 H VAL 31 -2.894 -1.949 1.746
225 HA VAL 31 HA VAL 31 -2.668 -0.666 4.376
226 HB VAL 31 HB VAL 31 -3.763 0.480 1.799
227 1HG1 VAL 31 1HG1 VAL 31 -4.644 1.563 3.760
228 2HG1 VAL 31 2HG1 VAL 31 -3.560 2.648 2.891
229 3HG1 VAL 31 3HG1 VAL 31 -3.015 1.862 4.371
230 1HG2 VAL 31 1HG2 VAL 31 -1.679 1.769 1.602
231 2HG2 VAL 31 2HG2 VAL 31 -1.400 0.033 1.488
232 3HG2 VAL 31 3HG2 VAL 31 -1.018 0.892 2.982
233 H ASN 32 H ASN 32 -4.456 -0.974 5.643
234 HA ASN 32 HA ASN 32 -6.970 -1.488 4.210
235 1HB ASN 32 1HB ASN 32 -6.229 -2.143 7.083
236 2HB ASN 32 2HB ASN 32 -6.247 -3.303 5.762
237 1HD2 ASN 32 1HD2 ASN 32 -7.696 -3.479 8.158
238 2HD2 ASN 32 2HD2 ASN 32 -9.379 -3.490 7.781
239 H SER 33 H SER 33 -8.014 0.325 3.951
240 HA SER 33 HA SER 33 -7.541 2.487 5.830
241 1HB SER 33 1HB SER 33 -8.369 3.924 4.060
242 2HB SER 33 2HB SER 33 -8.746 2.510 3.075
243 HG SER 33 HG SER 33 -6.329 2.135 3.724
244 H GLU 34 H GLU 34 -9.205 3.825 6.424
245 HA GLU 34 HA GLU 34 -11.541 2.478 7.364
246 1HB GLU 34 1HB GLU 34 -10.667 5.353 7.458
247 2HB GLU 34 2HB GLU 34 -10.366 4.139 8.683
248 1HG GLU 34 1HG GLU 34 -12.751 3.999 9.148
249 2HG GLU 34 2HG GLU 34 -13.049 5.237 7.923
250 H GLU 35 H GLU 35 -10.962 5.143 5.118
251 HA GLU 35 HA GLU 35 -13.724 5.007 4.157
252 1HB GLU 35 1HB GLU 35 -11.516 7.025 3.727
253 2HB GLU 35 2HB GLU 35 -12.925 7.210 4.750
254 1HG GLU 35 1HG GLU 35 -14.365 7.222 2.811
255 2HG GLU 35 2HG GLU 35 -12.971 6.987 1.756
256 H HIS 36 H HIS 36 -10.439 4.464 3.130
257 HA HIS 36 HA HIS 36 -11.261 4.199 0.346
258 1HB HIS 36 1HB HIS 36 -8.784 3.928 -0.124
259 2HB HIS 36 2HB HIS 36 -8.502 4.247 1.577
260 HD1 HIS 36 1HD HIS 36 -8.270 5.964 -1.430
261 HD2 HIS 36 2HD HIS 36 -10.032 6.908 2.214
262 HE1 HIS 36 1HE HIS 36 -8.521 8.444 -1.423
263 HE2 HIS 36 2HE HIS 36 -9.819 8.946 0.650
264 H GLY 37 H GLY 37 -11.383 2.133 2.799
265 1HA GLY 37 1HA GLY 37 -11.594 -0.155 1.152
266 2HA GLY 37 2HA GLY 37 -11.637 -0.139 2.909
267 H VAL 38 H VAL 38 -10.419 -2.210 1.598
268 HA VAL 38 HA VAL 38 -7.686 -1.793 2.459
269 HB VAL 38 HB VAL 38 -8.859 -3.790 3.348
270 1HG1 VAL 38 1HG1 VAL 38 -10.333 -4.298 1.511
271 2HG1 VAL 38 2HG1 VAL 38 -9.355 -5.711 1.910
272 3HG1 VAL 38 3HG1 VAL 38 -8.960 -4.735 0.496
273 1HG2 VAL 38 1HG2 VAL 38 -6.560 -4.472 1.517
274 2HG2 VAL 38 2HG2 VAL 38 -7.129 -5.473 2.853
275 3HG2 VAL 38 3HG2 VAL 38 -6.442 -3.880 3.175
276 H LYS 39 H LYS 39 -6.052 -1.604 1.131
277 HA LYS 39 HA LYS 39 -6.464 -2.371 -1.655
278 1HB LYS 39 1HB LYS 39 -5.136 0.179 -0.783
279 2HB LYS 39 2HB LYS 39 -6.827 0.069 -1.240
280 1HG LYS 39 1HG LYS 39 -4.665 -0.780 -3.108
281 2HG LYS 39 2HG LYS 39 -5.159 0.897 -2.980
282 1HD LYS 39 1HD LYS 39 -6.370 -0.015 -4.828
283 2HD LYS 39 2HD LYS 39 -7.488 0.178 -3.468
284 1HE LYS 39 1HE LYS 39 -7.644 -2.041 -3.024
285 2HE LYS 39 2HE LYS 39 -6.282 -2.476 -4.064
286 1HZ LYS 39 1HZ LYS 39 -7.527 -1.836 -5.942
287 2HZ LYS 39 2HZ LYS 39 -8.796 -1.237 -5.022
288 3HZ LYS 39 3HZ LYS 39 -8.516 -2.901 -5.066
289 H ALA 40 H ALA 40 -4.441 -2.733 -2.831
290 HA ALA 40 HA ALA 40 -2.156 -3.232 -1.077
291 1HB ALA 40 1HB ALA 40 -1.632 -5.191 -2.471
292 2HB ALA 40 2HB ALA 40 -3.103 -4.911 -3.407
293 3HB ALA 40 3HB ALA 40 -3.212 -5.347 -1.703
294 H TYR 41 H TYR 41 -0.351 -2.235 -1.707
295 HA TYR 41 HA TYR 41 0.001 -1.422 -4.523
296 1HB TYR 41 1HB TYR 41 1.068 0.676 -3.713
297 2HB TYR 41 2HB TYR 41 0.559 0.289 -2.085
298 HD1 TYR 41 1HD TYR 41 -1.535 0.905 -1.280
299 HD2 TYR 41 2HD TYR 41 -0.728 1.117 -5.443
300 HE1 TYR 41 1HE TYR 41 -3.639 2.112 -1.623
301 HE2 TYR 41 2HE TYR 41 -2.836 2.326 -5.802
302 HH TYR 41 HH TYR 41 -4.714 3.534 -3.181
303 H GLN 42 H GLN 42 2.324 -1.066 -5.019
304 HA GLN 42 HA GLN 42 4.102 -2.903 -3.896
305 1HB GLN 42 1HB GLN 42 5.963 -1.416 -4.830
306 2HB GLN 42 2HB GLN 42 4.706 -0.329 -5.404
307 1HG GLN 42 1HG GLN 42 5.413 -1.744 -7.167
308 2HG GLN 42 2HG GLN 42 3.751 -2.131 -6.718
309 1HE2 GLN 42 1HE2 GLN 42 7.082 -3.192 -6.635
310 2HE2 GLN 42 2HE2 GLN 42 6.731 -4.817 -6.202
311 H ALA 43 H ALA 43 5.576 -2.867 -2.285
312 HA ALA 43 HA ALA 43 4.885 -1.234 -0.070
313 1HB ALA 43 1HB ALA 43 5.633 -3.531 0.159
314 2HB ALA 43 2HB ALA 43 6.576 -2.407 1.140
315 3HB ALA 43 3HB ALA 43 7.242 -3.040 -0.367
316 H MET 44 H MET 44 7.531 -1.225 -2.256
317 HA MET 44 HA MET 44 8.643 1.083 -0.808
318 1HB MET 44 1HB MET 44 10.719 0.697 -2.119
319 2HB MET 44 2HB MET 44 9.949 -0.686 -2.880
320 1HG MET 44 1HG MET 44 9.742 -1.764 -0.695
321 2HG MET 44 2HG MET 44 10.541 -0.384 0.053
322 1HE MET 44 1HE MET 44 12.291 -2.002 1.182
323 2HE MET 44 2HE MET 44 13.246 -3.192 0.295
324 3HE MET 44 3HE MET 44 11.499 -3.389 0.433
325 H CYS 45 H CYS 45 8.231 3.022 -1.589
326 HA CYS 45 HA CYS 45 6.941 3.346 -4.096
327 1HB CYS 45 1HB CYS 45 6.418 4.763 -2.170
328 2HB CYS 45 2HB CYS 45 6.937 5.745 -3.523
329 HA PRO 46 HA PRO 46 10.175 4.178 -7.046
330 1HB PRO 46 1HB PRO 46 9.532 5.777 -8.568
331 2HB PRO 46 2HB PRO 46 9.473 7.046 -7.343
332 1HG PRO 46 1HG PRO 46 7.415 4.999 -8.050
333 2HG PRO 46 2HG PRO 46 7.207 6.721 -7.699
334 1HD PRO 46 1HD PRO 46 6.647 4.837 -5.869
335 2HD PRO 46 2HD PRO 46 7.356 6.404 -5.419
336 H HIS 47 H HIS 47 9.849 6.266 -4.430
337 HA HIS 47 HA HIS 47 12.558 7.337 -4.719
338 1HB HIS 47 1HB HIS 47 11.936 8.765 -2.815
339 2HB HIS 47 2HB HIS 47 10.302 8.102 -2.901
340 HD2 HIS 47 2HD HIS 47 12.681 9.792 -5.539
341 HE1 HIS 47 1HE HIS 47 8.794 11.292 -6.102
342 HE2 HIS 47 2HE HIS 47 11.057 10.952 -7.093
343 H GLN 48 H GLN 48 10.777 5.035 -2.955
344 HA GLN 48 HA GLN 48 10.906 4.124 -1.007
345 1HB GLN 48 1HB GLN 48 12.228 2.510 -2.152
346 2HB GLN 48 2HB GLN 48 12.962 2.712 -0.581
347 1HG GLN 48 1HG GLN 48 14.755 4.094 -1.583
348 2HG GLN 48 2HG GLN 48 14.010 3.855 -3.155
349 1HE2 GLN 48 1HE2 GLN 48 14.225 1.905 -4.179
350 2HE2 GLN 48 2HE2 GLN 48 15.288 0.666 -3.632
351 H GLU 49 H GLU 49 14.229 4.914 -0.287
352 HA GLU 49 HA GLU 49 15.183 5.917 1.450
353 1HB GLU 49 1HB GLU 49 14.304 8.161 2.150
354 2HB GLU 49 2HB GLU 49 12.939 7.901 1.077
355 1HG GLU 49 1HG GLU 49 14.442 7.781 -0.832
356 2HG GLU 49 2HG GLU 49 15.821 8.032 0.233
357 H ILE 50 H ILE 50 11.844 6.560 2.333
358 HA ILE 50 HA ILE 50 12.431 5.456 4.986
359 HB ILE 50 HB ILE 50 10.263 7.433 4.205
360 1HG1 ILE 50 1HG1 ILE 50 12.542 8.384 3.909
361 2HG1 ILE 50 2HG1 ILE 50 12.906 7.973 5.581
362 1HG2 ILE 50 1HG2 ILE 50 11.318 6.514 6.886
363 2HG2 ILE 50 2HG2 ILE 50 9.726 6.150 6.210
364 3HG2 ILE 50 3HG2 ILE 50 10.152 7.807 6.650
365 1HD1 ILE 50 1HD1 ILE 50 10.793 9.914 4.689
366 2HD1 ILE 50 2HD1 ILE 50 12.376 10.325 5.342
367 3HD1 ILE 50 3HD1 ILE 50 11.188 9.501 6.358
368 H LEU 51 H LEU 51 11.019 3.903 5.774
369 HA LEU 51 HA LEU 51 9.388 2.621 3.811
370 1HB LEU 51 1HB LEU 51 8.792 1.043 5.697
371 2HB LEU 51 2HB LEU 51 9.847 1.970 6.730
372 HG LEU 51 HG LEU 51 10.783 0.472 4.282
373 1HD1 LEU 51 1HD1 LEU 51 13.022 0.768 5.192
374 2HD1 LEU 51 2HD1 LEU 51 12.362 1.732 6.512
375 3HD1 LEU 51 3HD1 LEU 51 12.251 2.318 4.849
376 1HD2 LEU 51 1HD2 LEU 51 10.922 -0.303 7.186
377 2HD2 LEU 51 2HD2 LEU 51 11.695 -1.166 5.855
378 3HD2 LEU 51 3HD2 LEU 51 9.935 -1.074 5.943
379 H LEU 52 H LEU 52 7.720 3.798 3.272
380 HA LEU 52 HA LEU 52 6.078 5.298 4.958
381 1HB LEU 52 1HB LEU 52 6.014 5.707 2.574
382 2HB LEU 52 2HB LEU 52 4.409 5.346 3.146
383 HG LEU 52 HG LEU 52 4.633 3.033 2.173
384 1HD1 LEU 52 1HD1 LEU 52 3.437 4.818 1.010
385 2HD1 LEU 52 2HD1 LEU 52 4.293 3.777 -0.130
386 3HD1 LEU 52 3HD1 LEU 52 4.950 5.360 0.280
387 1HD2 LEU 52 1HD2 LEU 52 6.353 2.714 0.436
388 2HD2 LEU 52 2HD2 LEU 52 7.052 2.850 2.037
389 3HD2 LEU 52 3HD2 LEU 52 7.121 4.227 0.928
390 H SER 53 H SER 53 6.141 1.937 4.372
391 HA SER 53 HA SER 53 3.607 1.087 5.271
392 1HB SER 53 1HB SER 53 5.154 -0.276 4.050
393 2HB SER 53 2HB SER 53 4.848 -1.036 5.591
394 HG SER 53 HG SER 53 6.950 -1.004 5.700
395 H GLU 54 H GLU 54 6.454 2.205 6.853
396 HA GLU 54 HA GLU 54 5.408 1.602 9.525
397 1HB GLU 54 1HB GLU 54 8.266 2.093 8.581
398 2HB GLU 54 2HB GLU 54 7.562 0.505 8.638
399 1HG GLU 54 1HG GLU 54 8.949 0.619 10.493
400 2HG GLU 54 2HG GLU 54 7.318 0.749 11.120
401 H GLY 55 H GLY 55 4.846 3.883 7.522
402 1HA GLY 55 1HA GLY 55 5.312 6.136 7.265
403 2HA GLY 55 2HA GLY 55 6.200 6.112 8.784
404 H SER 56 H SER 56 3.302 6.925 7.298
405 HA SER 56 HA SER 56 1.780 6.741 9.726
406 1HB SER 56 1HB SER 56 1.277 9.129 9.690
407 2HB SER 56 2HB SER 56 2.461 9.292 8.388
408 HG SER 56 HG SER 56 3.675 8.001 10.307
409 H TYR 57 H TYR 57 -0.351 7.353 9.435
410 HA TYR 57 HA TYR 57 -1.448 7.189 6.691
411 1HB TYR 57 1HB TYR 57 -2.293 5.752 9.220
412 2HB TYR 57 2HB TYR 57 -1.655 5.007 7.770
413 HD1 TYR 57 1HD TYR 57 -4.612 6.382 9.370
414 HD2 TYR 57 2HD TYR 57 -3.061 4.786 5.739
415 HE1 TYR 57 1HE TYR 57 -6.900 6.018 8.568
416 HE2 TYR 57 2HE TYR 57 -5.357 4.429 4.921
417 HH TYR 57 HH TYR 57 -8.032 5.826 6.375
418 H GLU 58 H GLU 58 -2.668 8.733 6.228
419 HA GLU 58 HA GLU 58 -4.021 10.280 8.322
420 1HB GLU 58 1HB GLU 58 -3.302 11.047 5.478
421 2HB GLU 58 2HB GLU 58 -2.183 11.349 6.785
422 1HG GLU 58 1HG GLU 58 -3.234 13.400 6.251
423 2HG GLU 58 2HG GLU 58 -3.838 12.885 7.818
424 H GLY 59 H GLY 59 -6.275 10.959 7.375
425 1HA GLY 59 1HA GLY 59 -8.291 10.375 6.498
426 2HA GLY 59 2HA GLY 59 -7.757 8.718 6.714
427 H GLY 60 H GLY 60 -6.274 11.079 4.535
428 1HA GLY 60 1HA GLY 60 -7.173 10.945 2.166
429 2HA GLY 60 2HA GLY 60 -6.981 9.210 2.368
430 H VAL 61 H VAL 61 -4.417 10.236 4.038
431 HA VAL 61 HA VAL 61 -2.808 10.435 1.612
432 HB VAL 61 HB VAL 61 -2.294 12.024 4.155
433 1HG1 VAL 61 1HG1 VAL 61 -0.219 11.293 3.125
434 2HG1 VAL 61 2HG1 VAL 61 -0.447 13.033 2.949
435 3HG1 VAL 61 3HG1 VAL 61 -0.753 11.959 1.581
436 1HG2 VAL 61 1HG2 VAL 61 -3.091 12.932 1.393
437 2HG2 VAL 61 2HG2 VAL 61 -2.680 13.984 2.748
438 3HG2 VAL 61 3HG2 VAL 61 -4.116 12.959 2.830
439 H ILE 62 H ILE 62 -1.370 8.910 1.449
440 HA ILE 62 HA ILE 62 -0.544 7.441 3.839
441 HB ILE 62 HB ILE 62 0.270 7.061 0.928
442 1HG1 ILE 62 1HG1 ILE 62 -1.234 5.098 0.929
443 2HG1 ILE 62 2HG1 ILE 62 -2.105 6.597 1.206
444 1HG2 ILE 62 1HG2 ILE 62 0.730 5.232 3.267
445 2HG2 ILE 62 2HG2 ILE 62 1.958 6.205 2.458
446 3HG2 ILE 62 3HG2 ILE 62 1.158 4.893 1.590
447 1HD1 ILE 62 1HD1 ILE 62 -2.936 4.807 2.622
448 2HD1 ILE 62 2HD1 ILE 62 -2.256 6.119 3.575
449 3HD1 ILE 62 3HD1 ILE 62 -1.338 4.627 3.349
450 H THR 63 H THR 63 1.426 7.847 4.810
451 HA THR 63 HA THR 63 2.695 10.242 3.796
452 HB THR 63 HB THR 63 3.073 8.792 6.407
453 HG1 THR 63 1HG THR 63 1.114 10.323 5.466
454 1HG2 THR 63 1HG2 THR 63 4.114 10.895 7.156
455 2HG2 THR 63 2HG2 THR 63 3.923 11.564 5.537
456 3HG2 THR 63 3HG2 THR 63 5.006 10.198 5.801
457 H CYS 64 H CYS 64 4.241 9.944 2.384
458 HA CYS 64 HA CYS 64 6.275 7.869 2.658
459 1HB CYS 64 1HB CYS 64 7.408 9.279 0.766
460 2HB CYS 64 2HB CYS 64 5.892 10.139 0.721
461 H ARG 65 H ARG 65 5.949 11.345 2.965
462 HA ARG 65 HA ARG 65 7.071 12.977 4.060
463 1HB ARG 65 1HB ARG 65 8.536 10.730 5.474
464 2HB ARG 65 2HB ARG 65 6.972 11.324 5.980
465 1HG ARG 65 1HG ARG 65 8.562 12.221 7.480
466 2HG ARG 65 2HG ARG 65 8.022 13.545 6.459
467 1HD ARG 65 1HD ARG 65 10.021 13.383 5.117
468 2HD ARG 65 2HD ARG 65 10.580 12.019 6.081
469 HE ARG 65 HE ARG 65 10.315 13.788 7.966
470 1HH1 ARG 65 1HH1 ARG 65 11.612 14.355 4.711
471 2HH1 ARG 65 2HH1 ARG 65 12.770 15.469 5.244
472 1HH2 ARG 65 1HH2 ARG 65 11.859 15.307 8.646
473 2HH2 ARG 65 2HH2 ARG 65 12.929 16.047 7.533
474 H ALA 66 H ALA 66 9.054 10.454 2.676
475 HA ALA 66 HA ALA 66 11.451 11.780 2.517
476 1HB ALA 66 1HB ALA 66 11.133 9.390 2.065
477 2HB ALA 66 2HB ALA 66 12.072 10.205 0.813
478 3HB ALA 66 3HB ALA 66 10.380 9.806 0.524
479 H HIS 67 H HIS 67 9.145 11.572 -0.297
480 HA HIS 67 HA HIS 67 10.617 13.755 -1.469
481 1HB HIS 67 1HB HIS 67 9.460 12.153 -3.012
482 2HB HIS 67 2HB HIS 67 9.104 13.822 -3.378
483 HD2 HIS 67 2HD HIS 67 6.421 14.524 -1.977
484 HE1 HIS 67 1HE HIS 67 4.929 10.852 -3.434
485 HE2 HIS 67 2HE HIS 67 4.377 12.912 -2.202
486 H LEU 68 H LEU 68 8.163 13.714 0.775
487 HA LEU 68 HA LEU 68 8.135 16.441 1.235
488 1HB LEU 68 1HB LEU 68 5.706 15.546 -0.346
489 2HB LEU 68 2HB LEU 68 6.961 16.600 -0.958
490 HG LEU 68 HG LEU 68 5.105 17.276 1.317
491 1HD1 LEU 68 1HD1 LEU 68 7.255 18.409 1.496
492 2HD1 LEU 68 2HD1 LEU 68 5.984 19.544 1.047
493 3HD1 LEU 68 3HD1 LEU 68 7.111 18.961 -0.171
494 1HD2 LEU 68 1HD2 LEU 68 4.060 18.790 -0.276
495 2HD2 LEU 68 2HD2 LEU 68 3.918 17.112 -0.798
496 3HD2 LEU 68 3HD2 LEU 68 5.101 18.177 -1.561
497 H TRP 69 H TRP 69 5.293 14.341 0.985
498 HA TRP 69 HA TRP 69 5.254 13.233 3.557
499 1HB TRP 69 1HB TRP 69 3.573 15.756 3.374
500 2HB TRP 69 2HB TRP 69 5.106 15.678 4.233
501 HD1 TRP 69 HD TRP 69 5.191 14.141 6.453
502 HE1 TRP 69 1HE TRP 69 3.348 13.543 8.143
503 HE3 TRP 69 3HE TRP 69 1.089 15.292 3.629
504 HZ2 TRP 69 2HZ TRP 69 0.535 13.557 8.268
505 HZ3 TRP 69 3HZ TRP 69 -1.141 14.974 4.613
506 HH2 TRP 69 HH TRP 69 -1.407 14.122 6.888
507 H THR 70 H THR 70 3.589 14.420 0.704
508 HA THR 70 HA THR 70 1.174 13.009 1.381
509 HB THR 70 HB THR 70 0.361 14.275 -0.602
510 HG1 THR 70 1HG THR 70 1.820 15.986 -1.311
511 1HG2 THR 70 1HG2 THR 70 0.052 15.117 1.697
512 2HG2 THR 70 2HG2 THR 70 0.339 16.443 0.570
513 3HG2 THR 70 3HG2 THR 70 1.640 15.886 1.619
514 H PHE 71 H PHE 71 0.396 11.347 0.270
515 HA PHE 71 HA PHE 71 1.402 10.546 -2.346
516 1HB PHE 71 1HB PHE 71 0.872 8.821 0.089
517 2HB PHE 71 2HB PHE 71 2.357 8.909 -0.843
518 HD1 PHE 71 1HD PHE 71 -0.964 7.422 -0.624
519 HD2 PHE 71 2HD PHE 71 2.526 7.771 -3.020
520 HE1 PHE 71 1HE PHE 71 -1.684 5.481 -1.935
521 HE2 PHE 71 2HE PHE 71 1.793 5.821 -4.334
522 HZ PHE 71 HZ PHE 71 -0.306 4.681 -3.795
523 H ASN 72 H ASN 72 -0.307 9.948 -3.723
524 HA ASN 72 HA ASN 72 -2.940 10.425 -2.565
525 1HB ASN 72 1HB ASN 72 -2.011 10.702 -5.436
526 2HB ASN 72 2HB ASN 72 -2.376 12.018 -4.327
527 1HD2 ASN 72 1HD2 ASN 72 -4.475 12.511 -3.869
528 2HD2 ASN 72 2HD2 ASN 72 -5.809 11.909 -4.775
529 H ASP 73 H ASP 73 -4.018 8.698 -2.165
530 HA ASP 73 HA ASP 73 -3.438 6.104 -2.955
531 1HB ASP 73 1HB ASP 73 -5.896 7.342 -1.764
532 2HB ASP 73 2HB ASP 73 -4.630 6.428 -0.956
533 H GLY 74 H GLY 74 -5.994 8.249 -4.205
534 1HA GLY 74 1HA GLY 74 -7.251 8.167 -6.116
535 2HA GLY 74 2HA GLY 74 -7.582 6.545 -5.573
536 H THR 75 H THR 75 -4.609 7.868 -6.962
537 HA THR 75 HA THR 75 -5.018 5.971 -9.185
538 HB THR 75 HB THR 75 -3.408 8.539 -9.308
539 HG1 THR 75 1HG THR 75 -6.145 8.049 -9.427
540 1HG2 THR 75 1HG2 THR 75 -3.731 8.292 -11.751
541 2HG2 THR 75 2HG2 THR 75 -4.626 6.797 -11.481
542 3HG2 THR 75 3HG2 THR 75 -2.915 6.880 -11.079
543 H GLY 76 H GLY 76 -3.458 5.930 -6.434
544 1HA GLY 76 1HA GLY 76 -1.424 4.165 -7.068
545 2HA GLY 76 2HA GLY 76 -1.482 5.124 -5.595
546 H HIS 77 H HIS 77 -1.024 7.598 -6.316
547 HA HIS 77 HA HIS 77 1.680 7.584 -7.494
548 1HB HIS 77 1HB HIS 77 0.146 7.962 -9.428
549 2HB HIS 77 2HB HIS 77 1.176 9.348 -9.115
550 HD1 HIS 77 1HD HIS 77 -0.472 10.957 -10.363
551 HD2 HIS 77 2HD HIS 77 -2.093 9.033 -7.070
552 HE1 HIS 77 1HE HIS 77 -2.645 12.123 -9.918
553 HE2 HIS 77 2HE HIS 77 -3.711 10.837 -8.055
554 H GLY 78 H GLY 78 2.840 9.496 -6.970
555 1HA GLY 78 1HA GLY 78 3.414 11.121 -5.433
556 2HA GLY 78 2HA GLY 78 1.943 10.729 -4.538
557 H ILE 79 H ILE 79 2.045 13.220 -4.447
558 HA ILE 79 HA ILE 79 0.423 14.259 -6.619
559 HB ILE 79 HB ILE 79 1.354 15.679 -4.066
560 1HG1 ILE 79 1HG1 ILE 79 -1.376 14.531 -4.752
561 2HG1 ILE 79 2HG1 ILE 79 -1.067 15.568 -3.372
562 1HG2 ILE 79 1HG2 ILE 79 -0.280 17.430 -4.605
563 2HG2 ILE 79 2HG2 ILE 79 -0.642 16.612 -6.123
564 3HG2 ILE 79 3HG2 ILE 79 0.963 17.283 -5.847
565 1HD1 ILE 79 1HD1 ILE 79 -1.178 13.290 -2.642
566 2HD1 ILE 79 2HD1 ILE 79 0.490 13.876 -2.488
567 3HD1 ILE 79 3HD1 ILE 79 0.044 12.830 -3.822
568 H ASN 80 H ASN 80 3.630 14.309 -5.411
569 HA ASN 80 HA ASN 80 4.560 15.571 -7.815
570 1HB ASN 80 1HB ASN 80 5.405 16.529 -5.140
571 2HB ASN 80 2HB ASN 80 4.245 17.442 -6.088
572 1HD2 ASN 80 1HD2 ASN 80 5.753 16.812 -8.618
573 2HD2 ASN 80 2HD2 ASN 80 7.177 17.768 -8.559
574 HA PRO 81 HA PRO 81 5.653 14.878 -9.163
575 1HB PRO 81 1HB PRO 81 6.950 13.704 -10.657
576 2HB PRO 81 2HB PRO 81 6.254 12.179 -10.102
577 1HG PRO 81 1HG PRO 81 8.625 13.667 -9.069
578 2HG PRO 81 2HG PRO 81 8.376 11.918 -9.206
579 1HD PRO 81 1HD PRO 81 8.188 13.153 -6.847
580 2HD PRO 81 2HD PRO 81 7.083 11.826 -7.283
581 H ASP 82 H ASP 82 3.877 14.102 -10.598
582 HA ASP 82 HA ASP 82 1.899 12.608 -9.019
583 1HB ASP 82 1HB ASP 82 1.333 14.989 -9.532
584 2HB ASP 82 2HB ASP 82 0.163 13.841 -10.162
585 H ASP 83 H ASP 83 3.926 12.367 -11.525
586 HA ASP 83 HA ASP 83 2.633 11.186 -13.630
587 1HB ASP 83 1HB ASP 83 5.278 10.524 -12.434
588 2HB ASP 83 2HB ASP 83 4.971 11.700 -13.711
589 H CYS 84 H CYS 84 4.006 9.548 -10.801
590 HA CYS 84 HA CYS 84 1.998 7.533 -10.692
591 1HB CYS 84 1HB CYS 84 3.578 5.609 -11.102
592 2HB CYS 84 2HB CYS 84 4.720 6.757 -11.773
593 HG CYS 84 HG CYS 84 2.500 7.541 -13.615
594 H CYS 85 H CYS 85 2.608 5.891 -9.017
595 HA CYS 85 HA CYS 85 4.942 6.533 -7.620
596 1HB CYS 85 1HB CYS 85 2.374 6.325 -6.108
597 2HB CYS 85 2HB CYS 85 3.281 7.802 -6.318
598 HG CYS 85 HG CYS 85 5.213 7.262 -4.395
599 H LEU 86 H LEU 86 2.276 4.705 -6.879
600 HA LEU 86 HA LEU 86 3.877 2.200 -6.712
601 1HB LEU 86 1HB LEU 86 2.334 1.386 -5.044
602 2HB LEU 86 2HB LEU 86 1.367 2.843 -5.157
603 HG LEU 86 HG LEU 86 3.275 4.144 -4.252
604 1HD1 LEU 86 1HD1 LEU 86 2.460 1.808 -2.533
605 2HD1 LEU 86 2HD1 LEU 86 1.553 3.303 -2.743
606 3HD1 LEU 86 3HD1 LEU 86 3.135 3.333 -1.964
607 1HD2 LEU 86 1HD2 LEU 86 4.544 1.437 -3.941
608 2HD2 LEU 86 2HD2 LEU 86 5.134 2.938 -3.237
609 3HD2 LEU 86 3HD2 LEU 86 5.097 2.745 -4.994
610 H ALA 87 H ALA 87 2.588 0.175 -7.025
611 HA ALA 87 HA ALA 87 0.768 0.519 -9.281
612 1HB ALA 87 1HB ALA 87 2.159 -1.953 -8.232
613 2HB ALA 87 2HB ALA 87 2.664 -1.009 -9.632
614 3HB ALA 87 3HB ALA 87 1.137 -1.892 -9.663
615 H GLU 88 H GLU 88 -1.304 -0.170 -9.168
616 HA GLU 88 HA GLU 88 -2.316 -0.666 -6.484
617 1HB GLU 88 1HB GLU 88 -3.714 0.160 -9.052
618 2HB GLU 88 2HB GLU 88 -3.120 1.276 -7.850
619 1HG GLU 88 1HG GLU 88 -5.407 1.228 -7.503
620 2HG GLU 88 2HG GLU 88 -4.743 0.221 -6.228
621 H TYR 89 H TYR 89 -2.654 -2.725 -5.947
622 HA TYR 89 HA TYR 89 -3.102 -4.673 -8.063
623 1HB TYR 89 1HB TYR 89 -2.371 -6.367 -6.368
624 2HB TYR 89 2HB TYR 89 -1.970 -5.049 -5.283
625 HD1 TYR 89 1HD TYR 89 -1.066 -6.763 -8.361
626 HD2 TYR 89 2HD TYR 89 -0.026 -3.669 -5.650
627 HE1 TYR 89 1HE TYR 89 1.160 -6.622 -9.392
628 HE2 TYR 89 2HE TYR 89 2.193 -3.512 -6.669
629 HH TYR 89 HH TYR 89 2.938 -5.064 -9.633
630 HA PRO 90 HA PRO 90 -7.229 -5.488 -6.589
631 1HB PRO 90 1HB PRO 90 -7.977 -7.098 -8.022
632 2HB PRO 90 2HB PRO 90 -6.776 -8.266 -7.465
633 1HG PRO 90 1HG PRO 90 -6.557 -6.163 -9.568
634 2HG PRO 90 2HG PRO 90 -5.896 -7.806 -9.550
635 1HD PRO 90 1HD PRO 90 -4.389 -5.658 -9.074
636 2HD PRO 90 2HD PRO 90 -4.093 -7.199 -8.232
637 H VAL 91 H VAL 91 -7.933 -6.026 -4.669
638 HA VAL 91 HA VAL 91 -6.586 -8.149 -3.199
639 HB VAL 91 HB VAL 91 -5.630 -6.026 -2.451
640 1HG1 VAL 91 1HG1 VAL 91 -7.378 -4.529 -3.093
641 2HG1 VAL 91 2HG1 VAL 91 -7.029 -4.327 -1.371
642 3HG1 VAL 91 3HG1 VAL 91 -8.457 -5.221 -1.886
643 1HG2 VAL 91 1HG2 VAL 91 -7.562 -7.100 -0.391
644 2HG2 VAL 91 2HG2 VAL 91 -6.110 -6.155 -0.047
645 3HG2 VAL 91 3HG2 VAL 91 -5.974 -7.771 -0.743
646 H GLU 92 H GLU 92 -7.912 -9.235 -1.778
647 HA GLU 92 HA GLU 92 -10.768 -8.510 -1.819
648 1HB GLU 92 1HB GLU 92 -11.334 -10.820 -1.973
649 2HB GLU 92 2HB GLU 92 -9.657 -11.281 -1.928
650 1HG GLU 92 1HG GLU 92 -9.291 -10.400 -4.119
651 2HG GLU 92 2HG GLU 92 -10.961 -9.812 -4.177
652 H VAL 93 H VAL 93 -11.616 -8.512 0.169
653 HA VAL 93 HA VAL 93 -10.140 -9.882 2.276
654 HB VAL 93 HB VAL 93 -10.060 -7.487 2.590
655 1HG1 VAL 93 1HG1 VAL 93 -12.072 -6.121 3.008
656 2HG1 VAL 93 2HG1 VAL 93 -13.067 -7.508 2.563
657 3HG1 VAL 93 3HG1 VAL 93 -12.008 -6.768 1.367
658 1HG2 VAL 93 1HG2 VAL 93 -11.019 -7.302 4.856
659 2HG2 VAL 93 2HG2 VAL 93 -10.174 -8.833 4.601
660 3HG2 VAL 93 3HG2 VAL 93 -11.936 -8.780 4.560
661 H LYS 94 H LYS 94 -11.098 -11.598 3.057
662 HA LYS 94 HA LYS 94 -14.045 -11.717 2.995
663 1HB LYS 94 1HB LYS 94 -14.006 -14.063 2.580
664 2HB LYS 94 2HB LYS 94 -12.315 -14.197 3.003
665 1HG LYS 94 1HG LYS 94 -13.124 -12.697 0.549
666 2HG LYS 94 2HG LYS 94 -12.985 -14.457 0.537
667 1HD LYS 94 1HD LYS 94 -10.654 -14.306 1.255
668 2HD LYS 94 2HD LYS 94 -10.787 -12.566 1.433
669 1HE LYS 94 1HE LYS 94 -9.644 -13.116 -0.602
670 2HE LYS 94 2HE LYS 94 -11.170 -12.303 -0.884
671 1HZ LYS 94 1HZ LYS 94 -10.823 -14.061 -2.464
672 2HZ LYS 94 2HZ LYS 94 -12.167 -14.453 -1.538
673 3HZ LYS 94 3HZ LYS 94 -10.714 -15.228 -1.272
674 H GLY 95 H GLY 95 -14.259 -10.955 5.084
675 1HA GLY 95 1HA GLY 95 -13.922 -12.841 7.175
676 2HA GLY 95 2HA GLY 95 -14.391 -11.166 7.384
677 H ASP 96 H ASP 96 -11.986 -13.397 7.575
678 HA ASP 96 HA ASP 96 -10.090 -11.394 8.677
679 1HB ASP 96 1HB ASP 96 -9.008 -13.251 9.786
680 2HB ASP 96 2HB ASP 96 -10.127 -14.391 9.090
681 H ASP 97 H ASP 97 -10.647 -13.196 5.956
682 HA ASP 97 HA ASP 97 -7.769 -13.676 5.608
683 1HB ASP 97 1HB ASP 97 -8.455 -15.045 3.676
684 2HB ASP 97 2HB ASP 97 -10.124 -14.726 4.076
685 H ILE 98 H ILE 98 -6.608 -12.586 4.340
686 HA ILE 98 HA ILE 98 -7.920 -10.881 2.368
687 HB ILE 98 HB ILE 98 -5.551 -10.258 4.099
688 1HG1 ILE 98 1HG1 ILE 98 -7.749 -9.825 5.088
689 2HG1 ILE 98 2HG1 ILE 98 -8.193 -8.839 3.691
690 1HG2 ILE 98 1HG2 ILE 98 -5.320 -8.106 2.832
691 2HG2 ILE 98 2HG2 ILE 98 -6.552 -8.657 1.702
692 3HG2 ILE 98 3HG2 ILE 98 -5.013 -9.499 1.795
693 1HD1 ILE 98 1HD1 ILE 98 -7.688 -7.494 5.544
694 2HD1 ILE 98 2HD1 ILE 98 -6.561 -7.242 4.200
695 3HD1 ILE 98 3HD1 ILE 98 -6.060 -8.185 5.618
696 H TYR 99 H TYR 99 -7.473 -11.238 0.454
697 HA TYR 99 HA TYR 99 -5.015 -12.647 -0.280
698 1HB TYR 99 1HB TYR 99 -6.422 -13.169 -2.438
699 2HB TYR 99 2HB TYR 99 -7.737 -12.604 -1.483
700 HD1 TYR 99 1HD TYR 99 -5.872 -15.434 -2.386
701 HD2 TYR 99 2HD TYR 99 -8.105 -13.827 0.851
702 HE1 TYR 99 1HE TYR 99 -6.144 -17.688 -1.467
703 HE2 TYR 99 2HE TYR 99 -8.385 -16.082 1.779
704 HH TYR 99 HH TYR 99 -8.339 -18.373 1.021
705 H VAL 100 H VAL 100 -3.852 -11.786 -1.942
706 HA VAL 100 HA VAL 100 -4.823 -9.310 -3.165
707 HB VAL 100 HB VAL 100 -2.637 -8.285 -3.057
708 1HG1 VAL 100 1HG1 VAL 100 -3.463 -9.232 -0.341
709 2HG1 VAL 100 2HG1 VAL 100 -4.009 -7.780 -1.194
710 3HG1 VAL 100 3HG1 VAL 100 -2.339 -7.913 -0.658
711 1HG2 VAL 100 1HG2 VAL 100 -1.677 -10.748 -1.599
712 2HG2 VAL 100 2HG2 VAL 100 -0.740 -9.269 -1.813
713 3HG2 VAL 100 3HG2 VAL 100 -1.195 -10.235 -3.215
714 H SER 101 H SER 101 -4.378 -9.122 -5.330
715 HA SER 101 HA SER 101 -3.145 -11.498 -6.494
716 1HB SER 101 1HB SER 101 -4.964 -9.495 -7.824
717 2HB SER 101 2HB SER 101 -5.477 -11.061 -7.189
718 HG SER 101 HG SER 101 -4.955 -10.940 -9.500
719 H THR 102 H THR 102 -1.244 -11.278 -7.198
720 HA THR 102 HA THR 102 -0.323 -8.625 -7.989
721 HB THR 102 HB THR 102 1.059 -9.631 -6.276
722 HG1 THR 102 1HG THR 102 2.014 -9.176 -8.788
723 1HG2 THR 102 1HG2 THR 102 1.404 -11.962 -8.167
724 2HG2 THR 102 2HG2 THR 102 0.532 -11.979 -6.634
725 3HG2 THR 102 3HG2 THR 102 2.282 -11.746 -6.650
726 H LYS 103 H LYS 103 -1.930 -10.812 -9.486
727 HA LYS 103 HA LYS 103 -0.168 -11.065 -11.814
728 1HB LYS 103 1HB LYS 103 -2.843 -12.388 -11.319
729 2HB LYS 103 2HB LYS 103 -1.302 -13.143 -10.950
730 1HG LYS 103 1HG LYS 103 -0.698 -13.025 -13.331
731 2HG LYS 103 2HG LYS 103 -2.271 -12.313 -13.683
732 1HD LYS 103 1HD LYS 103 -3.382 -14.306 -12.862
733 2HD LYS 103 2HD LYS 103 -1.825 -15.036 -12.472
734 1HE LYS 103 1HE LYS 103 -2.681 -15.899 -14.584
735 2HE LYS 103 2HE LYS 103 -1.205 -14.976 -14.849
736 1HZ LYS 103 1HZ LYS 103 -3.962 -13.978 -15.318
737 2HZ LYS 103 2HZ LYS 103 -2.866 -14.478 -16.498
738 3HZ LYS 103 3HZ LYS 103 -2.534 -13.109 -15.585
739 H GLY 104 H GLY 104 -0.788 -10.214 -13.798
740 1HA GLY 104 1HA GLY 104 -3.300 -8.741 -13.948
741 2HA GLY 104 2HA GLY 104 -2.214 -9.115 -15.286
742 H ILE 105 H ILE 105 -1.465 -7.680 -12.194
743 HA ILE 105 HA ILE 105 -0.842 -5.177 -13.549
744 HB ILE 105 HB ILE 105 -1.239 -5.729 -10.573
745 1HG1 ILE 105 1HG1 ILE 105 -2.855 -4.038 -12.511
746 2HG1 ILE 105 2HG1 ILE 105 -3.102 -4.040 -10.775
747 1HG2 ILE 105 1HG2 ILE 105 0.526 -4.090 -10.809
748 2HG2 ILE 105 2HG2 ILE 105 -0.929 -3.330 -10.170
749 3HG2 ILE 105 3HG2 ILE 105 -0.490 -3.106 -11.863
750 1HD1 ILE 105 1HD1 ILE 105 -3.720 -6.381 -10.841
751 2HD1 ILE 105 2HD1 ILE 105 -3.532 -6.384 -12.598
752 3HD1 ILE 105 3HD1 ILE 105 -4.769 -5.375 -11.834
753 H LEU 106 H LEU 106 1.174 -4.394 -13.602
754 HA LEU 106 HA LEU 106 3.287 -6.068 -12.475
755 1HB LEU 106 1HB LEU 106 3.282 -4.334 -14.973
756 2HB LEU 106 2HB LEU 106 3.139 -6.069 -14.962
757 HG LEU 106 HG LEU 106 5.533 -6.111 -13.985
758 1HD1 LEU 106 1HD1 LEU 106 5.000 -5.098 -16.769
759 2HD1 LEU 106 2HD1 LEU 106 4.946 -6.782 -16.252
760 3HD1 LEU 106 3HD1 LEU 106 6.474 -5.901 -16.231
761 1HD2 LEU 106 1HD2 LEU 106 5.473 -3.320 -15.141
762 2HD2 LEU 106 2HD2 LEU 106 6.906 -4.191 -14.597
763 3HD2 LEU 106 3HD2 LEU 106 5.669 -3.713 -13.432
764 HA PRO 107 HA PRO 107 4.313 -2.814 -9.678
765 1HB PRO 107 1HB PRO 107 6.389 -3.227 -8.858
766 2HB PRO 107 2HB PRO 107 7.158 -3.194 -10.432
767 1HG PRO 107 1HG PRO 107 5.708 -5.403 -9.028
768 2HG PRO 107 2HG PRO 107 7.134 -5.503 -10.076
769 1HD PRO 107 1HD PRO 107 4.611 -6.170 -10.881
770 2HD PRO 107 2HD PRO 107 5.874 -5.590 -11.986
771 H ASN 108 H ASN 108 4.532 -0.779 -9.703
772 HA ASN 108 HA ASN 108 4.813 0.711 -12.183
773 1HB ASN 108 1HB ASN 108 4.390 1.829 -9.390
774 2HB ASN 108 2HB ASN 108 3.072 1.068 -10.257
775 1HD2 ASN 108 1HD2 ASN 108 1.848 2.937 -10.243
776 2HD2 ASN 108 2HD2 ASN 108 2.192 4.241 -11.298
777 H LYS 109 H LYS 109 6.118 2.984 -11.657
778 HA LYS 109 HA LYS 109 8.840 2.490 -11.718
779 1HB LYS 109 1HB LYS 109 9.147 4.909 -11.005
780 2HB LYS 109 2HB LYS 109 7.412 5.001 -10.838
781 1HG LYS 109 1HG LYS 109 8.833 4.421 -13.426
782 2HG LYS 109 2HG LYS 109 8.231 5.996 -12.936
783 1HD LYS 109 1HD LYS 109 5.946 5.090 -12.858
784 2HD LYS 109 2HD LYS 109 6.569 3.548 -13.446
785 1HE LYS 109 1HE LYS 109 5.654 4.813 -15.295
786 2HE LYS 109 2HE LYS 109 7.392 4.659 -15.470
787 1HZ LYS 109 1HZ LYS 109 6.004 7.127 -14.477
788 2HZ LYS 109 2HZ LYS 109 6.667 6.883 -15.987
789 3HZ LYS 109 3HZ LYS 109 7.669 6.904 -14.647
790 H ALA 110 H ALA 110 6.903 2.404 -9.073
791 HA ALA 110 HA ALA 110 8.329 2.986 -6.806
792 1HB ALA 110 1HB ALA 110 7.001 1.268 -5.707
793 2HB ALA 110 2HB ALA 110 6.568 0.594 -7.280
794 3HB ALA 110 3HB ALA 110 6.023 2.209 -6.836
795 H HIS 111 H HIS 111 9.752 1.869 -5.512
796 HA HIS 111 HA HIS 111 11.555 0.704 -4.986
797 1HB HIS 111 1HB HIS 111 10.337 -1.457 -6.747
798 2HB HIS 111 2HB HIS 111 10.158 -1.314 -5.005
799 HD1 HIS 111 1HD HIS 111 12.056 -3.093 -7.457
800 HD2 HIS 111 2HD HIS 111 12.816 -1.631 -3.651
801 HE1 HIS 111 1HE HIS 111 14.059 -4.358 -6.636
802 HE2 HIS 111 2HE HIS 111 14.632 -3.254 -4.435
803 H SER 112 H SER 112 12.655 2.383 -6.066
804 HA SER 112 HA SER 112 13.899 1.591 -8.566
805 1HB SER 112 1HB SER 112 13.900 4.252 -7.104
806 2HB SER 112 2HB SER 112 12.837 3.846 -8.442
807 HG SER 112 HG SER 112 15.658 3.876 -8.569
Start of MODEL 20
1 1H MET 1 1HT MET 1 2.433 -18.373 -9.070
2 2H MET 1 2HT MET 1 1.272 -17.976 -10.265
3 3H MET 1 3HT MET 1 0.882 -19.065 -9.069
4 HA MET 1 HA MET 1 0.979 -17.399 -7.410
5 1HB MET 1 1HB MET 1 1.577 -15.533 -9.721
6 2HB MET 1 2HB MET 1 2.735 -16.015 -8.492
7 1HG MET 1 1HG MET 1 0.208 -14.447 -8.031
8 2HG MET 1 2HG MET 1 1.844 -13.792 -8.030
9 1HE MET 1 1HE MET 1 -0.213 -13.343 -5.629
10 2HE MET 1 2HE MET 1 1.430 -12.709 -5.626
11 3HE MET 1 3HE MET 1 0.835 -13.619 -4.237
12 H SER 2 H SER 2 -0.977 -16.551 -6.846
13 HA SER 2 HA SER 2 -2.983 -15.823 -8.736
14 1HB SER 2 1HB SER 2 -3.296 -18.373 -7.094
15 2HB SER 2 2HB SER 2 -3.030 -18.353 -8.833
16 HG SER 2 HG SER 2 -5.014 -17.756 -9.174
17 H PHE 3 H PHE 3 -5.134 -16.085 -6.937
18 HA PHE 3 HA PHE 3 -4.626 -14.121 -4.976
19 1HB PHE 3 1HB PHE 3 -6.781 -14.912 -3.882
20 2HB PHE 3 2HB PHE 3 -6.872 -16.140 -5.131
21 HD1 PHE 3 1HD PHE 3 -7.699 -15.643 -7.285
22 HD2 PHE 3 2HD PHE 3 -6.883 -12.516 -4.519
23 HE1 PHE 3 1HE PHE 3 -8.865 -14.043 -8.749
24 HE2 PHE 3 2HE PHE 3 -8.042 -10.914 -5.979
25 HZ PHE 3 HZ PHE 3 -9.034 -11.677 -8.092
26 H GLU 4 H GLU 4 -3.131 -14.379 -3.563
27 HA GLU 4 HA GLU 4 -3.081 -16.873 -2.039
28 1HB GLU 4 1HB GLU 4 -0.761 -15.034 -2.635
29 2HB GLU 4 2HB GLU 4 -1.118 -16.497 -3.539
30 1HG GLU 4 1HG GLU 4 -0.396 -16.319 -0.626
31 2HG GLU 4 2HG GLU 4 0.625 -16.926 -1.937
32 H LYS 5 H LYS 5 -2.624 -16.706 0.159
33 HA LYS 5 HA LYS 5 -3.738 -14.339 1.343
34 1HB LYS 5 1HB LYS 5 -2.608 -16.816 2.615
35 2HB LYS 5 2HB LYS 5 -4.319 -16.495 2.297
36 1HG LYS 5 1HG LYS 5 -4.202 -14.592 3.846
37 2HG LYS 5 2HG LYS 5 -2.527 -15.002 4.198
38 1HD LYS 5 1HD LYS 5 -3.266 -17.209 5.017
39 2HD LYS 5 2HD LYS 5 -4.945 -16.708 4.770
40 1HE LYS 5 1HE LYS 5 -4.549 -14.797 6.273
41 2HE LYS 5 2HE LYS 5 -2.922 -15.382 6.569
42 1HZ LYS 5 1HZ LYS 5 -3.921 -17.440 7.475
43 2HZ LYS 5 2HZ LYS 5 -5.454 -16.666 7.318
44 3HZ LYS 5 3HZ LYS 5 -4.285 -16.020 8.319
45 H ILE 6 H ILE 6 -2.657 -12.690 1.731
46 HA ILE 6 HA ILE 6 0.266 -12.821 1.941
47 HB ILE 6 HB ILE 6 -0.759 -11.282 0.308
48 1HG1 ILE 6 1HG1 ILE 6 0.850 -9.919 2.466
49 2HG1 ILE 6 2HG1 ILE 6 0.574 -9.239 0.867
50 1HG2 ILE 6 1HG2 ILE 6 -1.819 -9.770 2.668
51 2HG2 ILE 6 2HG2 ILE 6 -2.751 -10.607 1.426
52 3HG2 ILE 6 3HG2 ILE 6 -1.809 -9.176 1.009
53 1HD1 ILE 6 1HD1 ILE 6 2.755 -10.271 0.999
54 2HD1 ILE 6 2HD1 ILE 6 1.734 -11.146 -0.141
55 3HD1 ILE 6 3HD1 ILE 6 2.033 -11.808 1.467
56 H CYS 7 H CYS 7 -2.540 -11.801 3.638
57 HA CYS 7 HA CYS 7 -1.299 -12.060 6.206
58 1HB CYS 7 1HB CYS 7 -0.584 -9.785 5.793
59 2HB CYS 7 2HB CYS 7 -1.881 -9.765 6.955
60 HG CYS 7 HG CYS 7 -2.290 -7.562 5.396
61 H SER 8 H SER 8 -3.165 -10.735 7.678
62 HA SER 8 HA SER 8 -5.694 -11.883 6.732
63 1HB SER 8 1HB SER 8 -6.211 -12.838 8.735
64 2HB SER 8 2HB SER 8 -5.082 -12.070 9.732
65 HG SER 8 HG SER 8 -3.473 -13.376 8.694
66 H LEU 9 H LEU 9 -7.590 -10.797 7.389
67 HA LEU 9 HA LEU 9 -7.445 -7.988 7.644
68 1HB LEU 9 1HB LEU 9 -9.729 -9.902 8.082
69 2HB LEU 9 2HB LEU 9 -9.290 -9.236 6.545
70 HG LEU 9 HG LEU 9 -11.276 -8.115 7.195
71 1HD1 LEU 9 1HD1 LEU 9 -11.353 -8.665 9.544
72 2HD1 LEU 9 2HD1 LEU 9 -11.600 -6.935 9.308
73 3HD1 LEU 9 3HD1 LEU 9 -10.038 -7.536 9.871
74 1HD2 LEU 9 1HD2 LEU 9 -8.967 -6.293 7.843
75 2HD2 LEU 9 2HD2 LEU 9 -10.601 -5.777 7.440
76 3HD2 LEU 9 3HD2 LEU 9 -9.624 -6.623 6.240
77 H ASP 10 H ASP 10 -7.879 -10.583 9.890
78 HA ASP 10 HA ASP 10 -8.503 -9.059 12.215
79 1HB ASP 10 1HB ASP 10 -7.291 -11.799 11.852
80 2HB ASP 10 2HB ASP 10 -8.962 -11.405 12.219
81 H ASP 11 H ASP 11 -5.586 -9.569 10.527
82 HA ASP 11 HA ASP 11 -3.899 -8.906 12.774
83 1HB ASP 11 1HB ASP 11 -3.203 -9.265 9.852
84 2HB ASP 11 2HB ASP 11 -3.080 -10.499 11.101
85 H ILE 12 H ILE 12 -4.909 -7.381 9.722
86 HA ILE 12 HA ILE 12 -3.745 -4.929 10.763
87 HB ILE 12 HB ILE 12 -4.001 -3.928 8.574
88 1HG1 ILE 12 1HG1 ILE 12 -5.904 -5.375 7.748
89 2HG1 ILE 12 2HG1 ILE 12 -4.734 -6.674 7.602
90 1HG2 ILE 12 1HG2 ILE 12 -2.178 -5.205 7.448
91 2HG2 ILE 12 2HG2 ILE 12 -2.466 -6.536 8.566
92 3HG2 ILE 12 3HG2 ILE 12 -1.885 -4.990 9.177
93 1HD1 ILE 12 1HD1 ILE 12 -3.518 -5.478 5.931
94 2HD1 ILE 12 2HD1 ILE 12 -4.607 -4.099 6.094
95 3HD1 ILE 12 3HD1 ILE 12 -5.212 -5.632 5.461
96 H TRP 13 H TRP 13 -4.901 -3.653 11.734
97 HA TRP 13 HA TRP 13 -7.745 -3.706 11.560
98 1HB TRP 13 1HB TRP 13 -7.496 -1.860 13.320
99 2HB TRP 13 2HB TRP 13 -5.783 -2.216 13.249
100 HD1 TRP 13 HD TRP 13 -5.541 -5.213 13.311
101 HE1 TRP 13 1HE TRP 13 -6.421 -6.655 15.270
102 HE3 TRP 13 3HE TRP 13 -8.909 -1.918 15.258
103 HZ2 TRP 13 2HZ TRP 13 -8.300 -6.386 17.385
104 HZ3 TRP 13 3HZ TRP 13 -10.201 -2.571 17.248
105 HH2 TRP 13 HH TRP 13 -9.901 -4.759 18.285
106 H VAL 14 H VAL 14 -8.896 -1.600 11.491
107 HA VAL 14 HA VAL 14 -8.362 -0.339 9.052
108 HB VAL 14 HB VAL 14 -10.639 -0.436 9.970
109 1HG1 VAL 14 1HG1 VAL 14 -9.683 1.513 12.047
110 2HG1 VAL 14 2HG1 VAL 14 -10.202 -0.150 12.320
111 3HG1 VAL 14 3HG1 VAL 14 -11.362 1.062 11.771
112 1HG2 VAL 14 1HG2 VAL 14 -9.662 2.386 9.577
113 2HG2 VAL 14 2HG2 VAL 14 -11.347 1.873 9.490
114 3HG2 VAL 14 3HG2 VAL 14 -10.179 1.268 8.315
115 H GLY 15 H GLY 15 -6.992 1.169 8.519
116 1HA GLY 15 1HA GLY 15 -6.114 3.094 10.524
117 2HA GLY 15 2HA GLY 15 -5.843 3.190 8.786
118 H GLU 16 H GLU 16 -5.223 0.086 9.573
119 HA GLU 16 HA GLU 16 -2.475 0.601 10.364
120 1HB GLU 16 1HB GLU 16 -2.508 -1.968 10.835
121 2HB GLU 16 2HB GLU 16 -4.199 -1.844 10.466
122 1HG GLU 16 1HG GLU 16 -3.805 -1.854 12.840
123 2HG GLU 16 2HG GLU 16 -4.606 -0.381 12.297
124 H MET 17 H MET 17 -0.826 -0.036 9.156
125 HA MET 17 HA MET 17 -1.320 -1.219 6.541
126 1HB MET 17 1HB MET 17 -1.349 1.157 6.193
127 2HB MET 17 2HB MET 17 0.172 0.497 5.586
128 1HG MET 17 1HG MET 17 1.336 1.277 7.567
129 2HG MET 17 2HG MET 17 -0.169 1.905 8.230
130 1HE MET 17 1HE MET 17 1.868 3.607 4.468
131 2HE MET 17 2HE MET 17 0.981 2.076 4.494
132 3HE MET 17 3HE MET 17 2.483 2.237 5.413
133 H GLU 18 H GLU 18 0.357 -2.479 5.855
134 HA GLU 18 HA GLU 18 2.892 -2.194 7.051
135 1HB GLU 18 1HB GLU 18 1.265 -4.669 7.648
136 2HB GLU 18 2HB GLU 18 2.062 -3.467 8.700
137 1HG GLU 18 1HG GLU 18 3.596 -5.407 7.050
138 2HG GLU 18 2HG GLU 18 3.190 -5.624 8.750
139 H THR 19 H THR 19 4.564 -3.534 5.914
140 HA THR 19 HA THR 19 3.743 -4.087 3.176
141 HB THR 19 HB THR 19 6.452 -3.537 4.382
142 HG1 THR 19 1HG THR 19 6.314 -1.610 3.362
143 1HG2 THR 19 1HG2 THR 19 7.306 -3.510 2.062
144 2HG2 THR 19 2HG2 THR 19 5.715 -4.015 1.488
145 3HG2 THR 19 3HG2 THR 19 6.666 -5.096 2.503
146 H PHE 20 H PHE 20 3.827 -6.017 2.445
147 HA PHE 20 HA PHE 20 5.280 -8.098 3.925
148 1HB PHE 20 1HB PHE 20 3.544 -9.691 3.228
149 2HB PHE 20 2HB PHE 20 2.670 -8.403 2.417
150 HD1 PHE 20 1HD PHE 20 1.308 -6.858 3.653
151 HD2 PHE 20 2HD PHE 20 3.610 -9.797 5.687
152 HE1 PHE 20 1HE PHE 20 0.067 -6.389 5.720
153 HE2 PHE 20 2HE PHE 20 2.371 -9.336 7.754
154 HZ PHE 20 HZ PHE 20 0.599 -7.631 7.777
155 H GLU 21 H GLU 21 6.167 -9.748 2.523
156 HA GLU 21 HA GLU 21 6.578 -8.694 -0.184
157 1HB GLU 21 1HB GLU 21 8.560 -10.185 1.549
158 2HB GLU 21 2HB GLU 21 8.557 -8.453 1.249
159 1HG GLU 21 1HG GLU 21 8.972 -8.838 -1.113
160 2HG GLU 21 2HG GLU 21 8.969 -10.579 -0.832
161 H THR 22 H THR 22 6.414 -10.070 -1.838
162 HA THR 22 HA THR 22 5.136 -12.607 -1.316
163 HB THR 22 HB THR 22 4.806 -12.744 -3.737
164 HG1 THR 22 1HG THR 22 5.687 -11.172 -5.076
165 1HG2 THR 22 1HG2 THR 22 3.290 -11.234 -2.478
166 2HG2 THR 22 2HG2 THR 22 3.569 -10.672 -4.131
167 3HG2 THR 22 3HG2 THR 22 4.412 -9.902 -2.790
168 H SER 23 H SER 23 5.912 -14.518 -2.761
169 HA SER 23 HA SER 23 8.502 -15.278 -2.067
170 1HB SER 23 1HB SER 23 6.772 -16.893 -2.401
171 2HB SER 23 2HB SER 23 7.983 -17.162 -3.660
172 HG SER 23 HG SER 23 6.390 -16.916 -4.990
173 H ASP 24 H ASP 24 7.211 -13.584 -4.787
174 HA ASP 24 HA ASP 24 9.469 -14.039 -6.537
175 1HB ASP 24 1HB ASP 24 7.211 -12.058 -6.787
176 2HB ASP 24 2HB ASP 24 7.148 -13.704 -7.406
177 H GLY 25 H GLY 25 8.802 -12.016 -3.947
178 1HA GLY 25 1HA GLY 25 11.171 -10.422 -4.572
179 2HA GLY 25 2HA GLY 25 10.455 -10.615 -2.979
180 H THR 26 H THR 26 7.745 -10.091 -4.285
181 HA THR 26 HA THR 26 7.984 -7.292 -4.969
182 HB THR 26 HB THR 26 5.517 -9.015 -4.696
183 HG1 THR 26 1HG THR 26 7.513 -8.905 -6.535
184 1HG2 THR 26 1HG2 THR 26 5.112 -6.585 -4.729
185 2HG2 THR 26 2HG2 THR 26 4.522 -7.346 -6.208
186 3HG2 THR 26 3HG2 THR 26 6.046 -6.455 -6.219
187 H GLU 27 H GLU 27 8.028 -5.860 -3.344
188 HA GLU 27 HA GLU 27 6.840 -6.558 -0.790
189 1HB GLU 27 1HB GLU 27 7.830 -4.391 -0.031
190 2HB GLU 27 2HB GLU 27 8.447 -4.150 -1.664
191 1HG GLU 27 1HG GLU 27 9.735 -6.218 -1.459
192 2HG GLU 27 2HG GLU 27 9.145 -6.411 0.186
193 H VAL 28 H VAL 28 4.907 -5.960 -0.230
194 HA VAL 28 HA VAL 28 3.565 -3.894 -1.828
195 HB VAL 28 HB VAL 28 2.377 -6.467 -0.818
196 1HG1 VAL 28 1HG1 VAL 28 0.743 -4.713 -0.870
197 2HG1 VAL 28 2HG1 VAL 28 0.416 -5.875 -2.158
198 3HG1 VAL 28 3HG1 VAL 28 1.168 -4.323 -2.536
199 1HG2 VAL 28 1HG2 VAL 28 3.097 -5.686 -3.637
200 2HG2 VAL 28 2HG2 VAL 28 2.219 -7.146 -3.184
201 3HG2 VAL 28 3HG2 VAL 28 3.891 -6.921 -2.664
202 H LEU 29 H LEU 29 2.353 -2.566 -0.725
203 HA LEU 29 HA LEU 29 2.397 -2.686 2.206
204 1HB LEU 29 1HB LEU 29 3.195 -0.620 1.071
205 2HB LEU 29 2HB LEU 29 1.879 -0.286 2.136
206 HG LEU 29 HG LEU 29 1.419 -0.577 -0.811
207 1HD1 LEU 29 1HD1 LEU 29 -0.027 0.938 1.326
208 2HD1 LEU 29 2HD1 LEU 29 -0.591 -0.526 0.502
209 3HD1 LEU 29 3HD1 LEU 29 -0.420 0.998 -0.382
210 1HD2 LEU 29 1HD2 LEU 29 2.162 1.989 0.578
211 2HD2 LEU 29 2HD2 LEU 29 1.680 1.816 -1.102
212 3HD2 LEU 29 3HD2 LEU 29 3.189 1.102 -0.545
213 H ILE 30 H ILE 30 0.672 -3.423 3.173
214 HA ILE 30 HA ILE 30 -1.855 -3.501 1.673
215 HB ILE 30 HB ILE 30 -1.100 -5.174 4.106
216 1HG1 ILE 30 1HG1 ILE 30 -0.803 -7.074 2.594
217 2HG1 ILE 30 2HG1 ILE 30 0.299 -5.777 2.143
218 1HG2 ILE 30 1HG2 ILE 30 -3.076 -6.503 3.494
219 2HG2 ILE 30 2HG2 ILE 30 -3.390 -5.412 2.148
220 3HG2 ILE 30 3HG2 ILE 30 -3.511 -4.821 3.804
221 1HD1 ILE 30 1HD1 ILE 30 -2.274 -6.431 0.747
222 2HD1 ILE 30 2HD1 ILE 30 -0.647 -6.825 0.188
223 3HD1 ILE 30 3HD1 ILE 30 -1.154 -5.140 0.313
224 H VAL 31 H VAL 31 -3.186 -1.947 2.274
225 HA VAL 31 HA VAL 31 -3.033 -0.975 5.060
226 HB VAL 31 HB VAL 31 -3.860 0.636 2.633
227 1HG1 VAL 31 1HG1 VAL 31 -3.728 2.567 4.138
228 2HG1 VAL 31 2HG1 VAL 31 -3.385 1.483 5.485
229 3HG1 VAL 31 3HG1 VAL 31 -4.937 1.394 4.658
230 1HG2 VAL 31 1HG2 VAL 31 -1.492 0.151 2.532
231 2HG2 VAL 31 2HG2 VAL 31 -1.275 0.737 4.178
232 3HG2 VAL 31 3HG2 VAL 31 -1.750 1.856 2.897
233 H ASN 32 H ASN 32 -4.823 -1.319 6.188
234 HA ASN 32 HA ASN 32 -7.338 -1.880 4.821
235 1HB ASN 32 1HB ASN 32 -6.637 -1.672 7.786
236 2HB ASN 32 2HB ASN 32 -6.661 -3.157 6.862
237 1HD2 ASN 32 1HD2 ASN 32 -8.130 -4.007 8.378
238 2HD2 ASN 32 2HD2 ASN 32 -9.803 -3.589 8.311
239 H SER 33 H SER 33 -8.241 -0.037 4.003
240 HA SER 33 HA SER 33 -7.999 2.426 5.536
241 1HB SER 33 1HB SER 33 -8.624 3.553 3.480
242 2HB SER 33 2HB SER 33 -8.927 2.003 2.691
243 HG SER 33 HG SER 33 -6.805 1.571 2.690
244 H GLU 34 H GLU 34 -9.795 3.702 5.971
245 HA GLU 34 HA GLU 34 -12.120 2.192 6.727
246 1HB GLU 34 1HB GLU 34 -11.589 5.165 6.888
247 2HB GLU 34 2HB GLU 34 -11.227 3.993 8.143
248 1HG GLU 34 1HG GLU 34 -13.981 4.668 7.135
249 2HG GLU 34 2HG GLU 34 -13.256 5.280 8.619
250 H GLU 35 H GLU 35 -11.544 4.855 4.446
251 HA GLU 35 HA GLU 35 -14.270 4.617 3.487
252 1HB GLU 35 1HB GLU 35 -12.070 6.617 2.876
253 2HB GLU 35 2HB GLU 35 -13.369 6.843 4.008
254 1HG GLU 35 1HG GLU 35 -13.941 8.172 2.194
255 2HG GLU 35 2HG GLU 35 -14.971 6.758 2.056
256 H HIS 36 H HIS 36 -10.983 4.264 2.290
257 HA HIS 36 HA HIS 36 -11.922 3.591 -0.367
258 1HB HIS 36 1HB HIS 36 -9.095 3.571 0.717
259 2HB HIS 36 2HB HIS 36 -9.891 4.990 0.063
260 HD1 HIS 36 1HD HIS 36 -7.283 4.114 -1.184
261 HD2 HIS 36 2HD HIS 36 -11.009 2.923 -2.587
262 HE1 HIS 36 1HE HIS 36 -6.935 3.496 -3.567
263 HE2 HIS 36 2HE HIS 36 -9.235 3.221 -4.451
264 H GLY 37 H GLY 37 -11.286 1.833 2.475
265 1HA GLY 37 1HA GLY 37 -11.731 -0.663 1.055
266 2HA GLY 37 2HA GLY 37 -11.703 -0.440 2.800
267 H VAL 38 H VAL 38 -10.435 -2.621 1.833
268 HA VAL 38 HA VAL 38 -7.736 -2.101 2.661
269 HB VAL 38 HB VAL 38 -8.984 -4.682 1.661
270 1HG1 VAL 38 1HG1 VAL 38 -6.438 -4.228 3.217
271 2HG1 VAL 38 2HG1 VAL 38 -6.548 -4.658 1.513
272 3HG1 VAL 38 3HG1 VAL 38 -7.109 -5.791 2.741
273 1HG2 VAL 38 1HG2 VAL 38 -8.590 -3.702 4.493
274 2HG2 VAL 38 2HG2 VAL 38 -9.176 -5.299 4.032
275 3HG2 VAL 38 3HG2 VAL 38 -10.133 -3.866 3.656
276 H LYS 39 H LYS 39 -6.117 -1.645 1.344
277 HA LYS 39 HA LYS 39 -6.360 -2.432 -1.458
278 1HB LYS 39 1HB LYS 39 -5.241 -0.271 -2.084
279 2HB LYS 39 2HB LYS 39 -5.525 0.274 -0.436
280 1HG LYS 39 1HG LYS 39 -7.230 1.152 -1.897
281 2HG LYS 39 2HG LYS 39 -7.943 -0.008 -0.777
282 1HD LYS 39 1HD LYS 39 -7.834 -1.745 -2.546
283 2HD LYS 39 2HD LYS 39 -7.182 -0.543 -3.658
284 1HE LYS 39 1HE LYS 39 -9.202 0.786 -3.420
285 2HE LYS 39 2HE LYS 39 -9.862 -0.408 -2.310
286 1HZ LYS 39 1HZ LYS 39 -9.767 -2.049 -4.127
287 2HZ LYS 39 2HZ LYS 39 -9.183 -0.834 -5.169
288 3HZ LYS 39 3HZ LYS 39 -10.729 -0.717 -4.517
289 H ALA 40 H ALA 40 -4.485 -2.758 -2.606
290 HA ALA 40 HA ALA 40 -2.100 -3.196 -0.979
291 1HB ALA 40 1HB ALA 40 -3.210 -5.312 -1.477
292 2HB ALA 40 2HB ALA 40 -1.688 -5.181 -2.365
293 3HB ALA 40 3HB ALA 40 -3.220 -4.913 -3.196
294 H TYR 41 H TYR 41 -0.515 -1.971 -1.699
295 HA TYR 41 HA TYR 41 -0.328 -1.341 -4.585
296 1HB TYR 41 1HB TYR 41 0.683 0.815 -3.949
297 2HB TYR 41 2HB TYR 41 0.355 0.480 -2.269
298 HD1 TYR 41 1HD TYR 41 -1.981 0.453 -1.424
299 HD2 TYR 41 2HD TYR 41 -0.976 1.780 -5.329
300 HE1 TYR 41 1HE TYR 41 -4.087 1.678 -1.544
301 HE2 TYR 41 2HE TYR 41 -3.095 3.000 -5.464
302 HH TYR 41 HH TYR 41 -4.947 3.561 -2.704
303 H GLN 42 H GLN 42 1.882 -1.057 -5.278
304 HA GLN 42 HA GLN 42 3.796 -2.728 -4.093
305 1HB GLN 42 1HB GLN 42 5.393 -1.693 -5.617
306 2HB GLN 42 2HB GLN 42 4.368 -0.284 -5.805
307 1HG GLN 42 1HG GLN 42 4.321 -1.772 -7.763
308 2HG GLN 42 2HG GLN 42 2.734 -1.559 -7.034
309 1HE2 GLN 42 1HE2 GLN 42 5.337 -3.845 -7.624
310 2HE2 GLN 42 2HE2 GLN 42 4.408 -5.205 -7.159
311 H ALA 43 H ALA 43 5.439 -2.281 -2.566
312 HA ALA 43 HA ALA 43 4.888 0.151 -0.975
313 1HB ALA 43 1HB ALA 43 4.480 -1.984 0.094
314 2HB ALA 43 2HB ALA 43 5.753 -1.062 0.907
315 3HB ALA 43 3HB ALA 43 6.171 -2.412 -0.143
316 H MET 44 H MET 44 7.202 -0.963 -3.051
317 HA MET 44 HA MET 44 9.371 -0.040 -1.411
318 1HB MET 44 1HB MET 44 9.847 -2.098 -2.489
319 2HB MET 44 2HB MET 44 10.897 -0.873 -3.170
320 1HG MET 44 1HG MET 44 10.182 -2.298 -4.922
321 2HG MET 44 2HG MET 44 9.424 -0.724 -5.136
322 1HE MET 44 1HE MET 44 7.720 -1.743 -6.858
323 2HE MET 44 2HE MET 44 6.754 -3.189 -6.541
324 3HE MET 44 3HE MET 44 8.515 -3.309 -6.662
325 H CYS 45 H CYS 45 9.536 2.040 -1.253
326 HA CYS 45 HA CYS 45 9.592 3.758 -3.567
327 1HB CYS 45 1HB CYS 45 10.588 5.433 -1.946
328 2HB CYS 45 2HB CYS 45 10.477 4.206 -0.699
329 HA PRO 46 HA PRO 46 13.829 2.253 -4.199
330 1HB PRO 46 1HB PRO 46 12.919 1.644 -6.249
331 2HB PRO 46 2HB PRO 46 14.051 2.907 -6.761
332 1HG PRO 46 1HG PRO 46 11.494 3.052 -7.453
333 2HG PRO 46 2HG PRO 46 12.355 4.511 -6.923
334 1HD PRO 46 1HD PRO 46 10.296 2.916 -5.510
335 2HD PRO 46 2HD PRO 46 10.698 4.639 -5.359
336 H HIS 47 H HIS 47 13.428 4.768 -2.880
337 HA HIS 47 HA HIS 47 15.161 6.576 -4.395
338 1HB HIS 47 1HB HIS 47 14.301 8.415 -2.931
339 2HB HIS 47 2HB HIS 47 13.245 7.235 -2.145
340 HD2 HIS 47 2HD HIS 47 13.791 7.623 -5.996
341 HE1 HIS 47 1HE HIS 47 9.685 8.048 -5.181
342 HE2 HIS 47 2HE HIS 47 11.458 8.217 -6.904
343 H GLN 48 H GLN 48 14.619 6.263 -0.911
344 HA GLN 48 HA GLN 48 17.210 5.358 -0.303
345 1HB GLN 48 1HB GLN 48 16.630 8.312 0.128
346 2HB GLN 48 2HB GLN 48 17.820 7.664 -0.988
347 1HG GLN 48 1HG GLN 48 17.896 7.456 2.007
348 2HG GLN 48 2HG GLN 48 18.899 8.500 1.003
349 1HE2 GLN 48 1HE2 GLN 48 20.537 7.583 -0.228
350 2HE2 GLN 48 2HE2 GLN 48 21.132 5.987 0.095
351 H GLU 49 H GLU 49 17.018 4.496 1.658
352 HA GLU 49 HA GLU 49 16.175 3.815 3.635
353 1HB GLU 49 1HB GLU 49 15.021 5.485 5.113
354 2HB GLU 49 2HB GLU 49 15.077 6.619 3.767
355 1HG GLU 49 1HG GLU 49 17.501 6.552 3.782
356 2HG GLU 49 2HG GLU 49 17.455 5.450 5.156
357 H ILE 50 H ILE 50 14.919 2.240 2.755
358 HA ILE 50 HA ILE 50 12.146 2.902 2.252
359 HB ILE 50 HB ILE 50 13.078 1.564 0.504
360 1HG1 ILE 50 1HG1 ILE 50 10.751 1.057 1.082
361 2HG1 ILE 50 2HG1 ILE 50 11.282 -0.159 2.231
362 1HG2 ILE 50 1HG2 ILE 50 13.905 -0.438 2.594
363 2HG2 ILE 50 2HG2 ILE 50 14.964 0.573 1.605
364 3HG2 ILE 50 3HG2 ILE 50 13.994 -0.690 0.852
365 1HD1 ILE 50 1HD1 ILE 50 11.663 -0.275 -0.745
366 2HD1 ILE 50 2HD1 ILE 50 10.492 -1.197 0.204
367 3HD1 ILE 50 3HD1 ILE 50 12.220 -1.483 0.413
368 H LEU 51 H LEU 51 10.968 3.019 3.948
369 HA LEU 51 HA LEU 51 10.478 0.639 5.496
370 1HB LEU 51 1HB LEU 51 11.249 3.242 6.874
371 2HB LEU 51 2HB LEU 51 12.307 1.864 6.715
372 HG LEU 51 HG LEU 51 9.698 1.821 8.213
373 1HD1 LEU 51 1HD1 LEU 51 11.935 -0.186 8.054
374 2HD1 LEU 51 2HD1 LEU 51 10.316 -0.362 7.371
375 3HD1 LEU 51 3HD1 LEU 51 10.535 -0.294 9.116
376 1HD2 LEU 51 1HD2 LEU 51 12.525 2.045 9.248
377 2HD2 LEU 51 2HD2 LEU 51 11.082 1.803 10.235
378 3HD2 LEU 51 3HD2 LEU 51 11.278 3.292 9.313
379 H LEU 52 H LEU 52 9.064 1.548 3.655
380 HA LEU 52 HA LEU 52 7.327 3.703 3.774
381 1HB LEU 52 1HB LEU 52 7.316 1.039 2.395
382 2HB LEU 52 2HB LEU 52 7.829 2.567 1.756
383 HG LEU 52 HG LEU 52 5.872 1.902 0.598
384 1HD1 LEU 52 1HD1 LEU 52 3.713 1.554 1.627
385 2HD1 LEU 52 2HD1 LEU 52 4.452 1.698 3.218
386 3HD1 LEU 52 3HD1 LEU 52 4.907 0.370 2.154
387 1HD2 LEU 52 1HD2 LEU 52 4.360 3.764 0.988
388 2HD2 LEU 52 2HD2 LEU 52 6.050 4.272 1.016
389 3HD2 LEU 52 3HD2 LEU 52 5.154 4.075 2.532
390 H SER 53 H SER 53 6.931 0.455 5.104
391 HA SER 53 HA SER 53 4.142 0.644 5.386
392 1HB SER 53 1HB SER 53 5.442 -1.322 5.097
393 2HB SER 53 2HB SER 53 4.364 -1.545 6.381
394 HG SER 53 HG SER 53 6.223 -2.132 7.317
395 H GLU 54 H GLU 54 6.754 1.427 7.388
396 HA GLU 54 HA GLU 54 5.265 1.974 9.824
397 1HB GLU 54 1HB GLU 54 7.417 2.917 10.611
398 2HB GLU 54 2HB GLU 54 8.087 2.670 9.013
399 1HG GLU 54 1HG GLU 54 8.859 0.896 10.371
400 2HG GLU 54 2HG GLU 54 7.635 0.219 9.299
401 H GLY 55 H GLY 55 4.820 3.541 7.067
402 1HA GLY 55 1HA GLY 55 4.737 5.646 6.326
403 2HA GLY 55 2HA GLY 55 5.580 6.184 7.777
404 H SER 56 H SER 56 2.748 6.480 6.223
405 HA SER 56 HA SER 56 1.128 6.284 8.603
406 1HB SER 56 1HB SER 56 0.520 8.625 8.497
407 2HB SER 56 2HB SER 56 1.739 8.759 7.215
408 HG SER 56 HG SER 56 2.827 7.597 9.369
409 H TYR 57 H TYR 57 -0.938 6.526 8.254
410 HA TYR 57 HA TYR 57 -2.032 6.676 5.509
411 1HB TYR 57 1HB TYR 57 -2.680 4.746 7.748
412 2HB TYR 57 2HB TYR 57 -2.358 4.412 6.054
413 HD1 TYR 57 1HD TYR 57 -4.136 4.979 4.322
414 HD2 TYR 57 2HD TYR 57 -4.888 5.143 8.498
415 HE1 TYR 57 1HE TYR 57 -6.562 4.974 3.890
416 HE2 TYR 57 2HE TYR 57 -7.301 5.132 8.080
417 HH TYR 57 HH TYR 57 -8.779 5.794 6.286
418 H GLU 58 H GLU 58 -3.033 8.398 5.252
419 HA GLU 58 HA GLU 58 -4.806 9.324 7.352
420 1HB GLU 58 1HB GLU 58 -4.540 11.599 6.405
421 2HB GLU 58 2HB GLU 58 -3.392 10.951 5.229
422 1HG GLU 58 1HG GLU 58 -1.911 10.283 7.047
423 2HG GLU 58 2HG GLU 58 -3.066 10.885 8.221
424 H GLY 59 H GLY 59 -6.675 10.672 6.186
425 1HA GLY 59 1HA GLY 59 -8.636 10.386 5.067
426 2HA GLY 59 2HA GLY 59 -8.174 8.716 4.816
427 H GLY 60 H GLY 60 -6.444 8.478 3.107
428 1HA GLY 60 1HA GLY 60 -7.421 9.892 0.693
429 2HA GLY 60 2HA GLY 60 -6.817 8.238 0.698
430 H VAL 61 H VAL 61 -4.850 9.753 2.739
431 HA VAL 61 HA VAL 61 -2.960 10.601 0.658
432 HB VAL 61 HB VAL 61 -3.413 11.811 3.383
433 1HG1 VAL 61 1HG1 VAL 61 -1.763 13.532 2.658
434 2HG1 VAL 61 2HG1 VAL 61 -1.528 12.630 1.164
435 3HG1 VAL 61 3HG1 VAL 61 -1.055 11.914 2.704
436 1HG2 VAL 61 1HG2 VAL 61 -4.007 12.964 0.658
437 2HG2 VAL 61 2HG2 VAL 61 -4.137 13.846 2.181
438 3HG2 VAL 61 3HG2 VAL 61 -5.182 12.460 1.871
439 H ILE 62 H ILE 62 -1.015 9.467 0.834
440 HA ILE 62 HA ILE 62 -0.548 8.108 3.419
441 HB ILE 62 HB ILE 62 0.236 7.021 0.697
442 1HG1 ILE 62 1HG1 ILE 62 -1.544 5.358 0.939
443 2HG1 ILE 62 2HG1 ILE 62 -2.213 6.987 0.968
444 1HG2 ILE 62 1HG2 ILE 62 1.701 6.285 2.490
445 2HG2 ILE 62 2HG2 ILE 62 0.710 4.938 1.924
446 3HG2 ILE 62 3HG2 ILE 62 0.310 5.752 3.436
447 1HD1 ILE 62 1HD1 ILE 62 -2.456 6.894 3.364
448 2HD1 ILE 62 2HD1 ILE 62 -1.767 5.267 3.384
449 3HD1 ILE 62 3HD1 ILE 62 -3.305 5.570 2.569
450 H THR 63 H THR 63 1.411 8.424 4.306
451 HA THR 63 HA THR 63 3.470 9.897 2.800
452 HB THR 63 HB THR 63 3.303 9.302 5.781
453 HG1 THR 63 1HG THR 63 1.664 10.713 4.588
454 1HG2 THR 63 1HG2 THR 63 4.928 11.334 4.231
455 2HG2 THR 63 2HG2 THR 63 5.561 9.865 4.972
456 3HG2 THR 63 3HG2 THR 63 4.916 11.156 5.984
457 H CYS 64 H CYS 64 5.485 8.842 2.420
458 HA CYS 64 HA CYS 64 5.344 6.035 2.877
459 1HB CYS 64 1HB CYS 64 6.177 6.636 0.728
460 2HB CYS 64 2HB CYS 64 7.481 5.851 1.603
461 H ARG 65 H ARG 65 8.152 8.143 3.574
462 HA ARG 65 HA ARG 65 8.221 7.783 6.300
463 1HB ARG 65 1HB ARG 65 10.066 5.756 4.998
464 2HB ARG 65 2HB ARG 65 8.537 5.324 5.743
465 1HG ARG 65 1HG ARG 65 10.869 6.598 7.168
466 2HG ARG 65 2HG ARG 65 10.420 4.890 7.239
467 1HD ARG 65 1HD ARG 65 8.217 5.546 8.159
468 2HD ARG 65 2HD ARG 65 8.773 7.220 8.194
469 HE ARG 65 HE ARG 65 10.567 5.544 9.583
470 1HH1 ARG 65 1HH1 ARG 65 7.442 7.190 9.906
471 2HH1 ARG 65 2HH1 ARG 65 7.460 7.171 11.602
472 1HH2 ARG 65 1HH2 ARG 65 10.579 5.547 11.951
473 2HH2 ARG 65 2HH2 ARG 65 9.256 6.237 12.765
474 H ALA 66 H ALA 66 10.777 7.187 3.879
475 HA ALA 66 HA ALA 66 12.544 9.070 5.008
476 1HB ALA 66 1HB ALA 66 13.243 7.191 3.655
477 2HB ALA 66 2HB ALA 66 13.847 8.715 2.994
478 3HB ALA 66 3HB ALA 66 12.462 7.901 2.251
479 H HIS 67 H HIS 67 10.852 9.122 1.889
480 HA HIS 67 HA HIS 67 10.872 11.940 1.915
481 1HB HIS 67 1HB HIS 67 8.872 11.595 0.189
482 2HB HIS 67 2HB HIS 67 9.454 9.937 0.182
483 HD2 HIS 67 2HD HIS 67 11.587 13.244 0.042
484 HE1 HIS 67 1HE HIS 67 12.447 10.959 -3.388
485 HE2 HIS 67 2HE HIS 67 13.162 12.848 -1.921
486 H LEU 68 H LEU 68 9.832 13.177 3.195
487 HA LEU 68 HA LEU 68 7.637 12.184 4.807
488 1HB LEU 68 1HB LEU 68 9.024 14.880 4.765
489 2HB LEU 68 2HB LEU 68 9.521 13.532 5.756
490 HG LEU 68 HG LEU 68 6.901 15.016 6.033
491 1HD1 LEU 68 1HD1 LEU 68 6.688 12.691 6.699
492 2HD1 LEU 68 2HD1 LEU 68 6.639 13.756 8.103
493 3HD1 LEU 68 3HD1 LEU 68 8.103 12.848 7.740
494 1HD2 LEU 68 1HD2 LEU 68 9.389 15.068 7.740
495 2HD2 LEU 68 2HD2 LEU 68 7.865 15.880 8.108
496 3HD2 LEU 68 3HD2 LEU 68 8.812 16.374 6.704
497 H TRP 69 H TRP 69 7.614 12.822 1.898
498 HA TRP 69 HA TRP 69 5.563 14.849 1.692
499 1HB TRP 69 1HB TRP 69 5.883 14.572 -0.731
500 2HB TRP 69 2HB TRP 69 7.010 13.256 -0.426
501 HD1 TRP 69 HD TRP 69 9.489 13.879 -0.055
502 HE1 TRP 69 1HE TRP 69 10.797 16.103 0.089
503 HE3 TRP 69 3HE TRP 69 5.564 17.121 0.153
504 HZ2 TRP 69 2HZ TRP 69 10.236 18.841 0.271
505 HZ3 TRP 69 3HZ TRP 69 6.031 19.531 0.315
506 HH2 TRP 69 HH TRP 69 8.318 20.370 0.376
507 H THR 70 H THR 70 3.876 13.979 -0.162
508 HA THR 70 HA THR 70 2.922 11.444 0.960
509 HB THR 70 HB THR 70 0.629 12.416 0.996
510 HG1 THR 70 1HG THR 70 1.955 14.526 -0.102
511 1HG2 THR 70 1HG2 THR 70 0.945 13.679 3.091
512 2HG2 THR 70 2HG2 THR 70 2.671 13.802 2.753
513 3HG2 THR 70 3HG2 THR 70 1.946 12.227 3.067
514 H PHE 71 H PHE 71 1.927 10.071 -0.413
515 HA PHE 71 HA PHE 71 1.396 11.104 -3.076
516 1HB PHE 71 1HB PHE 71 2.955 9.181 -3.154
517 2HB PHE 71 2HB PHE 71 1.432 8.785 -3.930
518 HD1 PHE 71 1HD PHE 71 -0.074 7.166 -3.101
519 HD2 PHE 71 2HD PHE 71 3.598 8.001 -1.127
520 HE1 PHE 71 1HE PHE 71 -0.269 5.050 -1.878
521 HE2 PHE 71 2HE PHE 71 3.413 5.880 0.116
522 HZ PHE 71 HZ PHE 71 1.481 4.405 -0.259
523 H ASN 72 H ASN 72 -0.582 10.332 -4.123
524 HA ASN 72 HA ASN 72 -2.672 10.650 -2.107
525 1HB ASN 72 1HB ASN 72 -2.895 10.845 -5.114
526 2HB ASN 72 2HB ASN 72 -2.448 12.198 -4.092
527 1HD2 ASN 72 1HD2 ASN 72 -4.200 13.381 -4.764
528 2HD2 ASN 72 2HD2 ASN 72 -5.791 13.058 -4.203
529 H ASP 73 H ASP 73 -3.684 8.905 -1.433
530 HA ASP 73 HA ASP 73 -3.487 6.366 -2.710
531 1HB ASP 73 1HB ASP 73 -5.012 7.360 -0.306
532 2HB ASP 73 2HB ASP 73 -3.605 6.304 -0.354
533 H GLY 74 H GLY 74 -5.827 8.910 -2.714
534 1HA GLY 74 1HA GLY 74 -7.987 8.969 -3.624
535 2HA GLY 74 2HA GLY 74 -7.823 7.260 -4.030
536 H THR 75 H THR 75 -5.295 7.610 -5.271
537 HA THR 75 HA THR 75 -6.147 8.356 -7.917
538 HB THR 75 HB THR 75 -3.816 9.837 -6.643
539 HG1 THR 75 1HG THR 75 -6.413 10.347 -6.669
540 1HG2 THR 75 1HG2 THR 75 -5.026 10.083 -9.406
541 2HG2 THR 75 2HG2 THR 75 -3.457 9.375 -9.024
542 3HG2 THR 75 3HG2 THR 75 -3.734 11.097 -8.759
543 H GLY 76 H GLY 76 -3.396 7.462 -5.782
544 1HA GLY 76 1HA GLY 76 -2.728 5.320 -7.658
545 2HA GLY 76 2HA GLY 76 -2.232 5.431 -5.976
546 H HIS 77 H HIS 77 -1.914 8.351 -7.488
547 HA HIS 77 HA HIS 77 0.878 7.834 -8.314
548 1HB HIS 77 1HB HIS 77 0.676 10.001 -9.577
549 2HB HIS 77 2HB HIS 77 -1.020 10.063 -9.132
550 HD1 HIS 77 1HD HIS 77 0.793 9.399 -11.997
551 HD2 HIS 77 2HD HIS 77 -2.163 7.252 -10.031
552 HE1 HIS 77 1HE HIS 77 -0.224 7.928 -13.726
553 HE2 HIS 77 2HE HIS 77 -1.845 6.489 -12.480
554 H GLY 78 H GLY 78 2.541 9.212 -7.551
555 1HA GLY 78 1HA GLY 78 3.573 10.368 -5.928
556 2HA GLY 78 2HA GLY 78 2.097 10.292 -4.973
557 H ILE 79 H ILE 79 1.827 12.326 -4.328
558 HA ILE 79 HA ILE 79 1.123 14.312 -6.289
559 HB ILE 79 HB ILE 79 1.544 14.614 -3.286
560 1HG1 ILE 79 1HG1 ILE 79 -0.195 12.927 -3.830
561 2HG1 ILE 79 2HG1 ILE 79 -1.037 14.129 -4.799
562 1HG2 ILE 79 1HG2 ILE 79 1.606 16.743 -4.477
563 2HG2 ILE 79 2HG2 ILE 79 0.123 16.619 -3.525
564 3HG2 ILE 79 3HG2 ILE 79 0.076 16.363 -5.268
565 1HD1 ILE 79 1HD1 ILE 79 -2.086 13.862 -2.623
566 2HD1 ILE 79 2HD1 ILE 79 -1.423 15.483 -2.824
567 3HD1 ILE 79 3HD1 ILE 79 -0.568 14.300 -1.834
568 H ASN 80 H ASN 80 3.614 13.658 -3.920
569 HA ASN 80 HA ASN 80 5.677 14.662 -5.577
570 1HB ASN 80 1HB ASN 80 5.279 15.884 -2.836
571 2HB ASN 80 2HB ASN 80 4.832 16.740 -4.292
572 1HD2 ASN 80 1HD2 ASN 80 7.442 15.517 -2.364
573 2HD2 ASN 80 2HD2 ASN 80 8.721 16.363 -3.139
574 HA PRO 81 HA PRO 81 7.720 14.185 -5.811
575 1HB PRO 81 1HB PRO 81 9.584 12.907 -6.090
576 2HB PRO 81 2HB PRO 81 8.608 11.460 -6.333
577 1HG PRO 81 1HG PRO 81 9.631 12.643 -3.788
578 2HG PRO 81 2HG PRO 81 9.509 10.938 -4.264
579 1HD PRO 81 1HD PRO 81 7.751 12.006 -2.581
580 2HD PRO 81 2HD PRO 81 7.222 10.862 -3.836
581 H ASP 82 H ASP 82 7.559 13.681 -8.119
582 HA ASP 82 HA ASP 82 4.958 12.504 -8.759
583 1HB ASP 82 1HB ASP 82 5.550 14.755 -9.666
584 2HB ASP 82 2HB ASP 82 5.149 13.587 -10.920
585 H ASP 83 H ASP 83 8.187 11.567 -8.722
586 HA ASP 83 HA ASP 83 8.050 9.947 -11.107
587 1HB ASP 83 1HB ASP 83 10.212 10.988 -10.428
588 2HB ASP 83 2HB ASP 83 10.325 9.249 -10.639
589 H CYS 84 H CYS 84 7.005 9.599 -7.943
590 HA CYS 84 HA CYS 84 7.009 6.751 -8.330
591 1HB CYS 84 1HB CYS 84 8.127 7.024 -6.356
592 2HB CYS 84 2HB CYS 84 6.493 6.633 -5.854
593 HG CYS 84 HG CYS 84 7.491 8.624 -4.024
594 H CYS 85 H CYS 85 5.324 5.702 -8.417
595 HA CYS 85 HA CYS 85 2.759 6.680 -7.606
596 1HB CYS 85 1HB CYS 85 1.717 6.257 -9.659
597 2HB CYS 85 2HB CYS 85 3.132 5.664 -10.434
598 HG CYS 85 HG CYS 85 3.908 8.661 -9.479
599 H LEU 86 H LEU 86 1.273 4.882 -7.671
600 HA LEU 86 HA LEU 86 2.604 2.278 -7.598
601 1HB LEU 86 1HB LEU 86 1.459 1.749 -5.539
602 2HB LEU 86 2HB LEU 86 0.693 3.326 -5.510
603 HG LEU 86 HG LEU 86 2.886 4.386 -5.138
604 1HD1 LEU 86 1HD1 LEU 86 2.275 2.172 -3.210
605 2HD1 LEU 86 2HD1 LEU 86 1.528 3.767 -3.239
606 3HD1 LEU 86 3HD1 LEU 86 3.244 3.603 -2.867
607 1HD2 LEU 86 1HD2 LEU 86 4.307 2.752 -6.271
608 2HD2 LEU 86 2HD2 LEU 86 3.944 1.563 -5.015
609 3HD2 LEU 86 3HD2 LEU 86 4.843 3.024 -4.611
610 H ALA 87 H ALA 87 0.633 0.614 -7.172
611 HA ALA 87 HA ALA 87 -1.630 1.470 -8.764
612 1HB ALA 87 1HB ALA 87 0.077 -0.964 -9.299
613 2HB ALA 87 2HB ALA 87 -0.156 0.432 -10.359
614 3HB ALA 87 3HB ALA 87 -1.493 -0.668 -10.044
615 H GLU 88 H GLU 88 -3.527 0.459 -8.004
616 HA GLU 88 HA GLU 88 -3.176 -1.309 -5.735
617 1HB GLU 88 1HB GLU 88 -4.778 0.471 -5.317
618 2HB GLU 88 2HB GLU 88 -5.649 -1.049 -5.375
619 1HG GLU 88 1HG GLU 88 -6.269 -0.517 -7.741
620 2HG GLU 88 2HG GLU 88 -5.575 1.079 -7.492
621 H TYR 89 H TYR 89 -2.849 -3.342 -6.304
622 HA TYR 89 HA TYR 89 -4.304 -4.374 -8.580
623 1HB TYR 89 1HB TYR 89 -1.868 -4.865 -8.426
624 2HB TYR 89 2HB TYR 89 -2.831 -6.320 -8.517
625 HD1 TYR 89 1HD TYR 89 -2.878 -7.912 -6.814
626 HD2 TYR 89 2HD TYR 89 -0.696 -4.316 -6.286
627 HE1 TYR 89 1HE TYR 89 -1.733 -8.916 -4.931
628 HE2 TYR 89 2HE TYR 89 0.466 -5.317 -4.359
629 HH TYR 89 HH TYR 89 0.352 -8.650 -3.720
630 HA PRO 90 HA PRO 90 -7.571 -6.424 -6.626
631 1HB PRO 90 1HB PRO 90 -8.173 -8.350 -7.709
632 2HB PRO 90 2HB PRO 90 -6.616 -9.129 -7.400
633 1HG PRO 90 1HG PRO 90 -7.338 -7.084 -9.471
634 2HG PRO 90 2HG PRO 90 -6.404 -8.580 -9.661
635 1HD PRO 90 1HD PRO 90 -5.180 -6.215 -9.453
636 2HD PRO 90 2HD PRO 90 -4.516 -7.669 -8.683
637 H VAL 91 H VAL 91 -7.719 -6.449 -4.578
638 HA VAL 91 HA VAL 91 -6.425 -8.520 -3.029
639 HB VAL 91 HB VAL 91 -5.245 -6.525 -2.507
640 1HG1 VAL 91 1HG1 VAL 91 -6.334 -4.461 -1.708
641 2HG1 VAL 91 2HG1 VAL 91 -7.909 -5.185 -2.041
642 3HG1 VAL 91 3HG1 VAL 91 -6.793 -4.852 -3.368
643 1HG2 VAL 91 1HG2 VAL 91 -5.726 -6.201 -0.114
644 2HG2 VAL 91 2HG2 VAL 91 -5.827 -7.912 -0.554
645 3HG2 VAL 91 3HG2 VAL 91 -7.293 -6.967 -0.338
646 H GLU 92 H GLU 92 -7.780 -9.633 -1.881
647 HA GLU 92 HA GLU 92 -10.539 -8.663 -1.800
648 1HB GLU 92 1HB GLU 92 -9.580 -11.498 -1.961
649 2HB GLU 92 2HB GLU 92 -10.189 -10.528 -3.306
650 1HG GLU 92 1HG GLU 92 -12.352 -10.369 -2.226
651 2HG GLU 92 2HG GLU 92 -11.771 -11.379 -0.899
652 H VAL 93 H VAL 93 -11.413 -8.529 -0.010
653 HA VAL 93 HA VAL 93 -9.913 -9.302 2.336
654 HB VAL 93 HB VAL 93 -10.533 -6.930 2.293
655 1HG1 VAL 93 1HG1 VAL 93 -13.404 -7.835 2.257
656 2HG1 VAL 93 2HG1 VAL 93 -12.544 -7.032 0.946
657 3HG1 VAL 93 3HG1 VAL 93 -12.857 -6.170 2.452
658 1HG2 VAL 93 1HG2 VAL 93 -10.378 -7.967 4.488
659 2HG2 VAL 93 2HG2 VAL 93 -12.081 -8.417 4.412
660 3HG2 VAL 93 3HG2 VAL 93 -11.623 -6.716 4.487
661 H LYS 94 H LYS 94 -10.566 -10.771 3.777
662 HA LYS 94 HA LYS 94 -13.064 -12.224 3.249
663 1HB LYS 94 1HB LYS 94 -11.877 -14.225 3.597
664 2HB LYS 94 2HB LYS 94 -10.552 -13.386 4.383
665 1HG LYS 94 1HG LYS 94 -9.867 -14.237 2.269
666 2HG LYS 94 2HG LYS 94 -9.827 -12.473 2.243
667 1HD LYS 94 1HD LYS 94 -10.720 -13.175 0.187
668 2HD LYS 94 2HD LYS 94 -12.021 -12.495 1.162
669 1HE LYS 94 1HE LYS 94 -12.670 -14.736 1.851
670 2HE LYS 94 2HE LYS 94 -11.303 -15.366 0.946
671 1HZ LYS 94 1HZ LYS 94 -13.727 -14.006 -0.162
672 2HZ LYS 94 2HZ LYS 94 -13.328 -15.637 -0.416
673 3HZ LYS 94 3HZ LYS 94 -12.394 -14.412 -1.095
674 H GLY 95 H GLY 95 -14.096 -12.811 5.186
675 1HA GLY 95 1HA GLY 95 -14.454 -13.012 7.498
676 2HA GLY 95 2HA GLY 95 -13.765 -11.402 7.533
677 H ASP 96 H ASP 96 -11.917 -11.115 8.336
678 HA ASP 96 HA ASP 96 -10.115 -11.254 9.644
679 1HB ASP 96 1HB ASP 96 -9.443 -13.068 10.848
680 2HB ASP 96 2HB ASP 96 -10.328 -14.236 9.993
681 H ASP 97 H ASP 97 -10.195 -12.944 6.656
682 HA ASP 97 HA ASP 97 -7.252 -13.211 6.756
683 1HB ASP 97 1HB ASP 97 -7.549 -14.939 4.983
684 2HB ASP 97 2HB ASP 97 -9.273 -14.910 5.285
685 H ILE 98 H ILE 98 -6.107 -12.723 4.740
686 HA ILE 98 HA ILE 98 -7.791 -11.428 2.792
687 HB ILE 98 HB ILE 98 -5.557 -10.117 4.234
688 1HG1 ILE 98 1HG1 ILE 98 -8.019 -9.898 4.721
689 2HG1 ILE 98 2HG1 ILE 98 -8.152 -9.150 3.157
690 1HG2 ILE 98 1HG2 ILE 98 -5.394 -8.361 2.464
691 2HG2 ILE 98 2HG2 ILE 98 -6.461 -9.307 1.432
692 3HG2 ILE 98 3HG2 ILE 98 -4.866 -9.919 1.832
693 1HD1 ILE 98 1HD1 ILE 98 -8.115 -7.483 4.841
694 2HD1 ILE 98 2HD1 ILE 98 -6.697 -7.367 3.772
695 3HD1 ILE 98 3HD1 ILE 98 -6.533 -8.040 5.402
696 H TYR 99 H TYR 99 -7.429 -11.611 0.730
697 HA TYR 99 HA TYR 99 -4.995 -13.091 -0.049
698 1HB TYR 99 1HB TYR 99 -6.319 -14.035 -1.955
699 2HB TYR 99 2HB TYR 99 -7.751 -13.329 -1.247
700 HD1 TYR 99 1HD TYR 99 -8.715 -14.252 0.754
701 HD2 TYR 99 2HD TYR 99 -5.283 -16.010 -0.964
702 HE1 TYR 99 1HE TYR 99 -9.079 -16.276 2.129
703 HE2 TYR 99 2HE TYR 99 -5.615 -18.034 0.391
704 HH TYR 99 HH TYR 99 -6.720 -18.697 2.459
705 H VAL 100 H VAL 100 -3.971 -12.486 -1.907
706 HA VAL 100 HA VAL 100 -4.998 -10.146 -3.348
707 HB VAL 100 HB VAL 100 -2.775 -9.106 -3.357
708 1HG1 VAL 100 1HG1 VAL 100 -3.764 -9.636 -0.593
709 2HG1 VAL 100 2HG1 VAL 100 -4.256 -8.342 -1.696
710 3HG1 VAL 100 3HG1 VAL 100 -2.618 -8.374 -1.049
711 1HG2 VAL 100 1HG2 VAL 100 -1.362 -11.081 -3.134
712 2HG2 VAL 100 2HG2 VAL 100 -1.949 -11.329 -1.494
713 3HG2 VAL 100 3HG2 VAL 100 -0.971 -9.907 -1.874
714 H SER 101 H SER 101 -4.441 -10.088 -5.567
715 HA SER 101 HA SER 101 -2.666 -12.217 -6.488
716 1HB SER 101 1HB SER 101 -5.287 -11.473 -7.815
717 2HB SER 101 2HB SER 101 -4.990 -12.953 -6.904
718 HG SER 101 HG SER 101 -4.703 -13.428 -9.015
719 H THR 102 H THR 102 -1.031 -11.320 -7.535
720 HA THR 102 HA THR 102 -1.337 -8.626 -8.598
721 HB THR 102 HB THR 102 0.620 -9.048 -7.152
722 HG1 THR 102 1HG THR 102 0.916 -8.268 -9.804
723 1HG2 THR 102 1HG2 THR 102 1.478 -11.026 -9.274
724 2HG2 THR 102 2HG2 THR 102 0.966 -11.421 -7.633
725 3HG2 THR 102 3HG2 THR 102 2.455 -10.513 -7.897
726 H LYS 103 H LYS 103 -2.092 -11.470 -9.734
727 HA LYS 103 HA LYS 103 -0.622 -11.657 -12.157
728 1HB LYS 103 1HB LYS 103 -3.182 -12.975 -11.262
729 2HB LYS 103 2HB LYS 103 -1.565 -13.634 -11.094
730 1HG LYS 103 1HG LYS 103 -1.371 -13.714 -13.551
731 2HG LYS 103 2HG LYS 103 -3.035 -13.146 -13.671
732 1HD LYS 103 1HD LYS 103 -3.774 -15.096 -12.378
733 2HD LYS 103 2HD LYS 103 -2.114 -15.692 -12.335
734 1HE LYS 103 1HE LYS 103 -3.318 -16.831 -14.077
735 2HE LYS 103 2HE LYS 103 -2.110 -15.768 -14.795
736 1HZ LYS 103 1HZ LYS 103 -4.229 -15.637 -15.948
737 2HZ LYS 103 2HZ LYS 103 -3.865 -14.144 -15.243
738 3HZ LYS 103 3HZ LYS 103 -5.000 -15.174 -14.526
739 H GLY 104 H GLY 104 -0.775 -10.193 -13.649
740 1HA GLY 104 1HA GLY 104 -3.455 -9.284 -14.431
741 2HA GLY 104 2HA GLY 104 -2.111 -9.489 -15.550
742 H ILE 105 H ILE 105 -1.235 -8.214 -12.536
743 HA ILE 105 HA ILE 105 -1.222 -5.538 -13.699
744 HB ILE 105 HB ILE 105 -1.582 -6.240 -10.758
745 1HG1 ILE 105 1HG1 ILE 105 -3.363 -4.712 -12.686
746 2HG1 ILE 105 2HG1 ILE 105 -3.632 -4.751 -10.953
747 1HG2 ILE 105 1HG2 ILE 105 -1.584 -3.822 -10.277
748 2HG2 ILE 105 2HG2 ILE 105 -1.097 -3.516 -11.945
749 3HG2 ILE 105 3HG2 ILE 105 -0.028 -4.409 -10.866
750 1HD1 ILE 105 1HD1 ILE 105 -3.979 -7.139 -11.028
751 2HD1 ILE 105 2HD1 ILE 105 -3.729 -7.132 -12.775
752 3HD1 ILE 105 3HD1 ILE 105 -5.111 -6.279 -12.072
753 H LEU 106 H LEU 106 0.701 -4.790 -14.143
754 HA LEU 106 HA LEU 106 3.018 -5.970 -12.949
755 1HB LEU 106 1HB LEU 106 4.119 -4.557 -14.711
756 2HB LEU 106 2HB LEU 106 2.536 -4.115 -15.278
757 HG LEU 106 HG LEU 106 3.576 -6.954 -15.313
758 1HD1 LEU 106 1HD1 LEU 106 1.164 -5.749 -16.652
759 2HD1 LEU 106 2HD1 LEU 106 1.150 -6.853 -15.278
760 3HD1 LEU 106 3HD1 LEU 106 1.735 -7.407 -16.848
761 1HD2 LEU 106 1HD2 LEU 106 4.921 -5.592 -16.785
762 2HD2 LEU 106 2HD2 LEU 106 3.469 -4.936 -17.544
763 3HD2 LEU 106 3HD2 LEU 106 3.864 -6.646 -17.724
764 HA PRO 107 HA PRO 107 3.652 -2.603 -10.104
765 1HB PRO 107 1HB PRO 107 5.734 -3.305 -9.495
766 2HB PRO 107 2HB PRO 107 6.323 -2.080 -10.620
767 1HG PRO 107 1HG PRO 107 6.925 -4.674 -10.933
768 2HG PRO 107 2HG PRO 107 6.637 -3.619 -12.328
769 1HD PRO 107 1HD PRO 107 4.773 -5.575 -11.017
770 2HD PRO 107 2HD PRO 107 5.101 -5.314 -12.749
771 H ASN 108 H ASN 108 3.321 -0.532 -10.250
772 HA ASN 108 HA ASN 108 3.302 0.673 -12.851
773 1HB ASN 108 1HB ASN 108 2.463 1.775 -10.146
774 2HB ASN 108 2HB ASN 108 1.430 0.931 -11.296
775 1HD2 ASN 108 1HD2 ASN 108 0.955 3.508 -10.244
776 2HD2 ASN 108 2HD2 ASN 108 0.920 4.564 -11.603
777 H LYS 109 H LYS 109 4.231 2.830 -13.159
778 HA LYS 109 HA LYS 109 6.958 2.507 -12.923
779 1HB LYS 109 1HB LYS 109 7.177 4.731 -13.932
780 2HB LYS 109 2HB LYS 109 5.452 4.912 -13.667
781 1HG LYS 109 1HG LYS 109 5.030 2.970 -15.117
782 2HG LYS 109 2HG LYS 109 6.754 2.706 -15.304
783 1HD LYS 109 1HD LYS 109 6.968 4.848 -16.450
784 2HD LYS 109 2HD LYS 109 5.224 5.089 -16.297
785 1HE LYS 109 1HE LYS 109 6.600 2.824 -17.752
786 2HE LYS 109 2HE LYS 109 5.806 4.202 -18.508
787 1HZ LYS 109 1HZ LYS 109 4.439 2.138 -16.844
788 2HZ LYS 109 2HZ LYS 109 4.351 2.264 -18.514
789 3HZ LYS 109 3HZ LYS 109 3.710 3.475 -17.549
790 H ALA 110 H ALA 110 7.991 2.534 -11.455
791 HA ALA 110 HA ALA 110 9.019 4.541 -9.878
792 1HB ALA 110 1HB ALA 110 8.107 4.003 -7.621
793 2HB ALA 110 2HB ALA 110 6.963 2.882 -8.359
794 3HB ALA 110 3HB ALA 110 6.839 4.608 -8.687
795 H HIS 111 H HIS 111 7.865 1.429 -8.984
796 HA HIS 111 HA HIS 111 8.852 -0.495 -8.225
797 1HB HIS 111 1HB HIS 111 10.043 -0.214 -10.984
798 2HB HIS 111 2HB HIS 111 8.516 -0.956 -10.566
799 HD1 HIS 111 1HD HIS 111 12.188 -1.789 -10.862
800 HD2 HIS 111 2HD HIS 111 8.696 -3.533 -9.371
801 HE1 HIS 111 1HE HIS 111 12.698 -4.200 -10.579
802 HE2 HIS 111 2HE HIS 111 10.615 -5.230 -9.635
803 H SER 112 H SER 112 11.697 0.354 -9.994
804 HA SER 112 HA SER 112 13.490 1.034 -8.079
805 1HB SER 112 1HB SER 112 13.379 -2.001 -8.440
806 2HB SER 112 2HB SER 112 12.844 -1.182 -6.980
807 HG SER 112 HG SER 112 14.825 -1.755 -6.518
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