NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
5383 |
1haj   |
4195 | cing | 1-original | 1 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ILE 1 H1 ILE 1 -17.054 4.822 -0.661
2 H2 ILE 1 H2 ILE 1 -16.727 3.207 -0.183
3 H3 ILE 1 H3 ILE 1 -17.927 4.119 0.636
4 HA ILE 1 HA ILE 1 -16.444 5.406 1.709
5 HB ILE 1 HB ILE 1 -16.262 2.743 2.030
6 1HG1 ILE 1 1HG1 ILE 1 -14.280 4.389 3.534
7 2HG1 ILE 1 2HG1 ILE 1 -15.983 4.828 3.626
8 1HG2 ILE 1 1HG2 ILE 1 -14.267 2.811 0.405
9 2HG2 ILE 1 2HG2 ILE 1 -13.372 3.456 1.781
10 3HG2 ILE 1 3HG2 ILE 1 -14.125 1.865 1.886
11 1HD1 ILE 1 1HD1 ILE 1 -16.433 2.452 4.320
12 2HD1 ILE 1 2HD1 ILE 1 -14.686 2.260 4.476
13 3HD1 ILE 1 3HD1 ILE 1 -15.537 3.439 5.474
14 H VAL 2 H VAL 2 -13.854 5.566 2.087
15 HA VAL 2 HA VAL 2 -12.699 6.198 -0.542
16 HB VAL 2 HB VAL 2 -12.314 7.788 2.002
17 1HG1 VAL 2 1HG1 VAL 2 -10.585 7.582 -0.100
18 2HG1 VAL 2 2HG1 VAL 2 -11.554 8.981 -0.561
19 3HG1 VAL 2 3HG1 VAL 2 -10.703 8.968 0.984
20 1HG2 VAL 2 1HG2 VAL 2 -14.285 7.957 -0.149
21 2HG2 VAL 2 2HG2 VAL 2 -14.312 8.649 1.473
22 3HG2 VAL 2 3HG2 VAL 2 -13.448 9.475 0.176
23 H CYS 3 H CYS 3 -10.752 5.368 -0.933
24 HA CYS 3 HA CYS 3 -9.195 4.332 1.345
25 1HB CYS 3 1HB CYS 3 -9.513 3.023 -1.366
26 2HB CYS 3 2HB CYS 3 -8.525 2.417 -0.043
27 H HIS 4 H HIS 4 -6.889 3.941 0.788
28 HA HIS 4 HA HIS 4 -5.874 6.259 -0.654
29 1HB HIS 4 1HB HIS 4 -4.388 4.261 1.055
30 2HB HIS 4 2HB HIS 4 -3.756 5.786 0.447
31 HD1 HIS 4 HD1 HIS 4 -5.572 7.875 1.243
32 HD2 HIS 4 HD2 HIS 4 -5.061 4.538 3.664
33 HE1 HIS 4 HE1 HIS 4 -6.320 8.579 3.533
34 HE2 HIS 4 HE2 HIS 4 -5.799 6.608 5.012
35 H THR 5 H THR 5 -4.707 6.166 -2.489
36 HA THR 5 HA THR 5 -4.118 3.496 -3.575
37 HB THR 5 HB THR 5 -5.958 5.174 -4.629
38 HG1 THR 5 HG1 THR 5 -5.381 2.976 -5.229
39 1HG2 THR 5 1HG2 THR 5 -3.435 5.717 -6.177
40 2HG2 THR 5 2HG2 THR 5 -5.073 6.119 -6.696
41 3HG2 THR 5 3HG2 THR 5 -4.382 6.901 -5.274
42 H THR 6 H THR 6 -2.329 3.327 -4.968
43 HA THR 6 HA THR 6 -0.346 5.490 -4.720
44 HB THR 6 HB THR 6 1.321 3.478 -4.692
45 HG1 THR 6 HG1 THR 6 0.020 1.753 -4.853
46 1HG2 THR 6 1HG2 THR 6 -0.165 4.702 -2.463
47 2HG2 THR 6 2HG2 THR 6 0.748 3.237 -2.101
48 3HG2 THR 6 3HG2 THR 6 1.569 4.642 -2.779
49 H ALA 7 H ALA 7 -2.221 4.359 -6.908
50 HA ALA 7 HA ALA 7 -0.301 3.468 -8.905
51 1HB ALA 7 1HB ALA 7 -2.903 2.815 -8.471
52 2HB ALA 7 2HB ALA 7 -2.041 2.558 -9.988
53 3HB ALA 7 3HB ALA 7 -3.050 3.989 -9.779
54 H THR 8 H THR 8 0.247 6.038 -8.061
55 HA THR 8 HA THR 8 0.035 7.493 -10.553
56 HB THR 8 HB THR 8 -1.284 9.231 -9.891
57 HG1 THR 8 HG1 THR 8 -0.711 8.934 -7.150
58 1HG2 THR 8 1HG2 THR 8 -2.675 7.233 -9.360
59 2HG2 THR 8 2HG2 THR 8 -2.176 7.407 -7.675
60 3HG2 THR 8 3HG2 THR 8 -3.101 8.688 -8.459
61 H SER 9 H SER 9 1.052 9.943 -9.743
62 HA SER 9 HA SER 9 3.754 9.234 -9.149
63 1HB SER 9 1HB SER 9 4.049 11.193 -10.220
64 2HB SER 9 2HB SER 9 2.355 11.630 -10.011
65 HG SER 9 HG SER 9 4.532 12.528 -8.688
66 HA PRO 10 HA PRO 10 2.852 10.778 -4.796
67 1HB PRO 10 1HB PRO 10 0.765 12.536 -4.413
68 2HB PRO 10 2HB PRO 10 2.413 13.015 -4.809
69 1HG PRO 10 1HG PRO 10 0.081 13.317 -6.425
70 2HG PRO 10 2HG PRO 10 1.751 13.708 -6.862
71 1HD PRO 10 1HD PRO 10 0.148 11.285 -7.485
72 2HD PRO 10 2HD PRO 10 1.465 12.034 -8.403
73 H ILE 11 H ILE 11 1.591 10.006 -2.996
74 HA ILE 11 HA ILE 11 -0.477 8.162 -3.808
75 HB ILE 11 HB ILE 11 -0.449 7.382 -1.513
76 1HG1 ILE 11 1HG1 ILE 11 1.581 9.566 -1.045
77 2HG1 ILE 11 2HG1 ILE 11 -0.051 9.514 -0.382
78 1HG2 ILE 11 1HG2 ILE 11 1.220 6.609 -3.209
79 2HG2 ILE 11 2HG2 ILE 11 2.374 7.724 -2.478
80 3HG2 ILE 11 3HG2 ILE 11 1.710 6.395 -1.528
81 1HD1 ILE 11 1HD1 ILE 11 1.292 7.087 0.245
82 2HD1 ILE 11 2HD1 ILE 11 2.300 8.456 0.718
83 3HD1 ILE 11 3HD1 ILE 11 0.652 8.321 1.333
84 H SER 12 H SER 12 -2.596 8.442 -3.613
85 HA SER 12 HA SER 12 -3.591 10.577 -1.854
86 1HB SER 12 1HB SER 12 -5.343 10.791 -3.907
87 2HB SER 12 2HB SER 12 -3.902 11.794 -3.752
88 HG SER 12 HG SER 12 -4.510 10.139 -5.708
89 H ALA 13 H ALA 13 -6.234 10.422 -2.219
90 HA ALA 13 HA ALA 13 -7.006 7.608 -2.015
91 1HB ALA 13 1HB ALA 13 -6.631 9.228 0.238
92 2HB ALA 13 2HB ALA 13 -7.404 7.644 0.170
93 3HB ALA 13 3HB ALA 13 -8.377 9.107 0.019
94 H VAL 14 H VAL 14 -8.899 7.185 -2.971
95 HA VAL 14 HA VAL 14 -10.636 9.466 -3.662
96 HB VAL 14 HB VAL 14 -9.327 8.139 -5.528
97 1HG1 VAL 14 1HG1 VAL 14 -10.510 5.990 -4.562
98 2HG1 VAL 14 2HG1 VAL 14 -11.807 6.507 -5.641
99 3HG1 VAL 14 3HG1 VAL 14 -10.201 6.169 -6.290
100 1HG2 VAL 14 1HG2 VAL 14 -11.496 9.809 -5.494
101 2HG2 VAL 14 2HG2 VAL 14 -10.640 9.268 -6.938
102 3HG2 VAL 14 3HG2 VAL 14 -12.091 8.419 -6.402
103 H THR 15 H THR 15 -12.813 8.254 -4.593
104 HA THR 15 HA THR 15 -13.778 6.664 -2.325
105 HB THR 15 HB THR 15 -15.080 8.730 -4.076
106 HG1 THR 15 HG1 THR 15 -15.082 9.802 -2.285
107 1HG2 THR 15 1HG2 THR 15 -16.504 6.677 -2.417
108 2HG2 THR 15 2HG2 THR 15 -17.232 8.183 -2.978
109 3HG2 THR 15 3HG2 THR 15 -16.681 6.981 -4.145
110 H CYS 16 H CYS 16 -13.875 4.584 -2.865
111 HA CYS 16 HA CYS 16 -13.874 3.574 -5.474
112 1HB CYS 16 1HB CYS 16 -15.070 1.918 -3.299
113 2HB CYS 16 2HB CYS 16 -13.928 1.470 -4.556
114 HA PRO 17 HA PRO 17 -18.149 4.222 -6.537
115 1HB PRO 17 1HB PRO 17 -18.137 2.916 -8.905
116 2HB PRO 17 2HB PRO 17 -17.394 4.505 -8.695
117 1HG PRO 17 1HG PRO 17 -16.112 1.804 -8.756
118 2HG PRO 17 2HG PRO 17 -15.567 3.321 -9.495
119 1HD PRO 17 1HD PRO 17 -14.561 2.344 -7.157
120 2HD PRO 17 2HD PRO 17 -14.623 4.074 -7.543
121 HA PRO 18 HA PRO 18 -20.724 0.771 -5.570
122 1HB PRO 18 1HB PRO 18 -21.594 0.606 -8.422
123 2HB PRO 18 2HB PRO 18 -22.569 0.664 -6.949
124 1HG PRO 18 1HG PRO 18 -22.312 2.822 -8.480
125 2HG PRO 18 2HG PRO 18 -22.312 2.959 -6.711
126 1HD PRO 18 1HD PRO 18 -20.038 3.147 -8.628
127 2HD PRO 18 2HD PRO 18 -20.296 4.000 -7.094
128 H GLY 19 H GLY 19 -18.635 -0.471 -5.394
129 1HA GLY 19 1HA GLY 19 -17.593 -2.053 -7.446
130 2HA GLY 19 2HA GLY 19 -18.863 -2.980 -6.660
131 H GLU 20 H GLU 20 -16.586 -0.675 -5.207
132 HA GLU 20 HA GLU 20 -15.537 -2.901 -3.575
133 1HB GLU 20 1HB GLU 20 -13.928 -0.443 -4.097
134 2HB GLU 20 2HB GLU 20 -13.381 -2.058 -3.683
135 1HG GLU 20 1HG GLU 20 -13.773 -2.848 -5.885
136 2HG GLU 20 2HG GLU 20 -14.631 -1.373 -6.328
137 H ASN 21 H ASN 21 -15.482 -2.648 -1.452
138 HA ASN 21 HA ASN 21 -16.303 -0.059 -0.333
139 1HB ASN 21 1HB ASN 21 -17.578 -2.597 -0.134
140 2HB ASN 21 2HB ASN 21 -17.053 -2.086 1.459
141 2HD2 ASN 21 2HD2 ASN 21 -19.558 -2.274 1.390
142 1HD2 ASN 21 1HD2 ASN 21 -20.367 -0.772 1.164
143 H LEU 22 H LEU 22 -14.068 -2.638 -0.300
144 HA LEU 22 HA LEU 22 -12.957 -1.772 2.269
145 1HB LEU 22 1HB LEU 22 -12.285 -4.244 0.692
146 2HB LEU 22 2HB LEU 22 -11.851 -3.887 2.344
147 HG LEU 22 HG LEU 22 -14.731 -4.106 1.568
148 1HD1 LEU 22 1HD1 LEU 22 -13.256 -6.130 0.861
149 2HD1 LEU 22 2HD1 LEU 22 -13.229 -6.473 2.591
150 3HD1 LEU 22 3HD1 LEU 22 -14.767 -6.401 1.730
151 1HD2 LEU 22 1HD2 LEU 22 -13.120 -4.112 4.058
152 2HD2 LEU 22 2HD2 LEU 22 -14.688 -3.379 3.723
153 3HD2 LEU 22 3HD2 LEU 22 -14.571 -5.114 4.017
154 H CYS 23 H CYS 23 -10.599 -1.712 2.433
155 HA CYS 23 HA CYS 23 -9.361 -0.742 -0.060
156 1HB CYS 23 1HB CYS 23 -8.377 -0.035 2.692
157 2HB CYS 23 2HB CYS 23 -8.119 0.820 1.178
158 H TYR 24 H TYR 24 -6.869 -0.996 0.008
159 HA TYR 24 HA TYR 24 -6.011 -3.290 1.552
160 1HB TYR 24 1HB TYR 24 -5.520 -4.749 -0.191
161 2HB TYR 24 2HB TYR 24 -7.096 -4.105 -0.622
162 HD1 TYR 24 HD1 TYR 24 -3.450 -3.422 -1.268
163 HD2 TYR 24 HD2 TYR 24 -7.431 -3.399 -2.788
164 HE1 TYR 24 HE1 TYR 24 -2.596 -2.808 -3.482
165 HE2 TYR 24 HE2 TYR 24 -6.579 -2.776 -5.008
166 HH TYR 24 HH TYR 24 -3.889 -3.201 -6.132
167 H ARG 25 H ARG 25 -3.853 -3.549 1.772
168 HA ARG 25 HA ARG 25 -2.064 -1.615 0.487
169 1HB ARG 25 1HB ARG 25 -2.516 -0.614 2.621
170 2HB ARG 25 2HB ARG 25 -2.329 -2.151 3.450
171 1HG ARG 25 1HG ARG 25 0.042 -2.152 3.001
172 2HG ARG 25 2HG ARG 25 -0.112 -0.678 2.043
173 1HD ARG 25 1HD ARG 25 0.700 -0.472 4.474
174 2HD ARG 25 2HD ARG 25 -0.542 0.640 3.910
175 HE ARG 25 HE ARG 25 -2.168 -0.650 5.121
176 1HH1 ARG 25 1HH1 ARG 25 1.165 -1.434 5.839
177 2HH1 ARG 25 2HH1 ARG 25 0.788 -2.165 7.360
178 1HH2 ARG 25 1HH2 ARG 25 -2.651 -1.611 7.119
179 2HH2 ARG 25 2HH2 ARG 25 -1.372 -2.266 8.087
180 H LYS 26 H LYS 26 -0.656 -2.850 -0.600
181 HA LYS 26 HA LYS 26 -0.094 -5.546 0.334
182 1HB LYS 26 1HB LYS 26 -0.597 -5.029 -2.062
183 2HB LYS 26 2HB LYS 26 0.940 -4.189 -2.149
184 1HG LYS 26 1HG LYS 26 1.367 -6.787 -1.055
185 2HG LYS 26 2HG LYS 26 0.421 -6.928 -2.539
186 1HD LYS 26 1HD LYS 26 2.968 -5.329 -2.320
187 2HD LYS 26 2HD LYS 26 2.908 -7.009 -2.859
188 1HE LYS 26 1HE LYS 26 1.156 -6.144 -4.559
189 2HE LYS 26 2HE LYS 26 1.824 -4.554 -4.190
190 1HZ LYS 26 1HZ LYS 26 3.473 -6.854 -5.077
191 2HZ LYS 26 2HZ LYS 26 2.846 -5.693 -6.136
192 3HZ LYS 26 3HZ LYS 26 3.953 -5.237 -4.941
193 H MET 27 H MET 27 1.899 -6.371 0.827
194 HA MET 27 HA MET 27 4.183 -4.576 0.946
195 1HB MET 27 1HB MET 27 2.869 -5.791 3.343
196 2HB MET 27 2HB MET 27 4.589 -5.447 3.351
197 1HG MET 27 1HG MET 27 4.258 -3.280 3.681
198 2HG MET 27 2HG MET 27 3.036 -3.189 2.415
199 1HE MET 27 1HE MET 27 4.046 -3.456 5.868
200 2HE MET 27 2HE MET 27 3.055 -2.009 6.047
201 3HE MET 27 3HE MET 27 2.598 -3.498 6.873
202 H TRP 28 H TRP 28 6.069 -5.550 0.643
203 HA TRP 28 HA TRP 28 6.638 -8.263 1.285
204 1HB TRP 28 1HB TRP 28 6.882 -9.171 -1.004
205 2HB TRP 28 2HB TRP 28 5.208 -8.816 -0.605
206 HD1 TRP 28 HD1 TRP 28 5.468 -5.650 -1.240
207 HE1 TRP 28 HE1 TRP 28 5.490 -4.909 -3.707
208 HE3 TRP 28 HE3 TRP 28 6.898 -10.054 -3.383
209 HZ2 TRP 28 HZ2 TRP 28 6.060 -6.039 -6.220
210 HZ3 TRP 28 HZ3 TRP 28 7.165 -10.144 -5.829
211 HH2 TRP 28 HH2 TRP 28 6.752 -8.177 -7.218
212 H CYS 29 H CYS 29 8.764 -8.271 1.679
213 HA CYS 29 HA CYS 29 10.353 -6.094 1.169
214 1HB CYS 29 1HB CYS 29 11.327 -8.874 1.741
215 2HB CYS 29 2HB CYS 29 12.298 -7.432 1.794
216 H ASP 30 H ASP 30 10.977 -5.322 -0.689
217 HA ASP 30 HA ASP 30 11.565 -7.026 -2.946
218 1HB ASP 30 1HB ASP 30 12.288 -4.918 -4.055
219 2HB ASP 30 2HB ASP 30 10.658 -4.793 -3.411
220 H ALA 31 H ALA 31 13.705 -7.385 -3.700
221 HA ALA 31 HA ALA 31 15.563 -8.261 -2.032
222 1HB ALA 31 1HB ALA 31 16.934 -8.472 -3.803
223 2HB ALA 31 2HB ALA 31 15.518 -7.915 -4.693
224 3HB ALA 31 3HB ALA 31 16.790 -6.774 -4.257
225 H PHE 32 H PHE 32 14.944 -6.432 -0.397
226 HA PHE 32 HA PHE 32 17.328 -5.202 0.336
227 1HB PHE 32 1HB PHE 32 15.613 -3.654 -1.370
228 2HB PHE 32 2HB PHE 32 15.732 -2.913 0.210
229 HD1 PHE 32 HD1 PHE 32 18.216 -2.881 1.182
230 HD2 PHE 32 HD2 PHE 32 17.182 -3.051 -2.939
231 HE1 PHE 32 HE1 PHE 32 20.422 -1.961 0.597
232 HE2 PHE 32 HE2 PHE 32 19.385 -2.132 -3.535
233 HZ PHE 32 HZ PHE 32 21.009 -1.586 -1.766
234 H CYS 33 H CYS 33 14.966 -6.875 1.327
235 HA CYS 33 HA CYS 33 13.280 -5.718 3.079
236 1HB CYS 33 1HB CYS 33 13.763 -8.214 2.652
237 2HB CYS 33 2HB CYS 33 14.884 -8.075 3.999
238 H SER 34 H SER 34 16.738 -5.749 3.381
239 HA SER 34 HA SER 34 16.786 -4.938 6.137
240 1HB SER 34 1HB SER 34 18.669 -5.954 4.392
241 2HB SER 34 2HB SER 34 19.147 -4.262 4.531
242 HG SER 34 HG SER 34 18.933 -4.653 6.889
243 H SER 35 H SER 35 17.594 -3.266 3.070
244 HA SER 35 HA SER 35 17.303 -0.685 4.398
245 1HB SER 35 1HB SER 35 18.980 -1.568 2.374
246 2HB SER 35 2HB SER 35 17.788 -0.595 1.514
247 HG SER 35 HG SER 35 18.928 1.027 2.192
248 H ARG 36 H ARG 36 16.261 -1.560 1.093
249 HA ARG 36 HA ARG 36 13.899 0.017 1.342
250 1HB ARG 36 1HB ARG 36 14.240 -2.098 -0.760
251 2HB ARG 36 2HB ARG 36 13.413 -0.573 -0.874
252 1HG ARG 36 1HG ARG 36 15.535 0.616 -0.834
253 2HG ARG 36 2HG ARG 36 16.391 -0.920 -0.711
254 1HD ARG 36 1HD ARG 36 16.043 -1.443 -2.891
255 2HD ARG 36 2HD ARG 36 14.472 -0.653 -2.938
256 HE ARG 36 HE ARG 36 16.425 1.325 -2.693
257 1HH1 ARG 36 1HH1 ARG 36 15.374 -1.063 -5.010
258 2HH1 ARG 36 2HH1 ARG 36 15.892 -0.144 -6.382
259 1HH2 ARG 36 1HH2 ARG 36 17.109 2.537 -4.498
260 2HH2 ARG 36 2HH2 ARG 36 16.879 1.900 -6.092
261 H GLY 37 H GLY 37 13.874 -3.468 0.352
262 1HA GLY 37 1HA GLY 37 12.491 -4.143 2.760
263 2HA GLY 37 2HA GLY 37 12.826 -5.202 1.405
264 H LYS 38 H LYS 38 10.452 -4.616 3.143
265 HA LYS 38 HA LYS 38 8.516 -5.405 1.475
266 1HB LYS 38 1HB LYS 38 7.479 -3.558 3.472
267 2HB LYS 38 2HB LYS 38 7.075 -5.229 3.154
268 1HG LYS 38 1HG LYS 38 9.543 -5.488 4.241
269 2HG LYS 38 2HG LYS 38 8.937 -4.072 5.096
270 1HD LYS 38 1HD LYS 38 7.536 -6.737 4.875
271 2HD LYS 38 2HD LYS 38 8.418 -6.152 6.287
272 1HE LYS 38 1HE LYS 38 6.635 -5.034 6.997
273 2HE LYS 38 2HE LYS 38 6.502 -4.187 5.456
274 1HZ LYS 38 1HZ LYS 38 5.519 -6.582 4.813
275 2HZ LYS 38 2HZ LYS 38 5.042 -6.493 6.434
276 3HZ LYS 38 3HZ LYS 38 4.565 -5.290 5.343
277 H VAL 39 H VAL 39 8.021 -4.622 -0.406
278 HA VAL 39 HA VAL 39 7.957 -1.828 -0.993
279 HB VAL 39 HB VAL 39 6.743 -4.130 -2.522
280 1HG1 VAL 39 1HG1 VAL 39 7.086 -1.237 -3.158
281 2HG1 VAL 39 2HG1 VAL 39 7.070 -2.441 -4.447
282 3HG1 VAL 39 3HG1 VAL 39 5.676 -2.271 -3.381
283 1HG2 VAL 39 1HG2 VAL 39 9.248 -4.166 -2.132
284 2HG2 VAL 39 2HG2 VAL 39 8.697 -4.258 -3.805
285 3HG2 VAL 39 3HG2 VAL 39 9.312 -2.736 -3.162
286 H VAL 40 H VAL 40 6.228 -0.472 -0.940
287 HA VAL 40 HA VAL 40 3.800 -1.529 0.314
288 HB VAL 40 HB VAL 40 4.648 1.359 0.128
289 1HG1 VAL 40 1HG1 VAL 40 2.383 -0.092 1.334
290 2HG1 VAL 40 2HG1 VAL 40 3.118 1.166 2.329
291 3HG1 VAL 40 3HG1 VAL 40 2.483 1.563 0.731
292 1HG2 VAL 40 1HG2 VAL 40 5.621 -0.786 1.838
293 2HG2 VAL 40 2HG2 VAL 40 6.264 0.834 1.578
294 3HG2 VAL 40 3HG2 VAL 40 4.974 0.578 2.751
295 H GLU 41 H GLU 41 1.999 -1.662 -0.758
296 HA GLU 41 HA GLU 41 1.596 -0.021 -3.170
297 1HB GLU 41 1HB GLU 41 1.874 -2.723 -3.203
298 2HB GLU 41 2HB GLU 41 0.135 -2.582 -2.993
299 1HG GLU 41 1HG GLU 41 1.384 -0.910 -5.089
300 2HG GLU 41 2HG GLU 41 1.299 -2.647 -5.379
301 H LEU 42 H LEU 42 -0.763 0.294 -3.676
302 HA LEU 42 HA LEU 42 -2.527 0.118 -1.360
303 1HB LEU 42 1HB LEU 42 -1.147 2.494 -2.115
304 2HB LEU 42 2HB LEU 42 -2.848 2.728 -2.452
305 HG LEU 42 HG LEU 42 -3.424 2.294 -0.158
306 1HD1 LEU 42 1HD1 LEU 42 -0.514 1.610 0.135
307 2HD1 LEU 42 2HD1 LEU 42 -1.555 1.978 1.511
308 3HD1 LEU 42 3HD1 LEU 42 -1.914 0.594 0.478
309 1HD2 LEU 42 1HD2 LEU 42 -2.707 4.568 -0.777
310 2HD2 LEU 42 2HD2 LEU 42 -2.361 4.186 0.910
311 3HD2 LEU 42 3HD2 LEU 42 -1.063 4.162 -0.283
312 H GLY 43 H GLY 43 -4.755 0.429 -1.844
313 1HA GLY 43 1HA GLY 43 -5.484 -0.491 -4.463
314 2HA GLY 43 2HA GLY 43 -5.914 1.189 -4.207
315 H CYS 44 H CYS 44 -8.093 0.351 -4.581
316 HA CYS 44 HA CYS 44 -9.327 -0.396 -2.035
317 1HB CYS 44 1HB CYS 44 -10.107 1.610 -3.383
318 2HB CYS 44 2HB CYS 44 -10.730 0.467 -4.567
319 H ALA 45 H ALA 45 -11.103 -1.972 -2.042
320 HA ALA 45 HA ALA 45 -11.327 -3.815 -4.235
321 1HB ALA 45 1HB ALA 45 -9.169 -4.423 -3.003
322 2HB ALA 45 2HB ALA 45 -10.331 -5.715 -3.302
323 3HB ALA 45 3HB ALA 45 -10.220 -4.982 -1.702
324 H ALA 46 H ALA 46 -12.712 -5.758 -3.549
325 HA ALA 46 HA ALA 46 -14.819 -4.761 -1.754
326 1HB ALA 46 1HB ALA 46 -16.397 -5.688 -3.108
327 2HB ALA 46 2HB ALA 46 -15.138 -5.400 -4.309
328 3HB ALA 46 3HB ALA 46 -15.346 -7.009 -3.616
329 H THR 47 H THR 47 -12.627 -7.395 -2.348
330 HA THR 47 HA THR 47 -13.721 -8.803 -0.002
331 HB THR 47 HB THR 47 -12.249 -10.712 -1.248
332 HG1 THR 47 HG1 THR 47 -11.959 -9.182 -3.028
333 1HG2 THR 47 1HG2 THR 47 -14.556 -10.999 -0.511
334 2HG2 THR 47 2HG2 THR 47 -15.114 -10.078 -1.908
335 3HG2 THR 47 3HG2 THR 47 -14.306 -11.628 -2.140
336 H CYS 48 H CYS 48 -11.820 -10.442 0.750
337 HA CYS 48 HA CYS 48 -9.333 -8.907 0.972
338 1HB CYS 48 1HB CYS 48 -10.681 -8.471 2.978
339 2HB CYS 48 2HB CYS 48 -10.757 -10.198 3.274
340 HA PRO 49 HA PRO 49 -8.338 -13.255 -0.105
341 1HB PRO 49 1HB PRO 49 -6.258 -12.683 -1.723
342 2HB PRO 49 2HB PRO 49 -7.934 -12.589 -2.275
343 1HG PRO 49 1HG PRO 49 -6.110 -10.391 -1.379
344 2HG PRO 49 2HG PRO 49 -7.217 -10.430 -2.764
345 1HD PRO 49 1HD PRO 49 -7.821 -9.201 -0.412
346 2HD PRO 49 2HD PRO 49 -9.049 -9.922 -1.471
347 H SER 50 H SER 50 -6.254 -14.458 0.104
348 HA SER 50 HA SER 50 -4.371 -13.191 1.969
349 1HB SER 50 1HB SER 50 -4.395 -15.715 2.946
350 2HB SER 50 2HB SER 50 -5.395 -14.416 3.595
351 HG SER 50 HG SER 50 -7.134 -15.252 2.647
352 H LYS 51 H LYS 51 -2.268 -14.191 2.032
353 HA LYS 51 HA LYS 51 -1.622 -16.262 0.153
354 1HB LYS 51 1HB LYS 51 0.119 -14.145 -0.589
355 2HB LYS 51 2HB LYS 51 -0.976 -15.068 -1.599
356 1HG LYS 51 1HG LYS 51 -2.713 -13.514 -1.328
357 2HG LYS 51 2HG LYS 51 -1.909 -12.732 0.032
358 1HD LYS 51 1HD LYS 51 -0.771 -11.367 -1.320
359 2HD LYS 51 2HD LYS 51 -0.255 -12.706 -2.347
360 1HE LYS 51 1HE LYS 51 -2.214 -12.578 -3.662
361 2HE LYS 51 2HE LYS 51 -3.017 -11.526 -2.496
362 1HZ LYS 51 1HZ LYS 51 -0.528 -10.536 -3.633
363 2HZ LYS 51 2HZ LYS 51 -1.847 -10.623 -4.689
364 3HZ LYS 51 3HZ LYS 51 -1.958 -9.709 -3.271
365 H LYS 52 H LYS 52 0.945 -16.297 -0.061
366 HA LYS 52 HA LYS 52 1.903 -16.791 2.568
367 1HB LYS 52 1HB LYS 52 2.618 -18.107 0.620
368 2HB LYS 52 2HB LYS 52 3.395 -16.687 -0.062
369 1HG LYS 52 1HG LYS 52 4.819 -16.642 2.038
370 2HG LYS 52 2HG LYS 52 4.189 -18.257 2.366
371 1HD LYS 52 1HD LYS 52 5.160 -19.143 0.405
372 2HD LYS 52 2HD LYS 52 5.485 -17.537 -0.250
373 1HE LYS 52 1HE LYS 52 7.534 -17.702 0.601
374 2HE LYS 52 2HE LYS 52 6.805 -17.589 2.202
375 1HZ LYS 52 1HZ LYS 52 6.750 -20.226 1.006
376 2HZ LYS 52 2HZ LYS 52 8.295 -19.645 1.374
377 3HZ LYS 52 3HZ LYS 52 7.123 -19.761 2.589
378 HA PRO 53 HA PRO 53 3.488 -12.960 4.089
379 1HB PRO 53 1HB PRO 53 6.022 -14.547 4.336
380 2HB PRO 53 2HB PRO 53 5.277 -13.439 5.496
381 1HG PRO 53 1HG PRO 53 5.005 -16.074 5.771
382 2HG PRO 53 2HG PRO 53 3.661 -14.976 6.130
383 1HD PRO 53 1HD PRO 53 4.022 -16.831 3.853
384 2HD PRO 53 2HD PRO 53 2.528 -16.203 4.570
385 H TYR 54 H TYR 54 5.355 -14.774 1.697
386 HA TYR 54 HA TYR 54 7.208 -12.879 0.936
387 1HB TYR 54 1HB TYR 54 7.547 -14.910 -0.079
388 2HB TYR 54 2HB TYR 54 5.851 -15.100 -0.465
389 HD1 TYR 54 HD1 TYR 54 5.118 -14.729 -2.649
390 HD2 TYR 54 HD2 TYR 54 8.826 -13.066 -1.391
391 HE1 TYR 54 HE1 TYR 54 5.561 -13.990 -4.952
392 HE2 TYR 54 HE2 TYR 54 9.279 -12.322 -3.690
393 HH TYR 54 HH TYR 54 8.250 -13.345 -6.192
394 H GLU 55 H GLU 55 3.808 -13.017 0.319
395 HA GLU 55 HA GLU 55 3.836 -10.314 -0.714
396 1HB GLU 55 1HB GLU 55 3.610 -12.572 -2.467
397 2HB GLU 55 2HB GLU 55 2.075 -11.715 -2.446
398 1HG GLU 55 1HG GLU 55 3.666 -9.621 -2.740
399 2HG GLU 55 2HG GLU 55 4.725 -10.845 -3.439
400 H GLU 56 H GLU 56 2.648 -9.681 1.063
401 HA GLU 56 HA GLU 56 -0.023 -10.894 1.331
402 1HB GLU 56 1HB GLU 56 1.986 -10.053 3.335
403 2HB GLU 56 2HB GLU 56 0.314 -9.675 3.712
404 1HG GLU 56 1HG GLU 56 -0.302 -11.991 3.548
405 2HG GLU 56 2HG GLU 56 1.318 -12.418 2.998
406 H VAL 57 H VAL 57 -1.751 -9.498 1.941
407 HA VAL 57 HA VAL 57 -1.315 -6.638 1.490
408 HB VAL 57 HB VAL 57 -3.782 -7.017 0.363
409 1HG1 VAL 57 1HG1 VAL 57 -2.020 -5.524 -0.427
410 2HG1 VAL 57 2HG1 VAL 57 -1.137 -6.908 -1.071
411 3HG1 VAL 57 3HG1 VAL 57 -2.705 -6.470 -1.749
412 1HG2 VAL 57 1HG2 VAL 57 -3.187 -9.517 0.388
413 2HG2 VAL 57 2HG2 VAL 57 -3.809 -8.822 -1.109
414 3HG2 VAL 57 3HG2 VAL 57 -2.080 -9.119 -0.926
415 H THR 58 H THR 58 -2.281 -5.436 3.009
416 HA THR 58 HA THR 58 -4.063 -6.753 4.889
417 HB THR 58 HB THR 58 -3.878 -4.373 5.974
418 HG1 THR 58 HG1 THR 58 -2.365 -3.114 5.205
419 1HG2 THR 58 1HG2 THR 58 -2.622 -6.672 6.504
420 2HG2 THR 58 2HG2 THR 58 -1.239 -5.673 6.058
421 3HG2 THR 58 3HG2 THR 58 -2.305 -5.168 7.369
422 H CYS 59 H CYS 59 -6.169 -6.710 4.591
423 HA CYS 59 HA CYS 59 -7.352 -4.505 3.060
424 1HB CYS 59 1HB CYS 59 -9.241 -6.603 3.482
425 2HB CYS 59 2HB CYS 59 -8.533 -6.049 1.976
426 H CYS 60 H CYS 60 -8.971 -3.267 3.907
427 HA CYS 60 HA CYS 60 -9.923 -3.927 6.609
428 1HB CYS 60 1HB CYS 60 -9.816 -1.392 7.045
429 2HB CYS 60 2HB CYS 60 -8.309 -2.299 7.103
430 H SER 61 H SER 61 -11.881 -2.652 7.221
431 HA SER 61 HA SER 61 -13.558 -2.174 4.845
432 1HB SER 61 1HB SER 61 -15.484 -2.857 6.263
433 2HB SER 61 2HB SER 61 -14.299 -4.146 6.061
434 HG SER 61 HG SER 61 -13.548 -3.760 8.118
435 H THR 62 H THR 62 -11.907 -0.193 6.202
436 HA THR 62 HA THR 62 -14.056 1.630 7.062
437 HB THR 62 HB THR 62 -11.332 2.097 8.135
438 HG1 THR 62 HG1 THR 62 -11.500 -0.104 8.500
439 1HG2 THR 62 1HG2 THR 62 -14.118 2.588 8.957
440 2HG2 THR 62 2HG2 THR 62 -12.959 2.256 10.244
441 3HG2 THR 62 3HG2 THR 62 -12.681 3.596 9.132
442 H ASP 63 H ASP 63 -12.848 3.986 7.169
443 HA ASP 63 HA ASP 63 -12.026 4.426 4.400
444 1HB ASP 63 1HB ASP 63 -13.870 5.752 5.689
445 2HB ASP 63 2HB ASP 63 -12.508 6.634 6.367
446 H LYS 64 H LYS 64 -10.209 5.678 3.864
447 HA LYS 64 HA LYS 64 -7.906 5.910 3.965
448 1HB LYS 64 1HB LYS 64 -8.456 7.339 6.555
449 2HB LYS 64 2HB LYS 64 -7.283 7.745 5.314
450 1HG LYS 64 1HG LYS 64 -9.509 8.019 3.874
451 2HG LYS 64 2HG LYS 64 -10.167 8.359 5.476
452 1HD LYS 64 1HD LYS 64 -8.203 9.975 5.742
453 2HD LYS 64 2HD LYS 64 -7.988 9.806 3.998
454 1HE LYS 64 1HE LYS 64 -10.518 10.709 5.372
455 2HE LYS 64 2HE LYS 64 -9.348 11.770 4.587
456 1HZ LYS 64 1HZ LYS 64 -9.780 10.446 2.516
457 2HZ LYS 64 2HZ LYS 64 -11.087 9.733 3.319
458 3HZ LYS 64 3HZ LYS 64 -11.071 11.403 3.044
459 H CYS 65 H CYS 65 -8.797 3.478 5.163
460 HA CYS 65 HA CYS 65 -7.248 3.111 7.581
461 1HB CYS 65 1HB CYS 65 -8.260 0.849 7.559
462 2HB CYS 65 2HB CYS 65 -9.451 2.139 7.521
463 H ASN 66 H ASN 66 -6.618 2.857 4.273
464 HA ASN 66 HA ASN 66 -4.581 0.808 4.754
465 1HB ASN 66 1HB ASN 66 -4.715 0.297 2.399
466 2HB ASN 66 2HB ASN 66 -6.309 0.192 3.126
467 2HD2 ASN 66 2HD2 ASN 66 -4.814 1.075 0.461
468 1HD2 ASN 66 1HD2 ASN 66 -5.819 2.374 -0.078
469 HA PRO 67 HA PRO 67 -2.326 4.704 3.456
470 1HB PRO 67 1HB PRO 67 -1.573 5.807 5.742
471 2HB PRO 67 2HB PRO 67 -3.236 6.010 5.172
472 1HG PRO 67 1HG PRO 67 -2.163 4.155 7.261
473 2HG PRO 67 2HG PRO 67 -3.652 5.116 7.277
474 1HD PRO 67 1HD PRO 67 -3.486 2.420 6.599
475 2HD PRO 67 2HD PRO 67 -4.818 3.509 6.173
476 H HIS 68 H HIS 68 -0.001 5.200 3.782
477 HA HIS 68 HA HIS 68 1.597 2.903 3.759
478 1HB HIS 68 1HB HIS 68 2.071 5.378 2.947
479 2HB HIS 68 2HB HIS 68 2.802 5.526 4.541
480 HD1 HIS 68 HD1 HIS 68 5.134 4.678 4.791
481 HD2 HIS 68 HD2 HIS 68 3.316 3.277 1.330
482 HE1 HIS 68 HE1 HIS 68 6.940 3.477 3.522
483 HE2 HIS 68 HE2 HIS 68 5.848 2.764 1.367
484 HA PRO 69 HA PRO 69 2.069 2.003 8.075
485 1HB PRO 69 1HB PRO 69 4.378 0.568 7.985
486 2HB PRO 69 2HB PRO 69 2.820 -0.078 7.456
487 1HG PRO 69 1HG PRO 69 5.046 1.075 5.819
488 2HG PRO 69 2HG PRO 69 4.068 -0.372 5.514
489 1HD PRO 69 1HD PRO 69 3.593 1.976 4.271
490 2HD PRO 69 2HD PRO 69 2.288 0.850 4.695
491 H LYS 70 H LYS 70 4.631 3.520 6.235
492 HA LYS 70 HA LYS 70 5.871 4.495 8.710
493 1HB LYS 70 1HB LYS 70 6.984 3.493 6.363
494 2HB LYS 70 2HB LYS 70 7.245 5.228 6.256
495 1HG LYS 70 1HG LYS 70 7.966 3.665 8.713
496 2HG LYS 70 2HG LYS 70 9.067 3.828 7.343
497 1HD LYS 70 1HD LYS 70 7.813 6.212 8.677
498 2HD LYS 70 2HD LYS 70 9.322 5.502 9.255
499 1HE LYS 70 1HE LYS 70 10.502 6.426 7.600
500 2HE LYS 70 2HE LYS 70 9.327 5.935 6.381
501 1HZ LYS 70 1HZ LYS 70 7.941 7.858 7.239
502 2HZ LYS 70 2HZ LYS 70 9.339 8.391 8.027
503 3HZ LYS 70 3HZ LYS 70 9.319 8.255 6.341
504 H GLN 71 H GLN 71 3.413 5.486 6.977
505 HA GLN 71 HA GLN 71 4.053 8.071 6.077
506 1HB GLN 71 1HB GLN 71 1.634 6.507 6.550
507 2HB GLN 71 2HB GLN 71 1.406 8.219 6.869
508 1HG GLN 71 1HG GLN 71 2.802 7.570 4.365
509 2HG GLN 71 2HG GLN 71 1.112 7.078 4.453
510 2HE2 GLN 71 2HE2 GLN 71 -0.347 8.531 3.914
511 1HE2 GLN 71 1HE2 GLN 71 -0.104 10.240 3.844
512 H ARG 72 H ARG 72 4.518 9.876 7.155
513 HA ARG 72 HA ARG 72 4.742 9.958 9.954
514 1HB ARG 72 1HB ARG 72 4.876 12.020 7.786
515 2HB ARG 72 2HB ARG 72 4.877 12.525 9.470
516 1HG ARG 72 1HG ARG 72 6.781 10.619 9.540
517 2HG ARG 72 2HG ARG 72 6.972 11.205 7.886
518 1HD ARG 72 1HD ARG 72 6.781 13.137 10.163
519 2HD ARG 72 2HD ARG 72 8.305 12.327 9.812
520 HE ARG 72 HE ARG 72 8.425 13.470 7.767
521 1HH1 ARG 72 1HH1 ARG 72 5.565 14.353 9.575
522 2HH1 ARG 72 2HH1 ARG 72 5.285 15.793 8.658
523 1HH2 ARG 72 1HH2 ARG 72 8.049 15.362 6.567
524 2HH2 ARG 72 2HH2 ARG 72 6.690 16.365 6.952
525 HA PRO 73 HA PRO 73 0.348 10.745 10.678
526 1HB PRO 73 1HB PRO 73 0.426 10.414 13.359
527 2HB PRO 73 2HB PRO 73 0.426 9.050 12.236
528 1HG PRO 73 1HG PRO 73 2.725 10.320 13.674
529 2HG PRO 73 2HG PRO 73 2.371 8.599 13.430
530 1HD PRO 73 1HD PRO 73 4.174 9.961 11.924
531 2HD PRO 73 2HD PRO 73 3.228 8.598 11.295
532 H GLY 74 H GLY 74 -0.692 12.614 11.100
533 1HA GLY 74 1HA GLY 74 0.677 14.627 12.761
534 2HA GLY 74 2HA GLY 74 -1.055 14.563 12.474
535 H1 TRP 75 H1 TRP 75 4.060 3.287 -10.980
536 H2 TRP 75 H2 TRP 75 5.333 2.905 -12.067
537 H3 TRP 75 H3 TRP 75 4.401 1.649 -11.366
538 HA TRP 75 HA TRP 75 6.369 1.650 -10.209
539 1HB TRP 75 1HB TRP 75 7.178 3.846 -9.184
540 2HB TRP 75 2HB TRP 75 7.346 3.684 -10.928
541 HD1 TRP 75 HD1 TRP 75 4.109 4.737 -9.100
542 HE1 TRP 75 HE1 TRP 75 3.475 7.097 -9.904
543 HE3 TRP 75 HE3 TRP 75 8.193 5.732 -12.010
544 HZ2 TRP 75 HZ2 TRP 75 4.559 9.115 -11.551
545 HZ3 TRP 75 HZ3 TRP 75 8.319 7.901 -13.165
546 HH2 TRP 75 HH2 TRP 75 6.538 9.557 -12.939
547 H ARG 76 H ARG 76 6.737 2.143 -7.773
548 HA ARG 76 HA ARG 76 4.266 2.718 -6.342
549 1HB ARG 76 1HB ARG 76 4.223 0.642 -5.128
550 2HB ARG 76 2HB ARG 76 4.192 0.284 -6.847
551 1HG ARG 76 1HG ARG 76 6.795 0.298 -5.391
552 2HG ARG 76 2HG ARG 76 5.707 -1.084 -5.251
553 1HD ARG 76 1HD ARG 76 5.905 -1.640 -7.478
554 2HD ARG 76 2HD ARG 76 6.373 -0.007 -7.953
555 HE ARG 76 HE ARG 76 8.467 -0.698 -6.493
556 1HH1 ARG 76 1HH1 ARG 76 6.754 -2.540 -8.918
557 2HH1 ARG 76 2HH1 ARG 76 8.146 -3.459 -9.379
558 1HH2 ARG 76 1HH2 ARG 76 10.295 -1.906 -7.104
559 2HH2 ARG 76 2HH2 ARG 76 10.155 -3.100 -8.351
560 H TYR 77 H TYR 77 5.037 1.869 -3.815
561 HA TYR 77 HA TYR 77 7.546 3.375 -3.410
562 1HB TYR 77 1HB TYR 77 5.281 3.407 -1.434
563 2HB TYR 77 2HB TYR 77 6.651 4.499 -1.545
564 HD1 TYR 77 HD1 TYR 77 3.789 3.412 -3.714
565 HD2 TYR 77 HD2 TYR 77 6.206 6.616 -2.309
566 HE1 TYR 77 HE1 TYR 77 2.441 4.999 -5.022
567 HE2 TYR 77 HE2 TYR 77 4.865 8.210 -3.612
568 HH TYR 77 HH TYR 77 1.905 7.553 -4.829
569 H TYR 78 H TYR 78 8.800 2.765 -1.570
570 HA TYR 78 HA TYR 78 8.350 -0.005 -0.758
571 1HB TYR 78 1HB TYR 78 10.839 1.700 -0.572
572 2HB TYR 78 2HB TYR 78 10.730 0.024 -0.077
573 HD1 TYR 78 HD1 TYR 78 8.783 -0.437 -2.637
574 HD2 TYR 78 HD2 TYR 78 12.752 0.962 -2.019
575 HE1 TYR 78 HE1 TYR 78 9.388 -1.173 -4.901
576 HE2 TYR 78 HE2 TYR 78 13.365 0.232 -4.287
577 HH TYR 78 HH TYR 78 12.300 -0.255 -6.418
578 H GLU 79 H GLU 79 8.908 -0.536 1.513
579 HA GLU 79 HA GLU 79 7.371 1.010 3.286
580 1HB GLU 79 1HB GLU 79 7.792 -1.399 3.590
581 2HB GLU 79 2HB GLU 79 9.480 -1.063 3.940
582 1HG GLU 79 1HG GLU 79 8.914 -0.967 6.077
583 2HG GLU 79 2HG GLU 79 8.085 0.545 5.712
584 H SER 80 H SER 80 10.735 1.113 2.438
585 HA SER 80 HA SER 80 11.917 2.313 4.602
586 1HB SER 80 1HB SER 80 13.644 2.964 3.170
587 2HB SER 80 2HB SER 80 12.911 1.610 2.311
588 HG SER 80 HG SER 80 11.974 2.994 0.905
589 H SER 81 H SER 81 10.483 4.089 1.841
590 HA SER 81 HA SER 81 9.767 6.234 3.696
591 1HB SER 81 1HB SER 81 11.852 6.386 1.767
592 2HB SER 81 2HB SER 81 10.569 7.502 1.321
593 HG SER 81 HG SER 81 10.685 8.165 3.624
594 H LEU 82 H LEU 82 8.400 7.942 2.515
595 HA LEU 82 HA LEU 82 6.264 6.526 1.151
596 1HB LEU 82 1HB LEU 82 6.225 9.469 1.682
597 2HB LEU 82 2HB LEU 82 4.890 8.334 1.645
598 HG LEU 82 HG LEU 82 6.939 8.628 3.842
599 1HD1 LEU 82 1HD1 LEU 82 5.127 10.354 3.656
600 2HD1 LEU 82 2HD1 LEU 82 3.961 9.056 3.920
601 3HD1 LEU 82 3HD1 LEU 82 5.145 9.447 5.169
602 1HD2 LEU 82 1HD2 LEU 82 5.511 6.329 3.094
603 2HD2 LEU 82 2HD2 LEU 82 6.411 6.605 4.586
604 3HD2 LEU 82 3HD2 LEU 82 4.688 6.982 4.513
605 H GLU 83 H GLU 83 9.051 7.780 0.082
606 HA GLU 83 HA GLU 83 8.210 9.450 -2.054
607 1HB GLU 83 1HB GLU 83 10.790 7.905 -1.954
608 2HB GLU 83 2HB GLU 83 10.472 9.440 -2.745
609 1HG GLU 83 1HG GLU 83 9.914 9.699 0.038
610 2HG GLU 83 2HG GLU 83 11.512 8.985 -0.172
611 HA PRO 84 HA PRO 84 7.078 6.469 -5.107
612 1HB PRO 84 1HB PRO 84 8.295 8.081 -7.221
613 2HB PRO 84 2HB PRO 84 6.585 7.804 -6.882
614 1HG PRO 84 1HG PRO 84 7.778 10.203 -6.493
615 2HG PRO 84 2HG PRO 84 6.428 9.631 -5.496
616 1HD PRO 84 1HD PRO 84 9.366 9.622 -4.893
617 2HD PRO 84 2HD PRO 84 8.005 10.037 -3.836
618 H TYR 85 H TYR 85 7.914 4.859 -6.475
619 HA TYR 85 HA TYR 85 10.815 4.816 -6.823
620 1HB TYR 85 1HB TYR 85 9.186 2.992 -5.141
621 2HB TYR 85 2HB TYR 85 10.500 2.280 -6.067
622 HD1 TYR 85 HD1 TYR 85 9.842 5.182 -3.769
623 HD2 TYR 85 HD2 TYR 85 12.603 2.210 -5.087
624 HE1 TYR 85 HE1 TYR 85 11.433 5.889 -2.033
625 HE2 TYR 85 HE2 TYR 85 14.196 2.919 -3.354
626 HH TYR 85 HH TYR 85 14.672 4.952 -2.011
627 HA PRO 86 HA PRO 86 9.223 3.487 -10.832
628 1HB PRO 86 1HB PRO 86 11.708 3.198 -11.969
629 2HB PRO 86 2HB PRO 86 10.828 4.727 -11.876
630 1HG PRO 86 1HG PRO 86 13.013 3.685 -10.120
631 2HG PRO 86 2HG PRO 86 12.762 5.325 -10.746
632 1HD PRO 86 1HD PRO 86 12.133 4.665 -8.220
633 2HD PRO 86 2HD PRO 86 11.161 5.825 -9.149
634 H ASP 87 H ASP 87 9.124 1.547 -11.958
635 HA ASP 87 HA ASP 87 10.064 -0.772 -10.463
636 1HB ASP 87 1HB ASP 87 8.579 -2.030 -12.077
637 2HB ASP 87 2HB ASP 87 7.751 -0.871 -11.041
No H/Q in entry = 637
Start of MODEL 2
1 H1 ILE 1 H1 ILE 1 -16.434 2.963 -0.297
2 H2 ILE 1 H2 ILE 1 -17.474 2.518 0.993
3 H3 ILE 1 H3 ILE 1 -17.542 4.104 0.339
4 HA ILE 1 HA ILE 1 -16.388 4.397 2.244
5 HB ILE 1 HB ILE 1 -16.035 1.730 2.259
6 1HG1 ILE 1 1HG1 ILE 1 -14.115 3.297 3.908
7 2HG1 ILE 1 2HG1 ILE 1 -15.829 3.668 4.059
8 1HG2 ILE 1 1HG2 ILE 1 -14.076 2.130 0.618
9 2HG2 ILE 1 2HG2 ILE 1 -13.198 2.635 2.062
10 3HG2 ILE 1 3HG2 ILE 1 -13.863 1.007 1.961
11 1HD1 ILE 1 1HD1 ILE 1 -15.908 0.992 4.275
12 2HD1 ILE 1 2HD1 ILE 1 -14.312 1.316 4.952
13 3HD1 ILE 1 3HD1 ILE 1 -15.738 2.086 5.647
14 H VAL 2 H VAL 2 -13.765 4.613 2.555
15 HA VAL 2 HA VAL 2 -12.759 5.653 -0.005
16 HB VAL 2 HB VAL 2 -12.377 6.915 2.718
17 1HG1 VAL 2 1HG1 VAL 2 -10.701 7.068 0.533
18 2HG1 VAL 2 2HG1 VAL 2 -11.701 8.512 0.381
19 3HG1 VAL 2 3HG1 VAL 2 -10.785 8.226 1.860
20 1HG2 VAL 2 1HG2 VAL 2 -14.471 7.168 0.777
21 2HG2 VAL 2 2HG2 VAL 2 -14.316 7.934 2.358
22 3HG2 VAL 2 3HG2 VAL 2 -13.610 8.699 0.935
23 H CYS 3 H CYS 3 -10.862 4.865 -0.599
24 HA CYS 3 HA CYS 3 -9.120 3.686 1.471
25 1HB CYS 3 1HB CYS 3 -9.456 2.691 -1.372
26 2HB CYS 3 2HB CYS 3 -8.426 1.979 -0.137
27 H HIS 4 H HIS 4 -6.828 3.517 0.799
28 HA HIS 4 HA HIS 4 -6.010 6.040 -0.405
29 1HB HIS 4 1HB HIS 4 -4.324 3.966 1.002
30 2HB HIS 4 2HB HIS 4 -3.839 5.605 0.581
31 HD1 HIS 4 HD1 HIS 4 -5.636 7.464 1.737
32 HD2 HIS 4 HD2 HIS 4 -5.063 3.795 3.593
33 HE1 HIS 4 HE1 HIS 4 -6.386 7.780 4.112
34 HE2 HIS 4 HE2 HIS 4 -5.810 5.614 5.259
35 H THR 5 H THR 5 -4.331 6.147 -1.987
36 HA THR 5 HA THR 5 -3.931 3.681 -3.524
37 HB THR 5 HB THR 5 -5.659 5.577 -4.378
38 HG1 THR 5 HG1 THR 5 -5.339 4.629 -6.438
39 1HG2 THR 5 1HG2 THR 5 -3.930 7.287 -4.661
40 2HG2 THR 5 2HG2 THR 5 -3.071 6.217 -5.771
41 3HG2 THR 5 3HG2 THR 5 -4.672 6.830 -6.195
42 H THR 6 H THR 6 -2.079 3.604 -4.779
43 HA THR 6 HA THR 6 -0.064 5.676 -4.239
44 HB THR 6 HB THR 6 1.634 3.873 -4.068
45 HG1 THR 6 HG1 THR 6 -0.654 2.283 -4.335
46 1HG2 THR 6 1HG2 THR 6 -0.322 4.538 -2.090
47 2HG2 THR 6 2HG2 THR 6 0.224 2.873 -1.882
48 3HG2 THR 6 3HG2 THR 6 1.395 4.190 -1.897
49 H ALA 7 H ALA 7 -1.820 4.969 -6.585
50 HA ALA 7 HA ALA 7 0.103 4.079 -8.581
51 1HB ALA 7 1HB ALA 7 -2.222 3.249 -8.629
52 2HB ALA 7 2HB ALA 7 -1.755 4.064 -10.122
53 3HB ALA 7 3HB ALA 7 -2.777 4.892 -8.947
54 H THR 8 H THR 8 0.220 6.744 -7.128
55 HA THR 8 HA THR 8 0.532 8.406 -9.531
56 HB THR 8 HB THR 8 -0.715 10.132 -8.712
57 HG1 THR 8 HG1 THR 8 -0.443 9.472 -5.998
58 1HG2 THR 8 1HG2 THR 8 -2.057 7.866 -8.316
59 2HG2 THR 8 2HG2 THR 8 -1.998 8.452 -6.651
60 3HG2 THR 8 3HG2 THR 8 -2.715 9.452 -7.917
61 H SER 9 H SER 9 1.759 10.594 -8.580
62 HA SER 9 HA SER 9 4.306 9.604 -7.766
63 1HB SER 9 1HB SER 9 3.314 12.031 -8.823
64 2HB SER 9 2HB SER 9 4.119 12.426 -7.307
65 HG SER 9 HG SER 9 5.946 12.105 -8.270
66 HA PRO 10 HA PRO 10 3.173 11.284 -3.476
67 1HB PRO 10 1HB PRO 10 1.166 12.979 -3.095
68 2HB PRO 10 2HB PRO 10 2.656 13.554 -3.856
69 1HG PRO 10 1HG PRO 10 0.042 12.825 -5.119
70 2HG PRO 10 2HG PRO 10 1.124 14.179 -5.490
71 1HD PRO 10 1HD PRO 10 1.025 11.775 -6.887
72 2HD PRO 10 2HD PRO 10 2.374 12.921 -6.911
73 H ILE 11 H ILE 11 1.064 11.157 -1.843
74 HA ILE 11 HA ILE 11 -0.300 8.733 -2.733
75 HB ILE 11 HB ILE 11 -0.552 10.012 -0.023
76 1HG1 ILE 11 1HG1 ILE 11 1.467 8.038 -1.077
77 2HG1 ILE 11 2HG1 ILE 11 1.782 9.578 -0.287
78 1HG2 ILE 11 1HG2 ILE 11 -1.096 7.229 -1.035
79 2HG2 ILE 11 2HG2 ILE 11 -1.203 7.730 0.652
80 3HG2 ILE 11 3HG2 ILE 11 -2.295 8.426 -0.545
81 1HD1 ILE 11 1HD1 ILE 11 0.537 7.199 1.067
82 2HD1 ILE 11 2HD1 ILE 11 2.251 7.605 1.126
83 3HD1 ILE 11 3HD1 ILE 11 1.061 8.704 1.824
84 H SER 12 H SER 12 -2.524 8.466 -2.639
85 HA SER 12 HA SER 12 -4.193 10.838 -2.344
86 1HB SER 12 1HB SER 12 -5.268 9.902 -4.652
87 2HB SER 12 2HB SER 12 -4.091 11.213 -4.579
88 HG SER 12 HG SER 12 -3.830 8.967 -5.860
89 H ALA 13 H ALA 13 -6.424 10.386 -2.098
90 HA ALA 13 HA ALA 13 -7.142 7.555 -1.821
91 1HB ALA 13 1HB ALA 13 -6.817 9.449 0.340
92 2HB ALA 13 2HB ALA 13 -8.455 8.797 0.292
93 3HB ALA 13 3HB ALA 13 -7.074 7.705 0.399
94 H VAL 14 H VAL 14 -9.150 7.071 -2.517
95 HA VAL 14 HA VAL 14 -10.964 9.317 -3.105
96 HB VAL 14 HB VAL 14 -9.746 8.014 -5.077
97 1HG1 VAL 14 1HG1 VAL 14 -10.926 5.866 -4.114
98 2HG1 VAL 14 2HG1 VAL 14 -12.274 6.453 -5.090
99 3HG1 VAL 14 3HG1 VAL 14 -10.722 6.098 -5.851
100 1HG2 VAL 14 1HG2 VAL 14 -11.844 9.751 -4.878
101 2HG2 VAL 14 2HG2 VAL 14 -11.109 9.206 -6.386
102 3HG2 VAL 14 3HG2 VAL 14 -12.553 8.403 -5.768
103 H THR 15 H THR 15 -13.157 8.021 -3.929
104 HA THR 15 HA THR 15 -13.893 6.301 -1.665
105 HB THR 15 HB THR 15 -15.296 8.601 -2.967
106 HG1 THR 15 HG1 THR 15 -14.224 8.876 -0.974
107 1HG2 THR 15 1HG2 THR 15 -16.700 6.389 -1.499
108 2HG2 THR 15 2HG2 THR 15 -17.397 7.964 -1.884
109 3HG2 THR 15 3HG2 THR 15 -16.936 6.861 -3.181
110 H CYS 16 H CYS 16 -14.001 4.292 -2.454
111 HA CYS 16 HA CYS 16 -14.394 3.554 -5.106
112 1HB CYS 16 1HB CYS 16 -15.307 1.733 -2.913
113 2HB CYS 16 2HB CYS 16 -14.436 1.356 -4.392
114 HA PRO 17 HA PRO 17 -18.702 4.358 -5.783
115 1HB PRO 17 1HB PRO 17 -19.056 2.641 -7.891
116 2HB PRO 17 2HB PRO 17 -18.336 4.246 -8.035
117 1HG PRO 17 1HG PRO 17 -17.003 1.576 -7.854
118 2HG PRO 17 2HG PRO 17 -16.599 2.963 -8.882
119 1HD PRO 17 1HD PRO 17 -15.216 2.403 -6.646
120 2HD PRO 17 2HD PRO 17 -15.509 4.073 -7.168
121 HA PRO 18 HA PRO 18 -21.222 1.213 -3.986
122 1HB PRO 18 1HB PRO 18 -23.192 0.704 -5.843
123 2HB PRO 18 2HB PRO 18 -23.184 2.093 -4.752
124 1HG PRO 18 1HG PRO 18 -22.332 1.925 -7.614
125 2HG PRO 18 2HG PRO 18 -23.250 3.200 -6.791
126 1HD PRO 18 1HD PRO 18 -20.643 3.485 -7.331
127 2HD PRO 18 2HD PRO 18 -21.350 4.123 -5.833
128 H GLY 19 H GLY 19 -19.136 -0.082 -4.586
129 1HA GLY 19 1HA GLY 19 -18.838 -1.881 -6.592
130 2HA GLY 19 2HA GLY 19 -20.029 -2.646 -5.549
131 H GLU 20 H GLU 20 -17.224 -0.636 -4.698
132 HA GLU 20 HA GLU 20 -16.074 -2.975 -3.318
133 1HB GLU 20 1HB GLU 20 -14.505 -0.506 -3.900
134 2HB GLU 20 2HB GLU 20 -13.939 -2.154 -3.702
135 1HG GLU 20 1HG GLU 20 -13.817 -2.281 -5.908
136 2HG GLU 20 2HG GLU 20 -15.579 -2.248 -5.940
137 H ASN 21 H ASN 21 -15.685 -2.895 -1.216
138 HA ASN 21 HA ASN 21 -16.214 -0.386 0.217
139 1HB ASN 21 1HB ASN 21 -17.612 -2.855 0.362
140 2HB ASN 21 2HB ASN 21 -16.846 -2.540 1.906
141 2HD2 ASN 21 2HD2 ASN 21 -19.331 -2.584 2.196
142 1HD2 ASN 21 1HD2 ASN 21 -20.068 -1.028 2.222
143 H LEU 22 H LEU 22 -14.129 -3.019 -0.299
144 HA LEU 22 HA LEU 22 -12.711 -2.544 2.215
145 1HB LEU 22 1HB LEU 22 -12.343 -4.764 0.213
146 2HB LEU 22 2HB LEU 22 -11.621 -4.655 1.800
147 HG LEU 22 HG LEU 22 -14.595 -4.682 1.558
148 1HD1 LEU 22 1HD1 LEU 22 -12.758 -6.893 0.911
149 2HD1 LEU 22 2HD1 LEU 22 -14.088 -7.280 2.002
150 3HD1 LEU 22 3HD1 LEU 22 -14.425 -6.609 0.407
151 1HD2 LEU 22 1HD2 LEU 22 -12.574 -4.993 3.642
152 2HD2 LEU 22 2HD2 LEU 22 -14.269 -4.522 3.763
153 3HD2 LEU 22 3HD2 LEU 22 -13.832 -6.228 3.685
154 H CYS 23 H CYS 23 -10.330 -2.634 2.101
155 HA CYS 23 HA CYS 23 -9.289 -1.385 -0.356
156 1HB CYS 23 1HB CYS 23 -8.212 -0.785 2.384
157 2HB CYS 23 2HB CYS 23 -7.998 0.138 0.902
158 H TYR 24 H TYR 24 -7.005 -1.794 -0.771
159 HA TYR 24 HA TYR 24 -5.954 -4.087 0.720
160 1HB TYR 24 1HB TYR 24 -5.417 -5.336 -1.165
161 2HB TYR 24 2HB TYR 24 -7.006 -4.695 -1.550
162 HD1 TYR 24 HD1 TYR 24 -3.394 -3.705 -2.033
163 HD2 TYR 24 HD2 TYR 24 -7.315 -3.941 -3.689
164 HE1 TYR 24 HE1 TYR 24 -2.534 -2.872 -4.171
165 HE2 TYR 24 HE2 TYR 24 -6.458 -3.099 -5.833
166 HH TYR 24 HH TYR 24 -4.262 -3.038 -7.042
167 H ARG 25 H ARG 25 -3.796 -4.233 0.971
168 HA ARG 25 HA ARG 25 -2.093 -2.125 -0.140
169 1HB ARG 25 1HB ARG 25 -2.719 -1.349 2.089
170 2HB ARG 25 2HB ARG 25 -2.256 -2.896 2.784
171 1HG ARG 25 1HG ARG 25 0.000 -2.470 2.570
172 2HG ARG 25 2HG ARG 25 -0.240 -1.279 1.290
173 1HD ARG 25 1HD ARG 25 0.035 0.253 2.893
174 2HD ARG 25 2HD ARG 25 -1.599 -0.171 3.398
175 HE ARG 25 HE ARG 25 0.869 -0.830 4.740
176 1HH1 ARG 25 1HH1 ARG 25 -2.517 -1.604 4.379
177 2HH1 ARG 25 2HH1 ARG 25 -2.635 -2.364 5.930
178 1HH2 ARG 25 1HH2 ARG 25 0.712 -1.828 6.778
179 2HH2 ARG 25 2HH2 ARG 25 -0.803 -2.491 7.292
180 H LYS 26 H LYS 26 -0.564 -3.184 -1.240
181 HA LYS 26 HA LYS 26 0.115 -5.906 -0.472
182 1HB LYS 26 1HB LYS 26 -0.298 -5.422 -2.831
183 2HB LYS 26 2HB LYS 26 1.021 -4.267 -2.834
184 1HG LYS 26 1HG LYS 26 2.641 -5.912 -2.716
185 2HG LYS 26 2HG LYS 26 1.516 -7.109 -2.071
186 1HD LYS 26 1HD LYS 26 1.809 -7.797 -4.273
187 2HD LYS 26 2HD LYS 26 0.311 -6.864 -4.343
188 1HE LYS 26 1HE LYS 26 1.399 -5.003 -5.300
189 2HE LYS 26 2HE LYS 26 2.997 -5.640 -4.911
190 1HZ LYS 26 1HZ LYS 26 2.055 -7.586 -6.455
191 2HZ LYS 26 2HZ LYS 26 1.244 -6.267 -7.138
192 3HZ LYS 26 3HZ LYS 26 2.933 -6.269 -7.054
193 H MET 27 H MET 27 2.021 -6.611 0.261
194 HA MET 27 HA MET 27 4.215 -4.715 0.529
195 1HB MET 27 1HB MET 27 2.808 -6.069 2.789
196 2HB MET 27 2HB MET 27 4.513 -5.680 2.926
197 1HG MET 27 1HG MET 27 4.141 -3.467 3.107
198 2HG MET 27 2HG MET 27 2.759 -3.496 2.013
199 1HE MET 27 1HE MET 27 0.944 -5.223 2.645
200 2HE MET 27 2HE MET 27 0.705 -5.848 4.276
201 3HE MET 27 3HE MET 27 -0.160 -4.405 3.750
202 H TRP 28 H TRP 28 6.173 -5.569 0.346
203 HA TRP 28 HA TRP 28 6.839 -8.278 0.894
204 1HB TRP 28 1HB TRP 28 7.329 -9.018 -1.440
205 2HB TRP 28 2HB TRP 28 5.614 -8.861 -1.098
206 HD1 TRP 28 HD1 TRP 28 5.678 -5.605 -1.542
207 HE1 TRP 28 HE1 TRP 28 5.677 -4.748 -3.969
208 HE3 TRP 28 HE3 TRP 28 7.366 -9.815 -3.875
209 HZ2 TRP 28 HZ2 TRP 28 6.323 -5.723 -6.528
210 HZ3 TRP 28 HZ3 TRP 28 7.652 -9.775 -6.320
211 HH2 TRP 28 HH2 TRP 28 7.139 -7.771 -7.619
212 H CYS 29 H CYS 29 8.899 -8.175 1.482
213 HA CYS 29 HA CYS 29 10.406 -5.926 1.273
214 1HB CYS 29 1HB CYS 29 11.479 -8.706 1.636
215 2HB CYS 29 2HB CYS 29 12.383 -7.239 1.888
216 H ASP 30 H ASP 30 11.189 -4.915 -0.405
217 HA ASP 30 HA ASP 30 11.932 -6.286 -2.826
218 1HB ASP 30 1HB ASP 30 12.602 -4.115 -3.669
219 2HB ASP 30 2HB ASP 30 11.067 -3.917 -2.844
220 H ALA 31 H ALA 31 14.095 -6.578 -3.489
221 HA ALA 31 HA ALA 31 15.845 -7.717 -1.846
222 1HB ALA 31 1HB ALA 31 16.480 -7.882 -4.030
223 2HB ALA 31 2HB ALA 31 17.689 -6.743 -3.439
224 3HB ALA 31 3HB ALA 31 16.289 -6.156 -4.335
225 H PHE 32 H PHE 32 15.138 -6.013 -0.049
226 HA PHE 32 HA PHE 32 17.504 -5.004 1.007
227 1HB PHE 32 1HB PHE 32 16.126 -3.186 -0.702
228 2HB PHE 32 2HB PHE 32 15.961 -2.633 0.946
229 HD1 PHE 32 HD1 PHE 32 17.306 -0.666 0.659
230 HD2 PHE 32 HD2 PHE 32 18.897 -4.511 -0.207
231 HE1 PHE 32 HE1 PHE 32 19.563 0.297 0.563
232 HE2 PHE 32 HE2 PHE 32 21.160 -3.558 -0.304
233 HZ PHE 32 HZ PHE 32 21.496 -1.149 0.082
234 H CYS 33 H CYS 33 15.110 -6.678 1.649
235 HA CYS 33 HA CYS 33 13.226 -5.699 3.284
236 1HB CYS 33 1HB CYS 33 13.804 -8.136 2.770
237 2HB CYS 33 2HB CYS 33 14.832 -8.062 4.196
238 H SER 34 H SER 34 16.629 -5.669 4.005
239 HA SER 34 HA SER 34 16.303 -5.020 6.785
240 1HB SER 34 1HB SER 34 18.600 -5.188 4.881
241 2HB SER 34 2HB SER 34 18.809 -4.244 6.356
242 HG SER 34 HG SER 34 17.809 -6.889 6.387
243 H SER 35 H SER 35 17.299 -3.184 3.887
244 HA SER 35 HA SER 35 16.906 -0.669 5.315
245 1HB SER 35 1HB SER 35 17.540 -0.214 2.573
246 2HB SER 35 2HB SER 35 18.560 0.046 3.985
247 HG SER 35 HG SER 35 19.635 -1.695 3.513
248 H ARG 36 H ARG 36 16.098 -1.391 1.917
249 HA ARG 36 HA ARG 36 13.718 0.165 2.046
250 1HB ARG 36 1HB ARG 36 14.541 -1.852 -0.048
251 2HB ARG 36 2HB ARG 36 13.271 -0.684 -0.215
252 1HG ARG 36 1HG ARG 36 16.107 -0.398 -0.669
253 2HG ARG 36 2HG ARG 36 14.769 0.598 -1.226
254 1HD ARG 36 1HD ARG 36 14.725 1.640 1.062
255 2HD ARG 36 2HD ARG 36 16.224 0.780 1.406
256 HE ARG 36 HE ARG 36 16.779 2.098 -0.889
257 1HH1 ARG 36 1HH1 ARG 36 15.498 3.104 2.196
258 2HH1 ARG 36 2HH1 ARG 36 16.171 4.697 2.097
259 1HH2 ARG 36 1HH2 ARG 36 17.666 4.190 -1.022
260 2HH2 ARG 36 2HH2 ARG 36 17.402 5.314 0.269
261 H GLY 37 H GLY 37 13.812 -3.266 0.942
262 1HA GLY 37 1HA GLY 37 12.230 -4.071 3.185
263 2HA GLY 37 2HA GLY 37 12.684 -5.055 1.808
264 H LYS 38 H LYS 38 10.191 -4.785 3.293
265 HA LYS 38 HA LYS 38 8.421 -5.431 1.449
266 1HB LYS 38 1HB LYS 38 7.141 -3.764 3.443
267 2HB LYS 38 2HB LYS 38 6.881 -5.442 3.028
268 1HG LYS 38 1HG LYS 38 7.590 -5.547 5.219
269 2HG LYS 38 2HG LYS 38 9.067 -5.867 4.315
270 1HD LYS 38 1HD LYS 38 9.216 -3.189 4.499
271 2HD LYS 38 2HD LYS 38 8.320 -3.543 5.978
272 1HE LYS 38 1HE LYS 38 11.041 -4.525 5.162
273 2HE LYS 38 2HE LYS 38 10.605 -3.569 6.577
274 1HZ LYS 38 1HZ LYS 38 9.395 -5.477 7.444
275 2HZ LYS 38 2HZ LYS 38 9.826 -6.393 6.088
276 3HZ LYS 38 3HZ LYS 38 11.017 -5.869 7.168
277 H VAL 39 H VAL 39 8.021 -4.549 -0.414
278 HA VAL 39 HA VAL 39 7.940 -1.743 -0.886
279 HB VAL 39 HB VAL 39 6.679 -3.925 -2.545
280 1HG1 VAL 39 1HG1 VAL 39 6.288 -1.304 -2.842
281 2HG1 VAL 39 2HG1 VAL 39 7.774 -1.482 -3.776
282 3HG1 VAL 39 3HG1 VAL 39 6.349 -2.432 -4.199
283 1HG2 VAL 39 1HG2 VAL 39 9.132 -4.246 -2.052
284 2HG2 VAL 39 2HG2 VAL 39 8.689 -4.160 -3.757
285 3HG2 VAL 39 3HG2 VAL 39 9.414 -2.762 -2.963
286 H VAL 40 H VAL 40 6.144 -0.401 -0.977
287 HA VAL 40 HA VAL 40 3.711 -1.517 0.233
288 HB VAL 40 HB VAL 40 4.172 1.426 0.132
289 1HG1 VAL 40 1HG1 VAL 40 2.507 -0.474 1.560
290 2HG1 VAL 40 2HG1 VAL 40 3.312 0.663 2.643
291 3HG1 VAL 40 3HG1 VAL 40 2.299 1.263 1.328
292 1HG2 VAL 40 1HG2 VAL 40 5.816 -0.508 1.669
293 2HG2 VAL 40 2HG2 VAL 40 6.243 1.070 1.009
294 3HG2 VAL 40 3HG2 VAL 40 5.290 0.963 2.490
295 H GLU 41 H GLU 41 1.961 -1.671 -0.902
296 HA GLU 41 HA GLU 41 1.515 0.103 -3.212
297 1HB GLU 41 1HB GLU 41 2.035 -2.510 -3.541
298 2HB GLU 41 2HB GLU 41 0.307 -2.611 -3.233
299 1HG GLU 41 1HG GLU 41 0.830 -2.505 -5.621
300 2HG GLU 41 2HG GLU 41 -0.157 -1.146 -5.087
301 H LEU 42 H LEU 42 -0.784 0.457 -3.694
302 HA LEU 42 HA LEU 42 -2.574 -0.035 -1.415
303 1HB LEU 42 1HB LEU 42 -1.605 2.528 -2.468
304 2HB LEU 42 2HB LEU 42 -3.342 2.446 -2.292
305 HG LEU 42 HG LEU 42 -3.245 2.283 0.008
306 1HD1 LEU 42 1HD1 LEU 42 -0.416 1.329 -0.322
307 2HD1 LEU 42 2HD1 LEU 42 -1.094 1.803 1.235
308 3HD1 LEU 42 3HD1 LEU 42 -1.793 0.451 0.345
309 1HD2 LEU 42 1HD2 LEU 42 -2.074 4.387 -1.151
310 2HD2 LEU 42 2HD2 LEU 42 -2.295 4.242 0.592
311 3HD2 LEU 42 3HD2 LEU 42 -0.742 3.831 -0.136
312 H GLY 43 H GLY 43 -4.867 0.305 -1.921
313 1HA GLY 43 1HA GLY 43 -5.562 -0.892 -4.422
314 2HA GLY 43 2HA GLY 43 -5.959 0.815 -4.397
315 H CYS 44 H CYS 44 -8.139 -0.170 -4.755
316 HA CYS 44 HA CYS 44 -9.419 -0.742 -2.159
317 1HB CYS 44 1HB CYS 44 -10.152 1.384 -3.075
318 2HB CYS 44 2HB CYS 44 -10.536 0.626 -4.617
319 H ALA 45 H ALA 45 -11.277 -2.205 -2.209
320 HA ALA 45 HA ALA 45 -11.801 -3.780 -4.540
321 1HB ALA 45 1HB ALA 45 -9.965 -5.083 -4.242
322 2HB ALA 45 2HB ALA 45 -9.884 -4.768 -2.509
323 3HB ALA 45 3HB ALA 45 -11.061 -5.920 -3.141
324 H ALA 46 H ALA 46 -13.372 -5.515 -4.118
325 HA ALA 46 HA ALA 46 -15.089 -4.814 -1.836
326 1HB ALA 46 1HB ALA 46 -16.150 -6.416 -4.094
327 2HB ALA 46 2HB ALA 46 -16.931 -5.169 -3.122
328 3HB ALA 46 3HB ALA 46 -15.793 -4.716 -4.392
329 H THR 47 H THR 47 -13.017 -7.222 -2.957
330 HA THR 47 HA THR 47 -14.211 -9.163 -1.095
331 HB THR 47 HB THR 47 -14.705 -10.149 -3.154
332 HG1 THR 47 HG1 THR 47 -12.116 -11.176 -2.669
333 1HG2 THR 47 1HG2 THR 47 -12.016 -9.225 -4.121
334 2HG2 THR 47 2HG2 THR 47 -13.018 -10.392 -4.985
335 3HG2 THR 47 3HG2 THR 47 -13.607 -8.751 -4.717
336 H CYS 48 H CYS 48 -12.566 -10.889 -0.471
337 HA CYS 48 HA CYS 48 -9.858 -9.773 -0.323
338 1HB CYS 48 1HB CYS 48 -11.178 -9.322 1.773
339 2HB CYS 48 2HB CYS 48 -11.211 -11.061 2.013
340 HA PRO 49 HA PRO 49 -9.539 -14.141 -1.680
341 1HB PRO 49 1HB PRO 49 -7.336 -13.785 -3.207
342 2HB PRO 49 2HB PRO 49 -8.964 -13.417 -3.787
343 1HG PRO 49 1HG PRO 49 -6.868 -11.566 -2.719
344 2HG PRO 49 2HG PRO 49 -7.942 -11.355 -4.115
345 1HD PRO 49 1HD PRO 49 -8.411 -10.201 -1.699
346 2HD PRO 49 2HD PRO 49 -9.710 -10.676 -2.811
347 H SER 50 H SER 50 -7.782 -15.716 -1.416
348 HA SER 50 HA SER 50 -6.435 -15.351 1.074
349 1HB SER 50 1HB SER 50 -5.349 -17.627 -0.144
350 2HB SER 50 2HB SER 50 -6.684 -17.581 1.006
351 HG SER 50 HG SER 50 -6.712 -18.116 -1.657
352 H LYS 51 H LYS 51 -4.273 -15.084 1.502
353 HA LYS 51 HA LYS 51 -2.343 -15.002 -0.638
354 1HB LYS 51 1HB LYS 51 -3.619 -12.615 0.310
355 2HB LYS 51 2HB LYS 51 -1.888 -12.550 0.587
356 1HG LYS 51 1HG LYS 51 -1.863 -11.731 -1.503
357 2HG LYS 51 2HG LYS 51 -1.921 -13.438 -1.947
358 1HD LYS 51 1HD LYS 51 -3.714 -12.838 -3.161
359 2HD LYS 51 2HD LYS 51 -4.563 -12.876 -1.615
360 1HE LYS 51 1HE LYS 51 -3.174 -10.402 -2.590
361 2HE LYS 51 2HE LYS 51 -4.823 -10.788 -3.078
362 1HZ LYS 51 1HZ LYS 51 -5.386 -10.908 -0.680
363 2HZ LYS 51 2HZ LYS 51 -3.836 -10.338 -0.317
364 3HZ LYS 51 3HZ LYS 51 -4.912 -9.367 -1.189
365 H LYS 52 H LYS 52 -0.236 -13.815 0.479
366 HA LYS 52 HA LYS 52 0.295 -15.505 2.801
367 1HB LYS 52 1HB LYS 52 2.094 -13.999 0.906
368 2HB LYS 52 2HB LYS 52 2.693 -14.773 2.367
369 1HG LYS 52 1HG LYS 52 1.566 -16.897 1.429
370 2HG LYS 52 2HG LYS 52 1.571 -16.023 -0.105
371 1HD LYS 52 1HD LYS 52 4.128 -15.634 0.809
372 2HD LYS 52 2HD LYS 52 3.775 -17.275 1.352
373 1HE LYS 52 1HE LYS 52 4.327 -17.932 -0.707
374 2HE LYS 52 2HE LYS 52 2.799 -17.226 -1.230
375 1HZ LYS 52 1HZ LYS 52 5.143 -15.480 -1.004
376 2HZ LYS 52 2HZ LYS 52 5.047 -16.527 -2.329
377 3HZ LYS 52 3HZ LYS 52 3.828 -15.384 -2.063
378 HA PRO 53 HA PRO 53 0.029 -11.885 5.392
379 1HB PRO 53 1HB PRO 53 0.658 -13.026 7.734
380 2HB PRO 53 2HB PRO 53 -0.876 -13.365 6.924
381 1HG PRO 53 1HG PRO 53 1.629 -15.000 7.000
382 2HG PRO 53 2HG PRO 53 -0.057 -15.528 7.149
383 1HD PRO 53 1HD PRO 53 1.406 -15.692 4.831
384 2HD PRO 53 2HD PRO 53 -0.364 -15.583 4.882
385 H TYR 54 H TYR 54 2.261 -11.680 3.898
386 HA TYR 54 HA TYR 54 4.069 -10.352 5.556
387 1HB TYR 54 1HB TYR 54 4.504 -13.145 5.459
388 2HB TYR 54 2HB TYR 54 5.827 -12.350 4.623
389 HD1 TYR 54 HD1 TYR 54 6.918 -10.339 5.890
390 HD2 TYR 54 HD2 TYR 54 4.588 -13.364 7.766
391 HE1 TYR 54 HE1 TYR 54 7.959 -9.793 8.050
392 HE2 TYR 54 HE2 TYR 54 5.621 -12.826 9.932
393 HH TYR 54 HH TYR 54 8.335 -11.304 10.346
394 H GLU 55 H GLU 55 4.046 -12.312 2.598
395 HA GLU 55 HA GLU 55 5.234 -10.015 1.187
396 1HB GLU 55 1HB GLU 55 6.342 -12.513 1.461
397 2HB GLU 55 2HB GLU 55 5.545 -12.631 -0.102
398 1HG GLU 55 1HG GLU 55 6.812 -10.878 -1.003
399 2HG GLU 55 2HG GLU 55 7.360 -10.349 0.587
400 H GLU 56 H GLU 56 2.591 -9.882 1.373
401 HA GLU 56 HA GLU 56 1.733 -10.156 -1.345
402 1HB GLU 56 1HB GLU 56 1.016 -12.166 0.597
403 2HB GLU 56 2HB GLU 56 -0.406 -11.334 -0.004
404 1HG GLU 56 1HG GLU 56 1.655 -12.818 -1.603
405 2HG GLU 56 2HG GLU 56 -0.039 -13.243 -1.374
406 H VAL 57 H VAL 57 -0.954 -9.765 -1.078
407 HA VAL 57 HA VAL 57 -1.015 -7.133 0.192
408 HB VAL 57 HB VAL 57 -3.255 -8.030 -1.485
409 1HG1 VAL 57 1HG1 VAL 57 -2.831 -5.752 -0.257
410 2HG1 VAL 57 2HG1 VAL 57 -1.901 -5.402 -1.714
411 3HG1 VAL 57 3HG1 VAL 57 -3.613 -5.805 -1.837
412 1HG2 VAL 57 1HG2 VAL 57 -0.492 -7.563 -2.495
413 2HG2 VAL 57 2HG2 VAL 57 -1.689 -8.749 -3.014
414 3HG2 VAL 57 3HG2 VAL 57 -1.872 -7.054 -3.468
415 H THR 58 H THR 58 -2.540 -6.488 1.617
416 HA THR 58 HA THR 58 -4.255 -8.601 2.735
417 HB THR 58 HB THR 58 -3.128 -8.214 4.639
418 HG1 THR 58 HG1 THR 58 -4.504 -7.098 5.722
419 1HG2 THR 58 1HG2 THR 58 -2.160 -5.666 3.401
420 2HG2 THR 58 2HG2 THR 58 -1.847 -6.071 5.089
421 3HG2 THR 58 3HG2 THR 58 -1.242 -7.116 3.804
422 H CYS 59 H CYS 59 -6.379 -8.102 3.165
423 HA CYS 59 HA CYS 59 -7.295 -5.542 2.051
424 1HB CYS 59 1HB CYS 59 -9.459 -7.385 2.277
425 2HB CYS 59 2HB CYS 59 -8.741 -6.709 0.829
426 H CYS 60 H CYS 60 -8.617 -4.222 3.230
427 HA CYS 60 HA CYS 60 -9.417 -5.182 5.900
428 1HB CYS 60 1HB CYS 60 -9.114 -2.695 6.563
429 2HB CYS 60 2HB CYS 60 -7.684 -3.711 6.421
430 H SER 61 H SER 61 -11.320 -4.214 6.798
431 HA SER 61 HA SER 61 -13.146 -3.198 4.724
432 1HB SER 61 1HB SER 61 -14.948 -4.266 5.842
433 2HB SER 61 2HB SER 61 -13.637 -5.446 5.822
434 HG SER 61 HG SER 61 -13.963 -5.501 7.897
435 H THR 62 H THR 62 -11.730 -1.198 5.638
436 HA THR 62 HA THR 62 -13.643 0.341 7.169
437 HB THR 62 HB THR 62 -10.895 0.618 8.226
438 HG1 THR 62 HG1 THR 62 -10.826 -1.248 9.240
439 1HG2 THR 62 1HG2 THR 62 -13.649 0.958 9.171
440 2HG2 THR 62 2HG2 THR 62 -12.509 0.332 10.362
441 3HG2 THR 62 3HG2 THR 62 -12.189 1.868 9.557
442 H ASP 63 H ASP 63 -12.880 2.677 7.357
443 HA ASP 63 HA ASP 63 -11.962 3.503 4.755
444 1HB ASP 63 1HB ASP 63 -13.724 4.614 6.396
445 2HB ASP 63 2HB ASP 63 -12.301 5.471 6.968
446 H LYS 64 H LYS 64 -10.148 4.735 4.304
447 HA LYS 64 HA LYS 64 -7.858 4.989 4.353
448 1HB LYS 64 1HB LYS 64 -8.138 5.996 7.156
449 2HB LYS 64 2HB LYS 64 -7.213 6.669 5.824
450 1HG LYS 64 1HG LYS 64 -10.213 6.727 6.030
451 2HG LYS 64 2HG LYS 64 -9.139 8.056 6.470
452 1HD LYS 64 1HD LYS 64 -8.472 7.149 3.843
453 2HD LYS 64 2HD LYS 64 -10.211 7.439 3.925
454 1HE LYS 64 1HE LYS 64 -9.007 9.447 3.230
455 2HE LYS 64 2HE LYS 64 -9.808 9.684 4.783
456 1HZ LYS 64 1HZ LYS 64 -7.392 8.830 5.552
457 2HZ LYS 64 2HZ LYS 64 -6.986 9.671 4.141
458 3HZ LYS 64 3HZ LYS 64 -7.810 10.460 5.391
459 H CYS 65 H CYS 65 -8.618 2.393 5.095
460 HA CYS 65 HA CYS 65 -7.074 1.648 7.427
461 1HB CYS 65 1HB CYS 65 -8.041 -0.544 7.115
462 2HB CYS 65 2HB CYS 65 -9.301 0.673 7.003
463 H ASN 66 H ASN 66 -6.470 1.921 4.076
464 HA ASN 66 HA ASN 66 -4.263 0.007 4.294
465 1HB ASN 66 1HB ASN 66 -4.403 -0.240 1.889
466 2HB ASN 66 2HB ASN 66 -5.953 -0.593 2.632
467 2HD2 ASN 66 2HD2 ASN 66 -4.557 0.837 0.104
468 1HD2 ASN 66 1HD2 ASN 66 -5.739 2.038 -0.277
469 HA PRO 67 HA PRO 67 -2.375 4.189 3.334
470 1HB PRO 67 1HB PRO 67 -1.836 5.267 5.687
471 2HB PRO 67 2HB PRO 67 -3.492 5.301 5.065
472 1HG PRO 67 1HG PRO 67 -2.278 3.507 7.128
473 2HG PRO 67 2HG PRO 67 -3.879 4.267 7.108
474 1HD PRO 67 1HD PRO 67 -3.309 1.641 6.326
475 2HD PRO 67 2HD PRO 67 -4.779 2.548 5.935
476 H HIS 68 H HIS 68 -0.144 4.924 3.762
477 HA HIS 68 HA HIS 68 1.672 2.725 3.933
478 1HB HIS 68 1HB HIS 68 1.893 4.930 2.583
479 2HB HIS 68 2HB HIS 68 2.495 5.614 4.087
480 HD1 HIS 68 HD1 HIS 68 4.825 4.858 4.882
481 HD2 HIS 68 HD2 HIS 68 3.629 3.134 1.300
482 HE1 HIS 68 HE1 HIS 68 6.896 3.811 3.919
483 HE2 HIS 68 HE2 HIS 68 6.176 2.908 1.681
484 HA PRO 69 HA PRO 69 1.907 2.788 8.420
485 1HB PRO 69 1HB PRO 69 4.061 1.087 8.604
486 2HB PRO 69 2HB PRO 69 2.385 0.559 8.421
487 1HG PRO 69 1HG PRO 69 4.520 0.846 6.346
488 2HG PRO 69 2HG PRO 69 3.314 -0.440 6.544
489 1HD PRO 69 1HD PRO 69 3.017 1.495 4.708
490 2HD PRO 69 2HD PRO 69 1.625 0.824 5.584
491 H LYS 70 H LYS 70 4.517 3.535 6.226
492 HA LYS 70 HA LYS 70 6.006 4.841 8.395
493 1HB LYS 70 1HB LYS 70 6.806 3.313 6.134
494 2HB LYS 70 2HB LYS 70 7.412 4.948 5.908
495 1HG LYS 70 1HG LYS 70 7.848 3.338 8.411
496 2HG LYS 70 2HG LYS 70 8.982 3.391 7.060
497 1HD LYS 70 1HD LYS 70 9.187 5.816 7.331
498 2HD LYS 70 2HD LYS 70 8.054 5.761 8.683
499 1HE LYS 70 1HE LYS 70 10.529 5.831 9.260
500 2HE LYS 70 2HE LYS 70 9.563 4.580 10.041
501 1HZ LYS 70 1HZ LYS 70 10.884 3.906 7.521
502 2HZ LYS 70 2HZ LYS 70 11.855 4.045 8.899
503 3HZ LYS 70 3HZ LYS 70 10.576 2.936 8.871
504 H GLN 71 H GLN 71 3.552 5.915 7.075
505 HA GLN 71 HA GLN 71 4.373 8.060 5.382
506 1HB GLN 71 1HB GLN 71 2.192 7.792 4.909
507 2HB GLN 71 2HB GLN 71 1.877 6.987 6.437
508 1HG GLN 71 1HG GLN 71 1.525 9.050 7.549
509 2HG GLN 71 2HG GLN 71 2.115 9.968 6.165
510 2HE2 GLN 71 2HE2 GLN 71 0.845 9.024 4.063
511 1HE2 GLN 71 1HE2 GLN 71 -0.869 9.163 4.224
512 H ARG 72 H ARG 72 5.215 9.949 5.938
513 HA ARG 72 HA ARG 72 5.378 10.664 8.752
514 1HB ARG 72 1HB ARG 72 7.416 10.774 7.416
515 2HB ARG 72 2HB ARG 72 6.651 11.899 6.303
516 1HG ARG 72 1HG ARG 72 7.566 13.511 7.526
517 2HG ARG 72 2HG ARG 72 6.349 13.132 8.746
518 1HD ARG 72 1HD ARG 72 9.047 11.801 8.583
519 2HD ARG 72 2HD ARG 72 8.700 13.200 9.599
520 HE ARG 72 HE ARG 72 6.912 10.996 10.036
521 1HH1 ARG 72 1HH1 ARG 72 10.005 12.369 10.884
522 2HH1 ARG 72 2HH1 ARG 72 10.081 11.570 12.418
523 1HH2 ARG 72 1HH2 ARG 72 7.007 9.943 12.053
524 2HH2 ARG 72 2HH2 ARG 72 8.379 10.189 13.082
525 HA PRO 73 HA PRO 73 2.007 13.552 8.375
526 1HB PRO 73 1HB PRO 73 2.355 14.871 10.715
527 2HB PRO 73 2HB PRO 73 1.680 13.240 10.631
528 1HG PRO 73 1HG PRO 73 4.471 14.103 11.283
529 2HG PRO 73 2HG PRO 73 3.470 12.866 12.066
530 1HD PRO 73 1HD PRO 73 5.407 12.262 10.267
531 2HD PRO 73 2HD PRO 73 3.934 11.290 10.452
532 H GLY 74 H GLY 74 1.772 16.056 8.952
533 1HA GLY 74 1HA GLY 74 4.159 17.603 8.438
534 2HA GLY 74 2HA GLY 74 2.536 18.233 8.673
535 H1 TRP 75 H1 TRP 75 3.990 3.641 -10.695
536 H2 TRP 75 H2 TRP 75 5.285 3.292 -11.766
537 H3 TRP 75 H3 TRP 75 4.457 2.015 -10.971
538 HA TRP 75 HA TRP 75 6.471 2.297 -9.880
539 1HB TRP 75 1HB TRP 75 6.936 4.626 -8.883
540 2HB TRP 75 2HB TRP 75 7.195 4.413 -10.610
541 HD1 TRP 75 HD1 TRP 75 4.107 5.463 -8.480
542 HE1 TRP 75 HE1 TRP 75 3.053 7.524 -9.609
543 HE3 TRP 75 HE3 TRP 75 7.326 5.973 -12.420
544 HZ2 TRP 75 HZ2 TRP 75 3.522 9.148 -11.868
545 HZ3 TRP 75 HZ3 TRP 75 6.953 7.806 -14.019
546 HH2 TRP 75 HH2 TRP 75 5.089 9.359 -13.748
547 H ARG 76 H ARG 76 6.763 2.481 -7.525
548 HA ARG 76 HA ARG 76 4.316 2.975 -6.002
549 1HB ARG 76 1HB ARG 76 5.396 0.621 -4.884
550 2HB ARG 76 2HB ARG 76 3.851 0.812 -5.697
551 1HG ARG 76 1HG ARG 76 4.642 -0.030 -7.692
552 2HG ARG 76 2HG ARG 76 6.320 0.360 -7.311
553 1HD ARG 76 1HD ARG 76 5.132 -1.517 -5.430
554 2HD ARG 76 2HD ARG 76 5.137 -2.114 -7.087
555 HE ARG 76 HE ARG 76 7.576 -1.143 -5.743
556 1HH1 ARG 76 1HH1 ARG 76 5.906 -3.525 -7.692
557 2HH1 ARG 76 2HH1 ARG 76 7.330 -4.462 -7.978
558 1HH2 ARG 76 1HH2 ARG 76 9.440 -2.390 -6.127
559 2HH2 ARG 76 2HH2 ARG 76 9.329 -3.824 -7.090
560 H TYR 77 H TYR 77 5.095 2.132 -3.522
561 HA TYR 77 HA TYR 77 7.644 3.574 -3.111
562 1HB TYR 77 1HB TYR 77 5.473 3.584 -1.048
563 2HB TYR 77 2HB TYR 77 6.810 4.703 -1.252
564 HD1 TYR 77 HD1 TYR 77 6.758 6.233 -3.315
565 HD2 TYR 77 HD2 TYR 77 3.353 4.128 -1.886
566 HE1 TYR 77 HE1 TYR 77 5.297 7.796 -4.525
567 HE2 TYR 77 HE2 TYR 77 1.880 5.687 -3.093
568 HH TYR 77 HH TYR 77 1.945 7.221 -4.945
569 H TYR 78 H TYR 78 8.965 2.825 -1.411
570 HA TYR 78 HA TYR 78 8.438 0.061 -0.650
571 1HB TYR 78 1HB TYR 78 10.949 1.733 -0.550
572 2HB TYR 78 2HB TYR 78 10.855 0.105 0.090
573 HD1 TYR 78 HD1 TYR 78 12.903 0.277 -1.708
574 HD2 TYR 78 HD2 TYR 78 8.763 0.029 -2.656
575 HE1 TYR 78 HE1 TYR 78 13.469 -0.658 -3.907
576 HE2 TYR 78 HE2 TYR 78 9.320 -0.899 -4.860
577 HH TYR 78 HH TYR 78 11.245 -0.895 -6.430
578 H GLU 79 H GLU 79 9.105 -0.547 1.602
579 HA GLU 79 HA GLU 79 7.576 0.918 3.459
580 1HB GLU 79 1HB GLU 79 7.980 -1.474 3.716
581 2HB GLU 79 2HB GLU 79 9.698 -1.186 3.943
582 1HG GLU 79 1HG GLU 79 9.317 -1.114 6.119
583 2HG GLU 79 2HG GLU 79 8.451 0.399 5.858
584 H SER 80 H SER 80 10.941 1.018 2.583
585 HA SER 80 HA SER 80 12.107 2.219 4.774
586 1HB SER 80 1HB SER 80 13.465 3.432 2.783
587 2HB SER 80 2HB SER 80 13.716 1.747 3.239
588 HG SER 80 HG SER 80 12.752 2.769 0.932
589 H SER 81 H SER 81 11.453 4.180 1.886
590 HA SER 81 HA SER 81 10.571 6.343 3.671
591 1HB SER 81 1HB SER 81 12.598 6.273 1.650
592 2HB SER 81 2HB SER 81 11.399 7.503 1.277
593 HG SER 81 HG SER 81 11.705 8.132 3.576
594 H LEU 82 H LEU 82 9.252 8.046 2.506
595 HA LEU 82 HA LEU 82 7.034 6.721 1.191
596 1HB LEU 82 1HB LEU 82 7.498 9.301 2.559
597 2HB LEU 82 2HB LEU 82 6.315 9.326 1.266
598 HG LEU 82 HG LEU 82 5.494 8.930 3.664
599 1HD1 LEU 82 1HD1 LEU 82 4.730 7.524 1.179
600 2HD1 LEU 82 2HD1 LEU 82 3.997 6.955 2.679
601 3HD1 LEU 82 3HD1 LEU 82 3.805 8.638 2.187
602 1HD2 LEU 82 1HD2 LEU 82 6.543 6.175 3.032
603 2HD2 LEU 82 2HD2 LEU 82 7.136 7.251 4.299
604 3HD2 LEU 82 3HD2 LEU 82 5.501 6.597 4.391
605 H GLU 83 H GLU 83 9.851 7.764 0.025
606 HA GLU 83 HA GLU 83 9.089 9.491 -2.090
607 1HB GLU 83 1HB GLU 83 11.522 7.894 -1.418
608 2HB GLU 83 2HB GLU 83 11.358 8.536 -3.046
609 1HG GLU 83 1HG GLU 83 11.821 10.619 -2.399
610 2HG GLU 83 2HG GLU 83 10.808 10.499 -0.962
611 HA PRO 84 HA PRO 84 7.517 6.599 -5.033
612 1HB PRO 84 1HB PRO 84 8.562 8.151 -7.256
613 2HB PRO 84 2HB PRO 84 6.898 8.034 -6.679
614 1HG PRO 84 1HG PRO 84 8.400 10.299 -6.468
615 2HG PRO 84 2HG PRO 84 7.094 9.884 -5.344
616 1HD PRO 84 1HD PRO 84 10.054 9.557 -5.013
617 2HD PRO 84 2HD PRO 84 8.843 10.100 -3.836
618 H TYR 85 H TYR 85 8.203 4.779 -5.960
619 HA TYR 85 HA TYR 85 11.048 4.614 -6.694
620 1HB TYR 85 1HB TYR 85 9.259 2.760 -5.180
621 2HB TYR 85 2HB TYR 85 10.601 2.095 -6.103
622 HD1 TYR 85 HD1 TYR 85 12.391 1.576 -4.737
623 HD2 TYR 85 HD2 TYR 85 10.165 5.113 -3.904
624 HE1 TYR 85 HE1 TYR 85 13.915 2.092 -2.880
625 HE2 TYR 85 HE2 TYR 85 11.688 5.633 -2.043
626 HH TYR 85 HH TYR 85 13.911 5.130 -1.287
627 HA PRO 86 HA PRO 86 8.806 3.464 -10.514
628 1HB PRO 86 1HB PRO 86 10.204 4.975 -12.215
629 2HB PRO 86 2HB PRO 86 8.963 5.685 -11.175
630 1HG PRO 86 1HG PRO 86 11.935 5.712 -10.870
631 2HG PRO 86 2HG PRO 86 10.764 7.004 -10.555
632 1HD PRO 86 1HD PRO 86 11.874 5.347 -8.624
633 2HD PRO 86 2HD PRO 86 10.373 6.273 -8.433
634 H ASP 87 H ASP 87 9.550 2.343 -12.435
635 HA ASP 87 HA ASP 87 12.242 1.181 -12.141
636 1HB ASP 87 1HB ASP 87 11.209 -0.922 -13.146
637 2HB ASP 87 2HB ASP 87 10.765 -0.551 -11.483
No H/Q in entry = 637
Start of MODEL 3
1 H1 ILE 1 H1 ILE 1 -16.997 5.802 -0.272
2 H2 ILE 1 H2 ILE 1 -16.980 4.105 -0.513
3 H3 ILE 1 H3 ILE 1 -17.874 4.777 0.789
4 HA ILE 1 HA ILE 1 -16.022 5.321 1.970
5 HB ILE 1 HB ILE 1 -16.452 2.916 1.924
6 1HG1 ILE 1 1HG1 ILE 1 -13.509 3.551 1.995
7 2HG1 ILE 1 2HG1 ILE 1 -14.635 3.861 3.309
8 1HG2 ILE 1 1HG2 ILE 1 -15.019 3.090 -0.596
9 2HG2 ILE 1 2HG2 ILE 1 -14.443 1.786 0.443
10 3HG2 ILE 1 3HG2 ILE 1 -16.145 1.864 -0.014
11 1HD1 ILE 1 1HD1 ILE 1 -15.109 1.288 3.059
12 2HD1 ILE 1 2HD1 ILE 1 -13.495 1.297 2.348
13 3HD1 ILE 1 3HD1 ILE 1 -13.738 1.886 3.992
14 H VAL 2 H VAL 2 -13.705 5.510 2.164
15 HA VAL 2 HA VAL 2 -12.387 6.095 -0.392
16 HB VAL 2 HB VAL 2 -12.066 7.757 2.111
17 1HG1 VAL 2 1HG1 VAL 2 -10.358 7.492 -0.013
18 2HG1 VAL 2 2HG1 VAL 2 -11.316 8.900 -0.470
19 3HG1 VAL 2 3HG1 VAL 2 -10.445 8.886 1.061
20 1HG2 VAL 2 1HG2 VAL 2 -13.971 7.943 -0.141
21 2HG2 VAL 2 2HG2 VAL 2 -14.131 8.484 1.530
22 3HG2 VAL 2 3HG2 VAL 2 -13.210 9.448 0.375
23 H CYS 3 H CYS 3 -10.250 5.551 -0.555
24 HA CYS 3 HA CYS 3 -8.846 4.572 1.818
25 1HB CYS 3 1HB CYS 3 -9.027 2.943 -0.729
26 2HB CYS 3 2HB CYS 3 -8.209 2.483 0.757
27 H HIS 4 H HIS 4 -6.539 4.208 1.406
28 HA HIS 4 HA HIS 4 -5.510 6.321 -0.282
29 1HB HIS 4 1HB HIS 4 -3.886 4.411 1.391
30 2HB HIS 4 2HB HIS 4 -3.438 6.019 0.848
31 HD1 HIS 4 HD1 HIS 4 -4.747 8.027 2.023
32 HD2 HIS 4 HD2 HIS 4 -5.168 4.306 3.832
33 HE1 HIS 4 HE1 HIS 4 -5.651 8.484 4.319
34 HE2 HIS 4 HE2 HIS 4 -5.713 6.240 5.454
35 H THR 5 H THR 5 -4.006 6.018 -1.985
36 HA THR 5 HA THR 5 -3.718 3.265 -2.953
37 HB THR 5 HB THR 5 -5.603 4.849 -4.025
38 HG1 THR 5 HG1 THR 5 -3.942 3.079 -5.490
39 1HG2 THR 5 1HG2 THR 5 -4.006 6.551 -4.802
40 2HG2 THR 5 2HG2 THR 5 -3.211 5.324 -5.790
41 3HG2 THR 5 3HG2 THR 5 -4.883 5.781 -6.125
42 H THR 6 H THR 6 -2.104 3.008 -4.632
43 HA THR 6 HA THR 6 0.095 4.952 -4.379
44 HB THR 6 HB THR 6 1.561 2.934 -4.887
45 HG1 THR 6 HG1 THR 6 -0.739 1.496 -4.088
46 1HG2 THR 6 1HG2 THR 6 0.715 3.878 -2.477
47 2HG2 THR 6 2HG2 THR 6 0.304 2.166 -2.375
48 3HG2 THR 6 3HG2 THR 6 1.962 2.654 -2.715
49 H ALA 7 H ALA 7 -2.038 3.361 -6.525
50 HA ALA 7 HA ALA 7 -0.696 2.990 -8.862
51 1HB ALA 7 1HB ALA 7 -2.721 2.883 -9.848
52 2HB ALA 7 2HB ALA 7 -3.253 4.422 -9.171
53 3HB ALA 7 3HB ALA 7 -3.294 2.962 -8.182
54 H THR 8 H THR 8 -1.811 6.081 -7.576
55 HA THR 8 HA THR 8 -1.034 7.617 -9.850
56 HB THR 8 HB THR 8 -1.925 9.388 -8.747
57 HG1 THR 8 HG1 THR 8 -1.037 8.684 -6.187
58 1HG2 THR 8 1HG2 THR 8 -3.336 7.273 -8.034
59 2HG2 THR 8 2HG2 THR 8 -2.765 7.745 -6.430
60 3HG2 THR 8 3HG2 THR 8 -3.688 8.886 -7.412
61 H SER 9 H SER 9 0.589 9.612 -9.264
62 HA SER 9 HA SER 9 3.141 8.368 -9.021
63 1HB SER 9 1HB SER 9 2.210 10.834 -9.967
64 2HB SER 9 2HB SER 9 3.279 11.228 -8.623
65 HG SER 9 HG SER 9 3.850 9.891 -11.027
66 HA PRO 10 HA PRO 10 3.207 10.113 -4.638
67 1HB PRO 10 1HB PRO 10 1.454 12.158 -4.024
68 2HB PRO 10 2HB PRO 10 3.090 12.385 -4.630
69 1HG PRO 10 1HG PRO 10 0.656 13.042 -5.951
70 2HG PRO 10 2HG PRO 10 2.294 13.139 -6.615
71 1HD PRO 10 1HD PRO 10 0.244 11.005 -6.930
72 2HD PRO 10 2HD PRO 10 1.517 11.522 -8.050
73 H ILE 11 H ILE 11 2.167 9.444 -2.692
74 HA ILE 11 HA ILE 11 -0.091 7.775 -3.078
75 HB ILE 11 HB ILE 11 0.785 8.810 -0.395
76 1HG1 ILE 11 1HG1 ILE 11 1.896 6.482 -1.968
77 2HG1 ILE 11 2HG1 ILE 11 2.758 7.969 -1.588
78 1HG2 ILE 11 1HG2 ILE 11 -1.319 7.595 -0.435
79 2HG2 ILE 11 2HG2 ILE 11 -0.532 6.240 -1.246
80 3HG2 ILE 11 3HG2 ILE 11 -0.075 6.667 0.403
81 1HD1 ILE 11 1HD1 ILE 11 1.674 6.250 0.599
82 2HD1 ILE 11 2HD1 ILE 11 3.204 5.857 -0.185
83 3HD1 ILE 11 3HD1 ILE 11 3.007 7.403 0.638
84 H SER 12 H SER 12 -2.171 7.952 -2.348
85 HA SER 12 HA SER 12 -3.216 10.307 -1.125
86 1HB SER 12 1HB SER 12 -4.659 10.937 -3.148
87 2HB SER 12 2HB SER 12 -2.961 11.408 -3.203
88 HG SER 12 HG SER 12 -3.989 9.037 -4.373
89 H ALA 13 H ALA 13 -5.781 10.315 -1.610
90 HA ALA 13 HA ALA 13 -6.762 7.562 -1.704
91 1HB ALA 13 1HB ALA 13 -7.529 9.406 0.549
92 2HB ALA 13 2HB ALA 13 -7.938 7.701 0.359
93 3HB ALA 13 3HB ALA 13 -6.271 8.177 0.681
94 H VAL 14 H VAL 14 -8.971 7.364 -2.222
95 HA VAL 14 HA VAL 14 -10.481 9.796 -2.771
96 HB VAL 14 HB VAL 14 -9.070 8.946 -4.838
97 1HG1 VAL 14 1HG1 VAL 14 -10.280 6.646 -4.497
98 2HG1 VAL 14 2HG1 VAL 14 -11.567 7.428 -5.417
99 3HG1 VAL 14 3HG1 VAL 14 -9.957 7.256 -6.122
100 1HG2 VAL 14 1HG2 VAL 14 -11.217 10.601 -4.492
101 2HG2 VAL 14 2HG2 VAL 14 -10.308 10.407 -5.991
102 3HG2 VAL 14 3HG2 VAL 14 -11.790 9.486 -5.732
103 H THR 15 H THR 15 -12.604 8.985 -3.993
104 HA THR 15 HA THR 15 -13.838 7.092 -2.168
105 HB THR 15 HB THR 15 -15.591 8.145 -4.216
106 HG1 THR 15 HG1 THR 15 -14.940 10.117 -4.316
107 1HG2 THR 15 1HG2 THR 15 -15.469 8.635 -1.254
108 2HG2 THR 15 2HG2 THR 15 -16.802 9.082 -2.318
109 3HG2 THR 15 3HG2 THR 15 -16.405 7.381 -2.068
110 H CYS 16 H CYS 16 -13.380 5.038 -2.778
111 HA CYS 16 HA CYS 16 -13.023 4.147 -5.410
112 1HB CYS 16 1HB CYS 16 -14.121 2.181 -3.479
113 2HB CYS 16 2HB CYS 16 -12.733 2.054 -4.545
114 HA PRO 17 HA PRO 17 -17.209 4.121 -6.901
115 1HB PRO 17 1HB PRO 17 -16.857 2.414 -8.998
116 2HB PRO 17 2HB PRO 17 -16.365 4.110 -9.037
117 1HG PRO 17 1HG PRO 17 -14.714 1.667 -8.524
118 2HG PRO 17 2HG PRO 17 -14.331 3.092 -9.508
119 1HD PRO 17 1HD PRO 17 -13.346 2.758 -7.018
120 2HD PRO 17 2HD PRO 17 -13.747 4.361 -7.668
121 HA PRO 18 HA PRO 18 -19.567 0.618 -5.580
122 1HB PRO 18 1HB PRO 18 -19.930 -0.220 -8.431
123 2HB PRO 18 2HB PRO 18 -21.132 -0.071 -7.143
124 1HG PRO 18 1HG PRO 18 -20.928 1.802 -9.021
125 2HG PRO 18 2HG PRO 18 -21.243 2.239 -7.331
126 1HD PRO 18 1HD PRO 18 -18.749 2.514 -8.925
127 2HD PRO 18 2HD PRO 18 -19.354 3.516 -7.592
128 H GLY 19 H GLY 19 -17.077 0.105 -7.982
129 1HA GLY 19 1HA GLY 19 -15.538 -1.563 -8.267
130 2HA GLY 19 2HA GLY 19 -16.847 -2.673 -7.898
131 H GLU 20 H GLU 20 -15.063 -0.258 -5.931
132 HA GLU 20 HA GLU 20 -14.391 -2.467 -4.093
133 1HB GLU 20 1HB GLU 20 -12.878 0.112 -4.249
134 2HB GLU 20 2HB GLU 20 -12.363 -1.424 -3.575
135 1HG GLU 20 1HG GLU 20 -11.245 -1.673 -5.482
136 2HG GLU 20 2HG GLU 20 -12.810 -2.090 -6.175
137 H ASN 21 H ASN 21 -14.748 -2.265 -1.988
138 HA ASN 21 HA ASN 21 -16.021 0.197 -1.028
139 1HB ASN 21 1HB ASN 21 -17.116 -2.426 -1.173
140 2HB ASN 21 2HB ASN 21 -16.988 -1.945 0.508
141 2HD2 ASN 21 2HD2 ASN 21 -19.397 -2.299 -0.104
142 1HD2 ASN 21 1HD2 ASN 21 -20.248 -0.848 -0.467
143 H LEU 22 H LEU 22 -13.663 -2.234 -0.560
144 HA LEU 22 HA LEU 22 -13.140 -1.280 2.168
145 1HB LEU 22 1HB LEU 22 -12.334 -3.864 0.843
146 2HB LEU 22 2HB LEU 22 -11.943 -3.395 2.478
147 HG LEU 22 HG LEU 22 -14.786 -3.671 1.551
148 1HD1 LEU 22 1HD1 LEU 22 -13.085 -5.762 1.464
149 2HD1 LEU 22 2HD1 LEU 22 -13.608 -5.844 3.146
150 3HD1 LEU 22 3HD1 LEU 22 -14.800 -5.902 1.848
151 1HD2 LEU 22 1HD2 LEU 22 -13.423 -3.573 4.230
152 2HD2 LEU 22 2HD2 LEU 22 -14.616 -2.453 3.574
153 3HD2 LEU 22 3HD2 LEU 22 -15.095 -4.092 4.017
154 H CYS 23 H CYS 23 -10.724 -1.605 2.737
155 HA CYS 23 HA CYS 23 -9.092 -0.478 0.553
156 1HB CYS 23 1HB CYS 23 -8.513 -0.108 3.482
157 2HB CYS 23 2HB CYS 23 -7.905 0.834 2.131
158 H TYR 24 H TYR 24 -6.833 -1.105 0.521
159 HA TYR 24 HA TYR 24 -6.201 -3.497 2.090
160 1HB TYR 24 1HB TYR 24 -5.621 -4.832 0.250
161 2HB TYR 24 2HB TYR 24 -7.157 -4.100 -0.193
162 HD1 TYR 24 HD1 TYR 24 -3.488 -3.870 -0.743
163 HD2 TYR 24 HD2 TYR 24 -7.358 -2.768 -2.128
164 HE1 TYR 24 HE1 TYR 24 -2.496 -3.029 -2.825
165 HE2 TYR 24 HE2 TYR 24 -6.373 -1.919 -4.215
166 HH TYR 24 HH TYR 24 -3.409 -2.673 -5.290
167 H ARG 25 H ARG 25 -4.005 -3.972 2.340
168 HA ARG 25 HA ARG 25 -2.050 -2.059 1.316
169 1HB ARG 25 1HB ARG 25 -3.078 -2.028 4.003
170 2HB ARG 25 2HB ARG 25 -1.372 -2.450 4.034
171 1HG ARG 25 1HG ARG 25 -2.149 -0.158 2.338
172 2HG ARG 25 2HG ARG 25 -2.251 0.061 4.084
173 1HD ARG 25 1HD ARG 25 0.176 -0.804 2.517
174 2HD ARG 25 2HD ARG 25 -0.075 0.764 3.283
175 HE ARG 25 HE ARG 25 0.851 -1.614 4.533
176 1HH1 ARG 25 1HH1 ARG 25 -1.057 1.253 5.098
177 2HH1 ARG 25 2HH1 ARG 25 -0.767 1.261 6.805
178 1HH2 ARG 25 1HH2 ARG 25 1.233 -1.603 6.779
179 2HH2 ARG 25 2HH2 ARG 25 0.535 -0.357 7.758
180 H LYS 26 H LYS 26 -0.772 -3.477 0.254
181 HA LYS 26 HA LYS 26 -0.072 -6.024 1.515
182 1HB LYS 26 1HB LYS 26 -0.823 -5.951 -0.856
183 2HB LYS 26 2HB LYS 26 0.612 -5.018 -1.249
184 1HG LYS 26 1HG LYS 26 1.892 -6.837 -1.331
185 2HG LYS 26 2HG LYS 26 1.223 -7.479 0.171
186 1HD LYS 26 1HD LYS 26 0.410 -9.064 -1.235
187 2HD LYS 26 2HD LYS 26 -0.877 -7.876 -1.439
188 1HE LYS 26 1HE LYS 26 0.453 -6.956 -3.380
189 2HE LYS 26 2HE LYS 26 1.478 -8.384 -3.243
190 1HZ LYS 26 1HZ LYS 26 -0.918 -9.519 -3.313
191 2HZ LYS 26 2HZ LYS 26 -1.242 -8.141 -4.239
192 3HZ LYS 26 3HZ LYS 26 -0.008 -9.201 -4.704
193 H MET 27 H MET 27 2.028 -6.632 1.997
194 HA MET 27 HA MET 27 4.187 -4.755 1.512
195 1HB MET 27 1HB MET 27 3.165 -5.413 4.253
196 2HB MET 27 2HB MET 27 4.814 -4.880 3.987
197 1HG MET 27 1HG MET 27 4.072 -2.784 3.117
198 2HG MET 27 2HG MET 27 2.393 -3.322 3.126
199 1HE MET 27 1HE MET 27 5.494 -2.347 5.245
200 2HE MET 27 2HE MET 27 4.892 -2.439 6.901
201 3HE MET 27 3HE MET 27 5.124 -3.914 5.964
202 H TRP 28 H TRP 28 6.137 -5.653 1.359
203 HA TRP 28 HA TRP 28 6.951 -8.053 2.638
204 1HB TRP 28 1HB TRP 28 7.038 -9.624 0.842
205 2HB TRP 28 2HB TRP 28 5.389 -9.021 0.901
206 HD1 TRP 28 HD1 TRP 28 5.800 -6.363 -0.710
207 HE1 TRP 28 HE1 TRP 28 6.239 -6.452 -3.249
208 HE3 TRP 28 HE3 TRP 28 7.528 -11.149 -1.073
209 HZ2 TRP 28 HZ2 TRP 28 7.193 -8.274 -5.136
210 HZ3 TRP 28 HZ3 TRP 28 8.189 -11.997 -3.289
211 HH2 TRP 28 HH2 TRP 28 8.023 -10.590 -5.281
212 H CYS 29 H CYS 29 9.122 -7.864 2.842
213 HA CYS 29 HA CYS 29 10.553 -5.776 1.994
214 1HB CYS 29 1HB CYS 29 11.696 -8.518 2.388
215 2HB CYS 29 2HB CYS 29 12.631 -7.062 2.223
216 H ASP 30 H ASP 30 10.783 -4.945 0.093
217 HA ASP 30 HA ASP 30 10.942 -6.482 -2.307
218 1HB ASP 30 1HB ASP 30 11.132 -4.453 -3.452
219 2HB ASP 30 2HB ASP 30 10.219 -3.994 -2.030
220 H ALA 31 H ALA 31 12.756 -7.026 -3.395
221 HA ALA 31 HA ALA 31 14.889 -8.071 -2.207
222 1HB ALA 31 1HB ALA 31 15.765 -8.407 -4.254
223 2HB ALA 31 2HB ALA 31 14.219 -7.743 -4.783
224 3HB ALA 31 3HB ALA 31 15.644 -6.707 -4.707
225 H PHE 32 H PHE 32 14.767 -6.115 -0.568
226 HA PHE 32 HA PHE 32 17.358 -5.111 -0.392
227 1HB PHE 32 1HB PHE 32 15.556 -3.520 -1.905
228 2HB PHE 32 2HB PHE 32 15.863 -2.708 -0.388
229 HD1 PHE 32 HD1 PHE 32 16.773 -2.402 -3.518
230 HD2 PHE 32 HD2 PHE 32 18.628 -3.367 0.186
231 HE1 PHE 32 HE1 PHE 32 18.927 -1.596 -4.393
232 HE2 PHE 32 HE2 PHE 32 20.787 -2.563 -0.679
233 HZ PHE 32 HZ PHE 32 20.938 -1.676 -2.973
234 H CYS 33 H CYS 33 15.158 -6.526 1.137
235 HA CYS 33 HA CYS 33 13.861 -5.188 3.057
236 1HB CYS 33 1HB CYS 33 14.186 -7.724 2.801
237 2HB CYS 33 2HB CYS 33 15.575 -7.524 3.857
238 H SER 34 H SER 34 17.329 -5.361 2.807
239 HA SER 34 HA SER 34 17.829 -4.295 5.431
240 1HB SER 34 1HB SER 34 19.654 -4.563 3.027
241 2HB SER 34 2HB SER 34 20.172 -4.119 4.654
242 HG SER 34 HG SER 34 18.850 -6.542 3.995
243 H SER 35 H SER 35 18.019 -3.019 2.100
244 HA SER 35 HA SER 35 18.287 -0.303 3.151
245 1HB SER 35 1HB SER 35 19.492 -1.510 1.022
246 2HB SER 35 2HB SER 35 18.164 -0.667 0.226
247 HG SER 35 HG SER 35 18.933 1.250 0.957
248 H ARG 36 H ARG 36 16.457 -1.537 0.343
249 HA ARG 36 HA ARG 36 14.429 0.422 0.658
250 1HB ARG 36 1HB ARG 36 14.094 -2.100 -0.948
251 2HB ARG 36 2HB ARG 36 13.366 -0.533 -1.216
252 1HG ARG 36 1HG ARG 36 16.325 -0.810 -1.385
253 2HG ARG 36 2HG ARG 36 15.312 -1.333 -2.731
254 1HD ARG 36 1HD ARG 36 14.506 0.816 -3.117
255 2HD ARG 36 2HD ARG 36 14.954 1.376 -1.506
256 HE ARG 36 HE ARG 36 17.058 1.843 -2.284
257 1HH1 ARG 36 1HH1 ARG 36 15.396 -0.149 -4.620
258 2HH1 ARG 36 2HH1 ARG 36 16.624 0.026 -5.828
259 1HH2 ARG 36 1HH2 ARG 36 18.673 2.074 -3.873
260 2HH2 ARG 36 2HH2 ARG 36 18.485 1.288 -5.405
261 H GLY 37 H GLY 37 13.699 -3.145 0.528
262 1HA GLY 37 1HA GLY 37 12.419 -2.701 3.149
263 2HA GLY 37 2HA GLY 37 12.890 -4.251 2.497
264 H LYS 38 H LYS 38 10.501 -3.903 3.661
265 HA LYS 38 HA LYS 38 8.785 -5.203 2.121
266 1HB LYS 38 1HB LYS 38 7.473 -3.172 3.787
267 2HB LYS 38 2HB LYS 38 7.185 -4.894 3.671
268 1HG LYS 38 1HG LYS 38 9.464 -5.121 4.862
269 2HG LYS 38 2HG LYS 38 9.213 -3.431 5.303
270 1HD LYS 38 1HD LYS 38 7.153 -3.970 6.417
271 2HD LYS 38 2HD LYS 38 7.227 -5.637 5.840
272 1HE LYS 38 1HE LYS 38 9.618 -5.417 7.099
273 2HE LYS 38 2HE LYS 38 8.627 -4.338 8.079
274 1HZ LYS 38 1HZ LYS 38 6.980 -6.300 8.072
275 2HZ LYS 38 2HZ LYS 38 8.319 -7.233 7.628
276 3HZ LYS 38 3HZ LYS 38 8.333 -6.376 9.086
277 H VAL 39 H VAL 39 8.303 -4.871 0.116
278 HA VAL 39 HA VAL 39 7.931 -2.440 -1.209
279 HB VAL 39 HB VAL 39 7.423 -5.277 -1.740
280 1HG1 VAL 39 1HG1 VAL 39 5.395 -3.301 -2.654
281 2HG1 VAL 39 2HG1 VAL 39 5.869 -4.603 -3.742
282 3HG1 VAL 39 3HG1 VAL 39 5.195 -4.977 -2.156
283 1HG2 VAL 39 1HG2 VAL 39 8.821 -3.109 -2.913
284 2HG2 VAL 39 2HG2 VAL 39 8.919 -4.829 -3.295
285 3HG2 VAL 39 3HG2 VAL 39 7.751 -3.806 -4.129
286 H VAL 40 H VAL 40 6.304 -0.960 -1.010
287 HA VAL 40 HA VAL 40 3.924 -1.802 0.468
288 HB VAL 40 HB VAL 40 4.994 0.973 -0.040
289 1HG1 VAL 40 1HG1 VAL 40 2.363 0.031 0.799
290 2HG1 VAL 40 2HG1 VAL 40 3.094 1.168 1.933
291 3HG1 VAL 40 3HG1 VAL 40 2.871 1.625 0.244
292 1HG2 VAL 40 1HG2 VAL 40 5.087 -0.921 2.259
293 2HG2 VAL 40 2HG2 VAL 40 6.337 0.147 1.628
294 3HG2 VAL 40 3HG2 VAL 40 5.007 0.813 2.577
295 H GLU 41 H GLU 41 2.293 -2.346 -0.660
296 HA GLU 41 HA GLU 41 1.551 -0.828 -3.072
297 1HB GLU 41 1HB GLU 41 2.255 -3.429 -3.163
298 2HB GLU 41 2HB GLU 41 0.565 -3.618 -2.716
299 1HG GLU 41 1HG GLU 41 1.306 -1.861 -5.010
300 2HG GLU 41 2HG GLU 41 1.261 -3.612 -5.215
301 H LEU 42 H LEU 42 -0.679 -0.279 -3.186
302 HA LEU 42 HA LEU 42 -2.521 -1.257 -1.249
303 1HB LEU 42 1HB LEU 42 -2.142 0.091 0.446
304 2HB LEU 42 2HB LEU 42 -0.751 0.726 -0.397
305 HG LEU 42 HG LEU 42 -3.254 2.015 -1.206
306 1HD1 LEU 42 1HD1 LEU 42 -3.146 1.389 1.467
307 2HD1 LEU 42 2HD1 LEU 42 -2.471 3.017 1.398
308 3HD1 LEU 42 3HD1 LEU 42 -4.074 2.698 0.739
309 1HD2 LEU 42 1HD2 LEU 42 -0.483 2.783 -0.399
310 2HD2 LEU 42 2HD2 LEU 42 -1.348 3.113 -1.901
311 3HD2 LEU 42 3HD2 LEU 42 -1.755 4.003 -0.435
312 H GLY 43 H GLY 43 -4.580 -0.136 -1.256
313 1HA GLY 43 1HA GLY 43 -5.366 0.466 -3.957
314 2HA GLY 43 2HA GLY 43 -5.480 1.850 -2.877
315 H CYS 44 H CYS 44 -7.765 0.969 -4.041
316 HA CYS 44 HA CYS 44 -9.298 0.188 -1.728
317 1HB CYS 44 1HB CYS 44 -10.164 0.714 -4.584
318 2HB CYS 44 2HB CYS 44 -11.254 0.452 -3.228
319 H ALA 45 H ALA 45 -11.022 -1.529 -1.982
320 HA ALA 45 HA ALA 45 -10.582 -3.655 -3.835
321 1HB ALA 45 1HB ALA 45 -8.868 -4.586 -2.710
322 2HB ALA 45 2HB ALA 45 -9.266 -3.758 -1.206
323 3HB ALA 45 3HB ALA 45 -10.148 -5.212 -1.671
324 H ALA 46 H ALA 46 -12.349 -4.941 -3.989
325 HA ALA 46 HA ALA 46 -14.663 -4.220 -2.429
326 1HB ALA 46 1HB ALA 46 -15.882 -5.135 -4.091
327 2HB ALA 46 2HB ALA 46 -14.365 -5.035 -4.986
328 3HB ALA 46 3HB ALA 46 -14.839 -6.551 -4.220
329 H THR 47 H THR 47 -12.384 -6.854 -2.599
330 HA THR 47 HA THR 47 -13.513 -7.963 -0.141
331 HB THR 47 HB THR 47 -14.466 -9.293 -1.983
332 HG1 THR 47 HG1 THR 47 -13.698 -11.322 -1.233
333 1HG2 THR 47 1HG2 THR 47 -11.599 -9.827 -2.707
334 2HG2 THR 47 2HG2 THR 47 -12.962 -10.798 -3.266
335 3HG2 THR 47 3HG2 THR 47 -12.847 -9.096 -3.715
336 H CYS 48 H CYS 48 -11.835 -10.144 0.126
337 HA CYS 48 HA CYS 48 -9.295 -8.797 0.573
338 1HB CYS 48 1HB CYS 48 -10.704 -11.071 1.778
339 2HB CYS 48 2HB CYS 48 -8.958 -11.244 1.686
340 HA PRO 49 HA PRO 49 -7.780 -10.834 -3.147
341 1HB PRO 49 1HB PRO 49 -5.258 -9.818 -3.016
342 2HB PRO 49 2HB PRO 49 -6.638 -8.914 -3.648
343 1HG PRO 49 1HG PRO 49 -5.379 -8.795 -0.934
344 2HG PRO 49 2HG PRO 49 -5.940 -7.466 -1.967
345 1HD PRO 49 1HD PRO 49 -7.399 -8.378 0.108
346 2HD PRO 49 2HD PRO 49 -8.154 -7.779 -1.382
347 H SER 50 H SER 50 -5.546 -11.976 -3.605
348 HA SER 50 HA SER 50 -5.423 -14.253 -1.998
349 1HB SER 50 1HB SER 50 -3.024 -14.365 -3.205
350 2HB SER 50 2HB SER 50 -4.531 -14.715 -4.051
351 HG SER 50 HG SER 50 -3.289 -13.236 -5.229
352 H LYS 51 H LYS 51 -3.344 -15.056 -0.953
353 HA LYS 51 HA LYS 51 -1.854 -12.964 0.420
354 1HB LYS 51 1HB LYS 51 -3.963 -14.428 1.628
355 2HB LYS 51 2HB LYS 51 -2.450 -14.885 2.387
356 1HG LYS 51 1HG LYS 51 -2.733 -13.092 3.670
357 2HG LYS 51 2HG LYS 51 -2.251 -12.157 2.253
358 1HD LYS 51 1HD LYS 51 -4.235 -11.149 2.359
359 2HD LYS 51 2HD LYS 51 -4.960 -12.681 1.868
360 1HE LYS 51 1HE LYS 51 -5.452 -13.286 4.074
361 2HE LYS 51 2HE LYS 51 -4.329 -12.104 4.743
362 1HZ LYS 51 1HZ LYS 51 -6.746 -11.315 3.225
363 2HZ LYS 51 2HZ LYS 51 -6.763 -11.544 4.900
364 3HZ LYS 51 3HZ LYS 51 -5.778 -10.348 4.219
365 H LYS 52 H LYS 52 -0.031 -13.647 -0.722
366 HA LYS 52 HA LYS 52 0.822 -16.380 -0.704
367 1HB LYS 52 1HB LYS 52 1.518 -14.029 -2.098
368 2HB LYS 52 2HB LYS 52 2.972 -14.544 -1.254
369 1HG LYS 52 1HG LYS 52 3.299 -15.851 -3.032
370 2HG LYS 52 2HG LYS 52 2.082 -16.897 -2.297
371 1HD LYS 52 1HD LYS 52 1.409 -14.673 -4.214
372 2HD LYS 52 2HD LYS 52 1.714 -16.334 -4.728
373 1HE LYS 52 1HE LYS 52 -0.370 -15.565 -2.694
374 2HE LYS 52 2HE LYS 52 -0.704 -15.743 -4.416
375 1HZ LYS 52 1HZ LYS 52 0.452 -18.058 -3.975
376 2HZ LYS 52 2HZ LYS 52 -0.133 -17.787 -2.411
377 3HZ LYS 52 3HZ LYS 52 -1.204 -17.826 -3.720
378 HA PRO 53 HA PRO 53 3.010 -16.936 3.069
379 1HB PRO 53 1HB PRO 53 5.419 -17.428 1.366
380 2HB PRO 53 2HB PRO 53 4.776 -18.385 2.706
381 1HG PRO 53 1HG PRO 53 4.389 -19.154 0.188
382 2HG PRO 53 2HG PRO 53 3.110 -19.337 1.403
383 1HD PRO 53 1HD PRO 53 3.341 -17.378 -0.824
384 2HD PRO 53 2HD PRO 53 1.891 -18.091 -0.090
385 H TYR 54 H TYR 54 5.307 -15.511 0.734
386 HA TYR 54 HA TYR 54 6.420 -13.797 2.751
387 1HB TYR 54 1HB TYR 54 7.164 -14.710 0.153
388 2HB TYR 54 2HB TYR 54 7.320 -12.963 0.236
389 HD1 TYR 54 HD1 TYR 54 8.436 -12.171 2.584
390 HD2 TYR 54 HD2 TYR 54 9.053 -15.916 0.662
391 HE1 TYR 54 HE1 TYR 54 10.577 -12.419 3.768
392 HE2 TYR 54 HE2 TYR 54 11.194 -16.176 1.841
393 HH TYR 54 HH TYR 54 12.859 -14.855 2.950
394 H GLU 55 H GLU 55 4.541 -13.344 -0.205
395 HA GLU 55 HA GLU 55 4.222 -10.514 0.281
396 1HB GLU 55 1HB GLU 55 4.440 -11.288 -2.009
397 2HB GLU 55 2HB GLU 55 3.055 -12.353 -1.816
398 1HG GLU 55 1HG GLU 55 2.232 -9.729 -1.146
399 2HG GLU 55 2HG GLU 55 3.119 -9.652 -2.667
400 H GLU 56 H GLU 56 2.938 -10.020 1.977
401 HA GLU 56 HA GLU 56 0.295 -11.313 2.097
402 1HB GLU 56 1HB GLU 56 2.266 -10.643 4.210
403 2HB GLU 56 2HB GLU 56 0.573 -10.397 4.600
404 1HG GLU 56 1HG GLU 56 0.147 -12.757 3.932
405 2HG GLU 56 2HG GLU 56 1.889 -12.963 3.750
406 H VAL 57 H VAL 57 -1.465 -10.018 2.773
407 HA VAL 57 HA VAL 57 -1.079 -7.136 2.872
408 HB VAL 57 HB VAL 57 -1.429 -7.227 0.584
409 1HG1 VAL 57 1HG1 VAL 57 -3.106 -9.589 1.190
410 2HG1 VAL 57 2HG1 VAL 57 -3.508 -8.653 -0.250
411 3HG1 VAL 57 3HG1 VAL 57 -1.897 -9.349 -0.071
412 1HG2 VAL 57 1HG2 VAL 57 -3.028 -5.707 1.694
413 2HG2 VAL 57 2HG2 VAL 57 -3.614 -6.309 0.145
414 3HG2 VAL 57 3HG2 VAL 57 -4.236 -6.990 1.648
415 H THR 58 H THR 58 -2.942 -5.990 3.621
416 HA THR 58 HA THR 58 -4.862 -7.699 5.053
417 HB THR 58 HB THR 58 -3.928 -6.890 6.916
418 HG1 THR 58 HG1 THR 58 -4.731 -4.839 7.550
419 1HG2 THR 58 1HG2 THR 58 -2.702 -4.771 5.206
420 2HG2 THR 58 2HG2 THR 58 -2.663 -4.657 6.965
421 3HG2 THR 58 3HG2 THR 58 -1.917 -6.034 6.154
422 H CYS 59 H CYS 59 -6.953 -7.174 4.977
423 HA CYS 59 HA CYS 59 -7.701 -4.798 3.410
424 1HB CYS 59 1HB CYS 59 -9.799 -6.735 3.375
425 2HB CYS 59 2HB CYS 59 -8.835 -6.138 2.037
426 H CYS 60 H CYS 60 -8.785 -3.316 4.602
427 HA CYS 60 HA CYS 60 -10.359 -4.289 6.895
428 1HB CYS 60 1HB CYS 60 -9.817 -2.312 8.116
429 2HB CYS 60 2HB CYS 60 -8.307 -2.954 7.480
430 H SER 61 H SER 61 -11.951 -2.409 7.598
431 HA SER 61 HA SER 61 -13.257 -1.332 5.196
432 1HB SER 61 1HB SER 61 -15.375 -2.154 5.799
433 2HB SER 61 2HB SER 61 -14.295 -3.513 6.109
434 HG SER 61 HG SER 61 -15.660 -1.870 7.903
435 H THR 62 H THR 62 -11.582 -0.108 7.319
436 HA THR 62 HA THR 62 -13.583 1.686 8.528
437 HB THR 62 HB THR 62 -10.763 1.788 9.441
438 HG1 THR 62 HG1 THR 62 -10.690 -0.174 10.160
439 1HG2 THR 62 1HG2 THR 62 -13.072 2.836 10.393
440 2HG2 THR 62 2HG2 THR 62 -12.923 1.374 11.367
441 3HG2 THR 62 3HG2 THR 62 -11.618 2.560 11.352
442 H ASP 63 H ASP 63 -13.442 2.420 6.094
443 HA ASP 63 HA ASP 63 -12.837 4.014 4.576
444 1HB ASP 63 1HB ASP 63 -13.303 5.277 6.922
445 2HB ASP 63 2HB ASP 63 -11.631 5.759 6.650
446 H LYS 64 H LYS 64 -10.633 5.870 4.717
447 HA LYS 64 HA LYS 64 -8.581 4.337 3.650
448 1HB LYS 64 1HB LYS 64 -7.388 6.379 3.423
449 2HB LYS 64 2HB LYS 64 -9.078 6.767 3.192
450 1HG LYS 64 1HG LYS 64 -9.077 7.396 5.681
451 2HG LYS 64 2HG LYS 64 -7.320 7.407 5.528
452 1HD LYS 64 1HD LYS 64 -8.240 9.641 5.205
453 2HD LYS 64 2HD LYS 64 -7.478 9.049 3.728
454 1HE LYS 64 1HE LYS 64 -9.370 9.315 2.602
455 2HE LYS 64 2HE LYS 64 -10.234 8.284 3.742
456 1HZ LYS 64 1HZ LYS 64 -9.688 10.984 4.653
457 2HZ LYS 64 2HZ LYS 64 -10.784 10.860 3.369
458 3HZ LYS 64 3HZ LYS 64 -11.085 10.046 4.821
459 H CYS 65 H CYS 65 -8.727 2.857 5.523
460 HA CYS 65 HA CYS 65 -7.204 3.602 7.869
461 1HB CYS 65 1HB CYS 65 -8.538 2.109 8.871
462 2HB CYS 65 2HB CYS 65 -9.307 1.810 7.329
463 H ASN 66 H ASN 66 -6.384 2.827 4.856
464 HA ASN 66 HA ASN 66 -4.190 1.057 5.645
465 1HB ASN 66 1HB ASN 66 -4.020 0.571 3.220
466 2HB ASN 66 2HB ASN 66 -5.510 0.040 3.982
467 2HD2 ASN 66 2HD2 ASN 66 -5.065 0.449 1.266
468 1HD2 ASN 66 1HD2 ASN 66 -6.118 1.701 0.720
469 HA PRO 67 HA PRO 67 -2.197 5.095 4.350
470 1HB PRO 67 1HB PRO 67 -1.440 6.134 6.677
471 2HB PRO 67 2HB PRO 67 -3.113 6.297 6.124
472 1HG PRO 67 1HG PRO 67 -1.957 4.383 8.117
473 2HG PRO 67 2HG PRO 67 -3.465 5.311 8.204
474 1HD PRO 67 1HD PRO 67 -3.303 2.665 7.430
475 2HD PRO 67 2HD PRO 67 -4.616 3.767 6.984
476 H HIS 68 H HIS 68 -0.119 4.960 3.716
477 HA HIS 68 HA HIS 68 1.610 2.914 4.092
478 1HB HIS 68 1HB HIS 68 1.856 5.091 2.665
479 2HB HIS 68 2HB HIS 68 2.755 5.692 4.053
480 HD1 HIS 68 HD1 HIS 68 5.017 4.442 4.612
481 HD2 HIS 68 HD2 HIS 68 3.231 3.331 1.040
482 HE1 HIS 68 HE1 HIS 68 6.785 3.197 3.339
483 HE2 HIS 68 HE2 HIS 68 5.706 2.607 1.143
484 HA PRO 69 HA PRO 69 2.780 2.808 8.380
485 1HB PRO 69 1HB PRO 69 5.370 1.757 7.392
486 2HB PRO 69 2HB PRO 69 4.229 1.047 8.538
487 1HG PRO 69 1HG PRO 69 4.458 0.089 6.060
488 2HG PRO 69 2HG PRO 69 2.881 0.182 6.866
489 1HD PRO 69 1HD PRO 69 4.043 1.956 4.757
490 2HD PRO 69 2HD PRO 69 2.375 1.378 4.954
491 H LYS 70 H LYS 70 4.432 4.633 6.018
492 HA LYS 70 HA LYS 70 5.844 6.115 8.126
493 1HB LYS 70 1HB LYS 70 7.007 4.698 5.960
494 2HB LYS 70 2HB LYS 70 7.207 6.412 5.625
495 1HG LYS 70 1HG LYS 70 7.897 5.364 8.327
496 2HG LYS 70 2HG LYS 70 9.007 5.104 6.979
497 1HD LYS 70 1HD LYS 70 7.919 7.804 7.769
498 2HD LYS 70 2HD LYS 70 9.467 7.164 8.325
499 1HE LYS 70 1HE LYS 70 8.636 7.868 5.523
500 2HE LYS 70 2HE LYS 70 9.960 8.543 6.472
501 1HZ LYS 70 1HZ LYS 70 10.838 6.137 6.437
502 2HZ LYS 70 2HZ LYS 70 9.796 5.931 5.121
503 3HZ LYS 70 3HZ LYS 70 11.026 7.092 5.054
504 H GLN 71 H GLN 71 3.343 6.303 6.125
505 HA GLN 71 HA GLN 71 3.734 8.645 4.626
506 1HB GLN 71 1HB GLN 71 1.605 6.839 5.161
507 2HB GLN 71 2HB GLN 71 1.007 8.465 5.451
508 1HG GLN 71 1HG GLN 71 2.210 8.910 3.131
509 2HG GLN 71 2HG GLN 71 1.891 7.187 2.934
510 2HE2 GLN 71 2HE2 GLN 71 0.758 9.887 1.894
511 1HE2 GLN 71 1HE2 GLN 71 -0.950 9.629 1.956
512 H ARG 72 H ARG 72 2.127 10.589 5.085
513 HA ARG 72 HA ARG 72 3.056 11.748 7.573
514 1HB ARG 72 1HB ARG 72 2.955 12.888 5.243
515 2HB ARG 72 2HB ARG 72 1.252 13.128 5.610
516 1HG ARG 72 1HG ARG 72 1.976 14.261 7.733
517 2HG ARG 72 2HG ARG 72 3.626 14.201 7.108
518 1HD ARG 72 1HD ARG 72 1.256 15.611 5.893
519 2HD ARG 72 2HD ARG 72 2.694 16.350 6.594
520 HE ARG 72 HE ARG 72 3.482 14.664 4.499
521 1HH1 ARG 72 1HH1 ARG 72 1.766 17.661 5.002
522 2HH1 ARG 72 2HH1 ARG 72 2.197 18.312 3.457
523 1HH2 ARG 72 1HH2 ARG 72 4.051 15.520 2.466
524 2HH2 ARG 72 2HH2 ARG 72 3.494 17.098 2.017
525 HA PRO 73 HA PRO 73 -0.878 10.516 9.437
526 1HB PRO 73 1HB PRO 73 -0.205 11.187 11.974
527 2HB PRO 73 2HB PRO 73 0.335 9.690 11.207
528 1HG PRO 73 1HG PRO 73 1.806 12.273 11.563
529 2HG PRO 73 2HG PRO 73 2.388 10.614 11.794
530 1HD PRO 73 1HD PRO 73 2.923 12.048 9.560
531 2HD PRO 73 2HD PRO 73 2.725 10.284 9.538
532 H GLY 74 H GLY 74 -2.653 11.629 10.295
533 1HA GLY 74 1HA GLY 74 -3.935 13.612 9.880
534 2HA GLY 74 2HA GLY 74 -2.460 14.553 10.037
535 H1 TRP 75 H1 TRP 75 3.562 2.945 -11.260
536 H2 TRP 75 H2 TRP 75 4.943 2.733 -12.256
537 H3 TRP 75 H3 TRP 75 4.232 1.380 -11.480
538 HA TRP 75 HA TRP 75 6.168 1.953 -10.325
539 1HB TRP 75 1HB TRP 75 6.179 4.308 -9.258
540 2HB TRP 75 2HB TRP 75 6.591 4.170 -10.964
541 HD1 TRP 75 HD1 TRP 75 3.233 4.653 -9.052
542 HE1 TRP 75 HE1 TRP 75 1.927 6.530 -10.237
543 HE3 TRP 75 HE3 TRP 75 6.591 5.777 -12.738
544 HZ2 TRP 75 HZ2 TRP 75 2.277 8.261 -12.440
545 HZ3 TRP 75 HZ3 TRP 75 6.030 7.558 -14.344
546 HH2 TRP 75 HH2 TRP 75 3.917 8.772 -14.196
547 H ARG 76 H ARG 76 6.327 2.192 -7.958
548 HA ARG 76 HA ARG 76 3.824 2.296 -6.485
549 1HB ARG 76 1HB ARG 76 5.033 0.009 -5.450
550 2HB ARG 76 2HB ARG 76 3.552 0.077 -6.387
551 1HG ARG 76 1HG ARG 76 4.581 -0.611 -8.323
552 2HG ARG 76 2HG ARG 76 6.163 -0.010 -7.820
553 1HD ARG 76 1HD ARG 76 4.742 -2.460 -6.794
554 2HD ARG 76 2HD ARG 76 6.192 -2.411 -7.795
555 HE ARG 76 HE ARG 76 7.442 -1.781 -5.941
556 1HH1 ARG 76 1HH1 ARG 76 4.049 -2.018 -5.133
557 2HH1 ARG 76 2HH1 ARG 76 4.330 -1.936 -3.428
558 1HH2 ARG 76 1HH2 ARG 76 7.801 -1.657 -3.731
559 2HH2 ARG 76 2HH2 ARG 76 6.472 -1.730 -2.633
560 H TYR 77 H TYR 77 4.700 1.384 -4.014
561 HA TYR 77 HA TYR 77 7.091 3.063 -3.558
562 1HB TYR 77 1HB TYR 77 4.823 2.819 -1.605
563 2HB TYR 77 2HB TYR 77 6.168 3.944 -1.561
564 HD1 TYR 77 HD1 TYR 77 3.448 3.051 -3.989
565 HD2 TYR 77 HD2 TYR 77 5.642 6.117 -2.019
566 HE1 TYR 77 HE1 TYR 77 2.082 4.753 -5.120
567 HE2 TYR 77 HE2 TYR 77 4.279 7.824 -3.145
568 HH TYR 77 HH TYR 77 2.161 7.073 -5.734
569 H TYR 78 H TYR 78 8.398 2.542 -1.807
570 HA TYR 78 HA TYR 78 8.228 -0.242 -0.930
571 1HB TYR 78 1HB TYR 78 10.583 1.667 -0.809
572 2HB TYR 78 2HB TYR 78 10.608 -0.032 -0.390
573 HD1 TYR 78 HD1 TYR 78 8.552 -0.157 -3.067
574 HD2 TYR 78 HD2 TYR 78 12.607 0.786 -2.199
575 HE1 TYR 78 HE1 TYR 78 9.173 -0.740 -5.369
576 HE2 TYR 78 HE2 TYR 78 13.240 0.202 -4.501
577 HH TYR 78 HH TYR 78 11.655 0.169 -6.892
578 H GLU 79 H GLU 79 8.975 -0.552 1.420
579 HA GLU 79 HA GLU 79 7.313 1.072 3.058
580 1HB GLU 79 1HB GLU 79 7.607 -1.261 3.591
581 2HB GLU 79 2HB GLU 79 9.342 -1.050 3.776
582 1HG GLU 79 1HG GLU 79 7.610 0.613 5.496
583 2HG GLU 79 2HG GLU 79 7.639 -1.118 5.830
584 H SER 80 H SER 80 10.846 0.630 3.024
585 HA SER 80 HA SER 80 11.396 2.570 4.974
586 1HB SER 80 1HB SER 80 13.680 2.291 4.395
587 2HB SER 80 2HB SER 80 12.922 0.721 4.147
588 HG SER 80 HG SER 80 12.834 1.188 1.924
589 H SER 81 H SER 81 10.408 3.002 1.736
590 HA SER 81 HA SER 81 11.291 5.805 1.863
591 1HB SER 81 1HB SER 81 11.078 5.367 -0.815
592 2HB SER 81 2HB SER 81 12.584 5.273 0.094
593 HG SER 81 HG SER 81 11.585 3.381 -1.312
594 H LEU 82 H LEU 82 9.531 6.973 2.263
595 HA LEU 82 HA LEU 82 6.895 6.235 1.597
596 1HB LEU 82 1HB LEU 82 8.118 8.107 3.199
597 2HB LEU 82 2HB LEU 82 7.422 9.101 1.940
598 HG LEU 82 HG LEU 82 6.161 8.436 4.206
599 1HD1 LEU 82 1HD1 LEU 82 5.393 9.424 1.588
600 2HD1 LEU 82 2HD1 LEU 82 4.054 8.660 2.444
601 3HD1 LEU 82 3HD1 LEU 82 4.935 9.992 3.194
602 1HD2 LEU 82 1HD2 LEU 82 6.115 6.026 3.553
603 2HD2 LEU 82 2HD2 LEU 82 4.531 6.730 3.882
604 3HD2 LEU 82 3HD2 LEU 82 5.052 6.469 2.218
605 H GLU 83 H GLU 83 9.392 7.817 -0.181
606 HA GLU 83 HA GLU 83 7.775 9.271 -1.991
607 1HB GLU 83 1HB GLU 83 10.578 8.218 -2.372
608 2HB GLU 83 2HB GLU 83 9.812 9.486 -3.310
609 1HG GLU 83 1HG GLU 83 9.536 10.566 -0.902
610 2HG GLU 83 2HG GLU 83 10.955 9.568 -0.587
611 HA PRO 84 HA PRO 84 6.571 6.260 -4.977
612 1HB PRO 84 1HB PRO 84 7.399 7.904 -7.240
613 2HB PRO 84 2HB PRO 84 5.769 7.559 -6.658
614 1HG PRO 84 1HG PRO 84 6.908 10.012 -6.463
615 2HG PRO 84 2HG PRO 84 5.724 9.404 -5.292
616 1HD PRO 84 1HD PRO 84 8.714 9.514 -5.078
617 2HD PRO 84 2HD PRO 84 7.487 9.897 -3.856
618 H TYR 85 H TYR 85 7.332 4.626 -6.287
619 HA TYR 85 HA TYR 85 10.140 4.748 -7.112
620 1HB TYR 85 1HB TYR 85 8.888 2.884 -5.163
621 2HB TYR 85 2HB TYR 85 10.079 2.216 -6.273
622 HD1 TYR 85 HD1 TYR 85 12.256 2.146 -5.491
623 HD2 TYR 85 HD2 TYR 85 9.695 5.248 -4.078
624 HE1 TYR 85 HE1 TYR 85 14.061 2.973 -4.045
625 HE2 TYR 85 HE2 TYR 85 11.499 6.076 -2.632
626 HH TYR 85 HH TYR 85 14.649 5.300 -2.981
627 HA PRO 86 HA PRO 86 8.627 2.886 -10.821
628 1HB PRO 86 1HB PRO 86 10.863 1.610 -11.691
629 2HB PRO 86 2HB PRO 86 10.667 3.365 -11.768
630 1HG PRO 86 1HG PRO 86 12.137 1.710 -9.752
631 2HG PRO 86 2HG PRO 86 12.629 3.229 -10.527
632 1HD PRO 86 1HD PRO 86 11.612 3.140 -8.021
633 2HD PRO 86 2HD PRO 86 11.339 4.514 -9.111
634 H ASP 87 H ASP 87 7.635 1.026 -11.427
635 HA ASP 87 HA ASP 87 7.369 -1.095 -9.611
636 1HB ASP 87 1HB ASP 87 6.108 -2.225 -11.384
637 2HB ASP 87 2HB ASP 87 5.645 -0.530 -11.268
No H/Q in entry = 637
Start of MODEL 4
1 H1 ILE 1 H1 ILE 1 -17.199 4.403 -0.490
2 H2 ILE 1 H2 ILE 1 -18.100 4.158 0.951
3 H3 ILE 1 H3 ILE 1 -17.717 5.749 0.441
4 HA ILE 1 HA ILE 1 -16.245 5.340 2.113
5 HB ILE 1 HB ILE 1 -16.675 2.950 2.312
6 1HG1 ILE 1 1HG1 ILE 1 -13.743 3.583 2.033
7 2HG1 ILE 1 2HG1 ILE 1 -14.730 3.926 3.447
8 1HG2 ILE 1 1HG2 ILE 1 -15.023 2.770 -0.179
9 2HG2 ILE 1 2HG2 ILE 1 -15.270 1.392 0.894
10 3HG2 ILE 1 3HG2 ILE 1 -16.651 2.152 0.103
11 1HD1 ILE 1 1HD1 ILE 1 -15.093 1.218 2.988
12 2HD1 ILE 1 2HD1 ILE 1 -13.379 1.500 2.684
13 3HD1 ILE 1 3HD1 ILE 1 -14.087 1.961 4.232
14 H VAL 2 H VAL 2 -13.938 5.560 2.095
15 HA VAL 2 HA VAL 2 -12.866 5.979 -0.608
16 HB VAL 2 HB VAL 2 -12.187 7.650 1.816
17 1HG1 VAL 2 1HG1 VAL 2 -10.737 7.285 -0.467
18 2HG1 VAL 2 2HG1 VAL 2 -11.693 8.711 -0.867
19 3HG1 VAL 2 3HG1 VAL 2 -10.662 8.713 0.563
20 1HG2 VAL 2 1HG2 VAL 2 -14.579 7.739 0.555
21 2HG2 VAL 2 2HG2 VAL 2 -13.813 9.129 1.323
22 3HG2 VAL 2 3HG2 VAL 2 -13.654 8.883 -0.416
23 H CYS 3 H CYS 3 -10.774 5.344 -0.990
24 HA CYS 3 HA CYS 3 -9.286 4.196 1.264
25 1HB CYS 3 1HB CYS 3 -9.771 2.847 -1.400
26 2HB CYS 3 2HB CYS 3 -8.640 2.270 -0.184
27 H HIS 4 H HIS 4 -6.996 3.703 0.650
28 HA HIS 4 HA HIS 4 -5.933 6.029 -0.737
29 1HB HIS 4 1HB HIS 4 -4.457 3.926 0.849
30 2HB HIS 4 2HB HIS 4 -3.825 5.481 0.319
31 HD1 HIS 4 HD1 HIS 4 -5.459 7.572 1.308
32 HD2 HIS 4 HD2 HIS 4 -5.230 4.011 3.432
33 HE1 HIS 4 HE1 HIS 4 -6.189 8.131 3.645
34 HE2 HIS 4 HE2 HIS 4 -5.832 6.006 4.950
35 H THR 5 H THR 5 -4.508 5.960 -2.434
36 HA THR 5 HA THR 5 -4.072 3.345 -3.695
37 HB THR 5 HB THR 5 -5.895 5.065 -4.686
38 HG1 THR 5 HG1 THR 5 -4.160 3.310 -6.054
39 1HG2 THR 5 1HG2 THR 5 -4.220 6.814 -5.147
40 2HG2 THR 5 2HG2 THR 5 -3.395 5.694 -6.233
41 3HG2 THR 5 3HG2 THR 5 -5.037 6.233 -6.599
42 H THR 6 H THR 6 -2.259 3.227 -5.072
43 HA THR 6 HA THR 6 -0.304 5.398 -4.759
44 HB THR 6 HB THR 6 1.400 3.427 -4.683
45 HG1 THR 6 HG1 THR 6 -0.122 1.774 -4.961
46 1HG2 THR 6 1HG2 THR 6 -0.281 4.213 -2.324
47 2HG2 THR 6 2HG2 THR 6 1.198 3.260 -2.209
48 3HG2 THR 6 3HG2 THR 6 1.257 4.909 -2.827
49 H ALA 7 H ALA 7 -2.103 4.406 -6.979
50 HA ALA 7 HA ALA 7 -0.183 3.464 -8.956
51 1HB ALA 7 1HB ALA 7 -2.248 3.542 -10.460
52 2HB ALA 7 2HB ALA 7 -2.242 2.365 -9.147
53 3HB ALA 7 3HB ALA 7 -3.158 3.864 -8.984
54 H THR 8 H THR 8 -0.061 6.192 -7.753
55 HA THR 8 HA THR 8 -0.025 7.709 -10.267
56 HB THR 8 HB THR 8 -1.240 9.459 -9.433
57 HG1 THR 8 HG1 THR 8 -0.838 8.948 -6.716
58 1HG2 THR 8 1HG2 THR 8 -2.488 7.173 -8.867
59 2HG2 THR 8 2HG2 THR 8 -2.344 7.829 -7.234
60 3HG2 THR 8 3HG2 THR 8 -3.165 8.758 -8.491
61 H SER 9 H SER 9 1.135 10.045 -9.412
62 HA SER 9 HA SER 9 3.810 9.204 -8.893
63 1HB SER 9 1HB SER 9 2.575 11.579 -9.801
64 2HB SER 9 2HB SER 9 3.524 12.007 -8.380
65 HG SER 9 HG SER 9 5.314 11.555 -9.425
66 HA PRO 10 HA PRO 10 3.075 10.683 -4.478
67 1HB PRO 10 1HB PRO 10 1.211 12.490 -3.861
68 2HB PRO 10 2HB PRO 10 2.682 12.983 -4.708
69 1HG PRO 10 1HG PRO 10 -0.081 12.677 -5.741
70 2HG PRO 10 2HG PRO 10 1.210 13.762 -6.282
71 1HD PRO 10 1HD PRO 10 0.446 11.260 -7.420
72 2HD PRO 10 2HD PRO 10 1.799 12.297 -7.893
73 H ILE 11 H ILE 11 1.207 10.581 -2.608
74 HA ILE 11 HA ILE 11 -0.446 8.313 -3.420
75 HB ILE 11 HB ILE 11 -0.290 9.439 -0.637
76 1HG1 ILE 11 1HG1 ILE 11 1.437 7.282 -1.861
77 2HG1 ILE 11 2HG1 ILE 11 1.988 8.902 -1.445
78 1HG2 ILE 11 1HG2 ILE 11 -2.134 7.910 -1.120
79 2HG2 ILE 11 2HG2 ILE 11 -0.980 6.698 -1.677
80 3HG2 ILE 11 3HG2 ILE 11 -0.985 7.199 0.014
81 1HD1 ILE 11 1HD1 ILE 11 0.906 8.018 0.910
82 2HD1 ILE 11 2HD1 ILE 11 1.626 6.556 0.238
83 3HD1 ILE 11 3HD1 ILE 11 2.618 7.992 0.488
84 H SER 12 H SER 12 -2.642 8.209 -3.122
85 HA SER 12 HA SER 12 -4.109 10.592 -2.356
86 1HB SER 12 1HB SER 12 -5.436 10.346 -4.616
87 2HB SER 12 2HB SER 12 -3.951 11.294 -4.554
88 HG SER 12 HG SER 12 -4.205 9.649 -6.297
89 H ALA 13 H ALA 13 -6.450 10.255 -2.325
90 HA ALA 13 HA ALA 13 -7.277 7.445 -2.284
91 1HB ALA 13 1HB ALA 13 -7.122 9.267 0.033
92 2HB ALA 13 2HB ALA 13 -8.596 8.308 -0.105
93 3HB ALA 13 3HB ALA 13 -7.026 7.507 -0.037
94 H VAL 14 H VAL 14 -9.425 7.102 -2.806
95 HA VAL 14 HA VAL 14 -11.134 9.455 -3.189
96 HB VAL 14 HB VAL 14 -9.852 8.654 -5.342
97 1HG1 VAL 14 1HG1 VAL 14 -10.702 6.281 -4.958
98 2HG1 VAL 14 2HG1 VAL 14 -12.266 6.877 -5.518
99 3HG1 VAL 14 3HG1 VAL 14 -10.863 6.935 -6.590
100 1HG2 VAL 14 1HG2 VAL 14 -12.085 10.154 -4.863
101 2HG2 VAL 14 2HG2 VAL 14 -11.285 9.985 -6.427
102 3HG2 VAL 14 3HG2 VAL 14 -12.669 8.964 -6.027
103 H THR 15 H THR 15 -13.300 8.557 -4.218
104 HA THR 15 HA THR 15 -14.333 6.640 -2.303
105 HB THR 15 HB THR 15 -16.249 7.629 -4.241
106 HG1 THR 15 HG1 THR 15 -14.882 9.601 -2.739
107 1HG2 THR 15 1HG2 THR 15 -15.967 8.094 -1.286
108 2HG2 THR 15 2HG2 THR 15 -17.373 8.514 -2.263
109 3HG2 THR 15 3HG2 THR 15 -16.914 6.824 -2.060
110 H CYS 16 H CYS 16 -14.093 4.571 -2.857
111 HA CYS 16 HA CYS 16 -13.682 3.574 -5.429
112 1HB CYS 16 1HB CYS 16 -14.999 1.832 -3.393
113 2HB CYS 16 2HB CYS 16 -13.707 1.464 -4.523
114 HA PRO 17 HA PRO 17 -17.733 3.802 -7.227
115 1HB PRO 17 1HB PRO 17 -17.322 2.040 -9.268
116 2HB PRO 17 2HB PRO 17 -16.726 3.702 -9.286
117 1HG PRO 17 1HG PRO 17 -15.275 1.174 -8.609
118 2HG PRO 17 2HG PRO 17 -14.728 2.553 -9.582
119 1HD PRO 17 1HD PRO 17 -13.960 2.216 -7.022
120 2HD PRO 17 2HD PRO 17 -14.223 3.827 -7.721
121 HA PRO 18 HA PRO 18 -20.235 0.396 -5.951
122 1HB PRO 18 1HB PRO 18 -21.502 -0.456 -8.258
123 2HB PRO 18 2HB PRO 18 -22.015 0.918 -7.275
124 1HG PRO 18 1HG PRO 18 -20.389 0.882 -9.783
125 2HG PRO 18 2HG PRO 18 -21.671 2.005 -9.292
126 1HD PRO 18 1HD PRO 18 -19.090 2.686 -9.123
127 2HD PRO 18 2HD PRO 18 -20.258 3.200 -7.889
128 H GLY 19 H GLY 19 -18.021 -0.704 -5.742
129 1HA GLY 19 1HA GLY 19 -16.961 -2.489 -7.552
130 2HA GLY 19 2HA GLY 19 -18.258 -3.362 -6.750
131 H GLU 20 H GLU 20 -16.074 -0.933 -5.357
132 HA GLU 20 HA GLU 20 -14.841 -3.057 -3.709
133 1HB GLU 20 1HB GLU 20 -13.830 -0.252 -3.938
134 2HB GLU 20 2HB GLU 20 -12.944 -1.702 -3.523
135 1HG GLU 20 1HG GLU 20 -12.208 -1.658 -5.618
136 2HG GLU 20 2HG GLU 20 -13.808 -2.248 -6.061
137 H ASN 21 H ASN 21 -14.927 -2.992 -1.567
138 HA ASN 21 HA ASN 21 -16.361 -0.769 -0.298
139 1HB ASN 21 1HB ASN 21 -17.105 -3.510 -0.429
140 2HB ASN 21 2HB ASN 21 -16.776 -3.084 1.240
141 2HD2 ASN 21 2HD2 ASN 21 -19.185 -3.752 0.958
142 1HD2 ASN 21 1HD2 ASN 21 -20.267 -2.419 0.828
143 H LEU 22 H LEU 22 -13.653 -2.887 -0.278
144 HA LEU 22 HA LEU 22 -12.823 -1.746 2.302
145 1HB LEU 22 1HB LEU 22 -11.377 -4.136 1.806
146 2HB LEU 22 2HB LEU 22 -12.489 -3.772 3.097
147 HG LEU 22 HG LEU 22 -14.197 -4.425 1.045
148 1HD1 LEU 22 1HD1 LEU 22 -11.614 -5.849 0.705
149 2HD1 LEU 22 2HD1 LEU 22 -13.106 -6.762 0.495
150 3HD1 LEU 22 3HD1 LEU 22 -12.794 -5.340 -0.501
151 1HD2 LEU 22 1HD2 LEU 22 -13.887 -5.155 3.572
152 2HD2 LEU 22 2HD2 LEU 22 -14.863 -6.095 2.442
153 3HD2 LEU 22 3HD2 LEU 22 -13.213 -6.597 2.812
154 H CYS 23 H CYS 23 -10.544 -1.408 2.582
155 HA CYS 23 HA CYS 23 -9.214 -0.685 0.066
156 1HB CYS 23 1HB CYS 23 -8.222 0.072 2.784
157 2HB CYS 23 2HB CYS 23 -8.022 0.924 1.259
158 H TYR 24 H TYR 24 -6.983 -1.230 -0.281
159 HA TYR 24 HA TYR 24 -6.022 -3.406 1.443
160 1HB TYR 24 1HB TYR 24 -5.441 -4.782 -0.347
161 2HB TYR 24 2HB TYR 24 -7.012 -4.148 -0.788
162 HD1 TYR 24 HD1 TYR 24 -3.379 -3.391 -1.315
163 HD2 TYR 24 HD2 TYR 24 -7.321 -3.351 -2.923
164 HE1 TYR 24 HE1 TYR 24 -2.481 -2.666 -3.482
165 HE2 TYR 24 HE2 TYR 24 -6.431 -2.620 -5.093
166 HH TYR 24 HH TYR 24 -4.407 -1.437 -5.953
167 H ARG 25 H ARG 25 -3.859 -3.721 1.652
168 HA ARG 25 HA ARG 25 -2.028 -1.744 0.509
169 1HB ARG 25 1HB ARG 25 -2.637 -0.847 2.703
170 2HB ARG 25 2HB ARG 25 -2.248 -2.386 3.461
171 1HG ARG 25 1HG ARG 25 0.086 -1.802 2.189
172 2HG ARG 25 2HG ARG 25 -0.495 -0.196 2.631
173 1HD ARG 25 1HD ARG 25 0.967 -1.270 4.344
174 2HD ARG 25 2HD ARG 25 -0.625 -0.798 4.937
175 HE ARG 25 HE ARG 25 -0.473 -3.529 4.041
176 1HH1 ARG 25 1HH1 ARG 25 -0.013 -1.365 6.741
177 2HH1 ARG 25 2HH1 ARG 25 -0.214 -2.606 7.931
178 1HH2 ARG 25 1HH2 ARG 25 -0.738 -5.164 5.606
179 2HH2 ARG 25 2HH2 ARG 25 -0.625 -4.763 7.288
180 H LYS 26 H LYS 26 -0.656 -3.006 -0.592
181 HA LYS 26 HA LYS 26 -0.066 -5.688 0.368
182 1HB LYS 26 1HB LYS 26 -0.574 -5.227 -2.032
183 2HB LYS 26 2HB LYS 26 0.931 -4.326 -2.132
184 1HG LYS 26 1HG LYS 26 2.043 -6.487 -1.305
185 2HG LYS 26 2HG LYS 26 0.523 -7.264 -1.753
186 1HD LYS 26 1HD LYS 26 0.772 -6.320 -4.035
187 2HD LYS 26 2HD LYS 26 2.350 -5.686 -3.563
188 1HE LYS 26 1HE LYS 26 3.312 -7.651 -3.953
189 2HE LYS 26 2HE LYS 26 2.171 -8.469 -2.887
190 1HZ LYS 26 1HZ LYS 26 1.434 -7.734 -5.653
191 2HZ LYS 26 2HZ LYS 26 2.243 -9.180 -5.315
192 3HZ LYS 26 3HZ LYS 26 0.720 -8.887 -4.641
193 H MET 27 H MET 27 1.997 -6.484 0.804
194 HA MET 27 HA MET 27 4.211 -4.622 0.910
195 1HB MET 27 1HB MET 27 3.017 -5.888 3.356
196 2HB MET 27 2HB MET 27 4.657 -5.268 3.315
197 1HG MET 27 1HG MET 27 3.649 -3.065 2.565
198 2HG MET 27 2HG MET 27 2.092 -3.751 3.023
199 1HE MET 27 1HE MET 27 5.365 -2.133 4.132
200 2HE MET 27 2HE MET 27 3.939 -1.096 4.170
201 3HE MET 27 3HE MET 27 4.791 -1.480 5.665
202 H TRP 28 H TRP 28 6.085 -5.544 0.543
203 HA TRP 28 HA TRP 28 6.814 -8.186 1.301
204 1HB TRP 28 1HB TRP 28 6.976 -9.228 -0.921
205 2HB TRP 28 2HB TRP 28 5.307 -8.860 -0.514
206 HD1 TRP 28 HD1 TRP 28 5.516 -5.741 -1.346
207 HE1 TRP 28 HE1 TRP 28 5.493 -5.150 -3.852
208 HE3 TRP 28 HE3 TRP 28 6.974 -10.247 -3.242
209 HZ2 TRP 28 HZ2 TRP 28 6.042 -6.418 -6.299
210 HZ3 TRP 28 HZ3 TRP 28 7.206 -10.479 -5.681
211 HH2 TRP 28 HH2 TRP 28 6.747 -8.605 -7.178
212 H CYS 29 H CYS 29 8.971 -8.064 1.591
213 HA CYS 29 HA CYS 29 10.402 -5.827 0.907
214 1HB CYS 29 1HB CYS 29 11.332 -8.519 1.778
215 2HB CYS 29 2HB CYS 29 12.488 -7.339 1.244
216 H ASP 30 H ASP 30 11.504 -5.116 -0.728
217 HA ASP 30 HA ASP 30 11.808 -6.811 -3.093
218 1HB ASP 30 1HB ASP 30 12.272 -4.794 -4.331
219 2HB ASP 30 2HB ASP 30 10.846 -4.481 -3.359
220 H ALA 31 H ALA 31 13.908 -7.132 -3.921
221 HA ALA 31 HA ALA 31 15.875 -7.905 -2.297
222 1HB ALA 31 1HB ALA 31 17.203 -8.100 -4.118
223 2HB ALA 31 2HB ALA 31 15.702 -7.707 -4.957
224 3HB ALA 31 3HB ALA 31 16.899 -6.447 -4.655
225 H PHE 32 H PHE 32 15.403 -6.221 -0.613
226 HA PHE 32 HA PHE 32 17.691 -4.658 -0.239
227 1HB PHE 32 1HB PHE 32 15.529 -3.380 -1.616
228 2HB PHE 32 2HB PHE 32 15.750 -2.642 -0.044
229 HD1 PHE 32 HD1 PHE 32 16.750 -2.511 -3.364
230 HD2 PHE 32 HD2 PHE 32 18.317 -2.239 0.580
231 HE1 PHE 32 HE1 PHE 32 18.687 -1.263 -4.225
232 HE2 PHE 32 HE2 PHE 32 20.255 -0.983 -0.271
233 HZ PHE 32 HZ PHE 32 20.442 -0.494 -2.677
234 H CYS 33 H CYS 33 14.517 -5.762 0.819
235 HA CYS 33 HA CYS 33 13.445 -5.242 2.875
236 1HB CYS 33 1HB CYS 33 14.845 -7.545 2.557
237 2HB CYS 33 2HB CYS 33 15.463 -6.968 4.100
238 H SER 34 H SER 34 16.944 -5.275 3.597
239 HA SER 34 HA SER 34 16.799 -3.850 5.982
240 1HB SER 34 1HB SER 34 19.183 -3.256 5.553
241 2HB SER 34 2HB SER 34 18.845 -4.970 5.311
242 HG SER 34 HG SER 34 18.709 -4.519 3.055
243 H SER 35 H SER 35 17.627 -2.524 2.748
244 HA SER 35 HA SER 35 17.141 0.168 3.718
245 1HB SER 35 1HB SER 35 18.836 -0.859 1.788
246 2HB SER 35 2HB SER 35 17.571 -0.084 0.836
247 HG SER 35 HG SER 35 18.875 1.195 2.998
248 H ARG 36 H ARG 36 16.083 -1.089 0.541
249 HA ARG 36 HA ARG 36 13.640 0.366 0.736
250 1HB ARG 36 1HB ARG 36 13.924 -1.878 -1.213
251 2HB ARG 36 2HB ARG 36 13.160 -0.330 -1.412
252 1HG ARG 36 1HG ARG 36 16.058 -0.197 -1.024
253 2HG ARG 36 2HG ARG 36 15.524 -1.004 -2.497
254 1HD ARG 36 1HD ARG 36 14.333 1.620 -1.721
255 2HD ARG 36 2HD ARG 36 15.917 1.567 -2.495
256 HE ARG 36 HE ARG 36 13.373 1.086 -3.728
257 1HH1 ARG 36 1HH1 ARG 36 16.788 0.387 -3.895
258 2HH1 ARG 36 2HH1 ARG 36 16.764 0.052 -5.593
259 1HH2 ARG 36 1HH2 ARG 36 13.339 0.645 -5.962
260 2HH2 ARG 36 2HH2 ARG 36 14.806 0.197 -6.767
261 H GLY 37 H GLY 37 13.805 -3.178 0.026
262 1HA GLY 37 1HA GLY 37 12.490 -3.755 2.497
263 2HA GLY 37 2HA GLY 37 12.833 -4.881 1.200
264 H LYS 38 H LYS 38 10.473 -4.345 2.949
265 HA LYS 38 HA LYS 38 8.556 -5.281 1.332
266 1HB LYS 38 1HB LYS 38 7.456 -3.444 3.298
267 2HB LYS 38 2HB LYS 38 7.154 -5.147 3.037
268 1HG LYS 38 1HG LYS 38 9.290 -5.649 4.189
269 2HG LYS 38 2HG LYS 38 9.449 -3.930 4.553
270 1HD LYS 38 1HD LYS 38 7.275 -4.028 5.737
271 2HD LYS 38 2HD LYS 38 7.232 -5.768 5.449
272 1HE LYS 38 1HE LYS 38 9.749 -5.225 6.569
273 2HE LYS 38 2HE LYS 38 8.586 -4.293 7.510
274 1HZ LYS 38 1HZ LYS 38 7.326 -6.629 7.331
275 2HZ LYS 38 2HZ LYS 38 8.930 -7.166 7.312
276 3HZ LYS 38 3HZ LYS 38 8.367 -6.229 8.602
277 H VAL 39 H VAL 39 8.041 -4.566 -0.573
278 HA VAL 39 HA VAL 39 7.809 -1.807 -1.248
279 HB VAL 39 HB VAL 39 6.610 -4.179 -2.681
280 1HG1 VAL 39 1HG1 VAL 39 5.813 -1.805 -3.208
281 2HG1 VAL 39 2HG1 VAL 39 7.409 -1.577 -3.923
282 3HG1 VAL 39 3HG1 VAL 39 6.331 -2.824 -4.553
283 1HG2 VAL 39 1HG2 VAL 39 9.149 -4.172 -2.271
284 2HG2 VAL 39 2HG2 VAL 39 8.558 -4.451 -3.910
285 3HG2 VAL 39 3HG2 VAL 39 9.180 -2.864 -3.454
286 H VAL 40 H VAL 40 6.014 -0.520 -1.152
287 HA VAL 40 HA VAL 40 3.653 -1.721 0.112
288 HB VAL 40 HB VAL 40 4.469 1.183 0.075
289 1HG1 VAL 40 1HG1 VAL 40 2.137 -0.295 1.124
290 2HG1 VAL 40 2HG1 VAL 40 2.836 0.932 2.182
291 3HG1 VAL 40 3HG1 VAL 40 2.270 1.375 0.571
292 1HG2 VAL 40 1HG2 VAL 40 5.206 -1.071 1.822
293 2HG2 VAL 40 2HG2 VAL 40 6.054 0.439 1.495
294 3HG2 VAL 40 3HG2 VAL 40 4.721 0.411 2.647
295 H GLU 41 H GLU 41 1.885 -1.929 -0.994
296 HA GLU 41 HA GLU 41 1.438 -0.251 -3.374
297 1HB GLU 41 1HB GLU 41 1.654 -2.920 -3.432
298 2HB GLU 41 2HB GLU 41 -0.052 -2.805 -3.021
299 1HG GLU 41 1HG GLU 41 -0.428 -1.413 -5.000
300 2HG GLU 41 2HG GLU 41 1.280 -1.558 -5.415
301 H LEU 42 H LEU 42 -0.827 0.316 -3.798
302 HA LEU 42 HA LEU 42 -2.605 0.162 -1.487
303 1HB LEU 42 1HB LEU 42 -1.038 2.432 -2.102
304 2HB LEU 42 2HB LEU 42 -2.690 2.836 -2.510
305 HG LEU 42 HG LEU 42 -3.419 2.384 -0.262
306 1HD1 LEU 42 1HD1 LEU 42 -0.632 1.341 0.076
307 2HD1 LEU 42 2HD1 LEU 42 -1.590 1.871 1.458
308 3HD1 LEU 42 3HD1 LEU 42 -2.163 0.548 0.443
309 1HD2 LEU 42 1HD2 LEU 42 -2.410 4.594 -0.790
310 2HD2 LEU 42 2HD2 LEU 42 -2.285 4.141 0.910
311 3HD2 LEU 42 3HD2 LEU 42 -0.879 3.999 -0.145
312 H GLY 43 H GLY 43 -4.746 0.171 -1.981
313 1HA GLY 43 1HA GLY 43 -5.543 -0.416 -4.621
314 2HA GLY 43 2HA GLY 43 -5.907 1.267 -4.284
315 H CYS 44 H CYS 44 -8.118 0.357 -4.747
316 HA CYS 44 HA CYS 44 -9.306 -0.589 -2.222
317 1HB CYS 44 1HB CYS 44 -9.923 1.723 -3.007
318 2HB CYS 44 2HB CYS 44 -10.701 0.972 -4.396
319 H ALA 45 H ALA 45 -10.856 -2.229 -2.278
320 HA ALA 45 HA ALA 45 -11.755 -3.334 -4.788
321 1HB ALA 45 1HB ALA 45 -10.350 -5.023 -5.008
322 2HB ALA 45 2HB ALA 45 -9.408 -4.377 -3.667
323 3HB ALA 45 3HB ALA 45 -10.680 -5.560 -3.361
324 H ALA 46 H ALA 46 -12.672 -5.791 -3.932
325 HA ALA 46 HA ALA 46 -14.468 -5.027 -1.725
326 1HB ALA 46 1HB ALA 46 -16.151 -5.104 -3.147
327 2HB ALA 46 2HB ALA 46 -15.097 -5.683 -4.436
328 3HB ALA 46 3HB ALA 46 -15.864 -6.833 -3.341
329 H THR 47 H THR 47 -12.036 -7.141 -2.322
330 HA THR 47 HA THR 47 -12.985 -8.987 -0.325
331 HB THR 47 HB THR 47 -12.247 -10.267 -2.866
332 HG1 THR 47 HG1 THR 47 -13.901 -9.261 -3.725
333 1HG2 THR 47 1HG2 THR 47 -12.708 -11.417 -0.574
334 2HG2 THR 47 2HG2 THR 47 -14.391 -11.221 -1.062
335 3HG2 THR 47 3HG2 THR 47 -13.279 -12.138 -2.078
336 H CYS 48 H CYS 48 -10.490 -7.347 -1.488
337 HA CYS 48 HA CYS 48 -8.318 -8.852 -1.899
338 1HB CYS 48 1HB CYS 48 -7.661 -6.873 0.116
339 2HB CYS 48 2HB CYS 48 -7.073 -7.051 -1.523
340 HA PRO 49 HA PRO 49 -8.167 -11.271 1.905
341 1HB PRO 49 1HB PRO 49 -7.738 -13.643 0.790
342 2HB PRO 49 2HB PRO 49 -9.330 -12.881 0.692
343 1HG PRO 49 1HG PRO 49 -7.236 -13.163 -1.393
344 2HG PRO 49 2HG PRO 49 -8.997 -13.121 -1.565
345 1HD PRO 49 1HD PRO 49 -7.172 -10.971 -1.945
346 2HD PRO 49 2HD PRO 49 -8.944 -10.893 -1.968
347 H SER 50 H SER 50 -6.407 -13.298 2.213
348 HA SER 50 HA SER 50 -3.790 -12.353 1.297
349 1HB SER 50 1HB SER 50 -3.169 -13.005 3.858
350 2HB SER 50 2HB SER 50 -3.518 -11.361 3.322
351 HG SER 50 HG SER 50 -5.686 -11.696 3.969
352 H LYS 51 H LYS 51 -2.115 -13.934 1.400
353 HA LYS 51 HA LYS 51 -2.649 -16.583 2.303
354 1HB LYS 51 1HB LYS 51 -3.472 -15.947 -0.309
355 2HB LYS 51 2HB LYS 51 -2.056 -16.973 -0.445
356 1HG LYS 51 1HG LYS 51 -3.205 -18.782 0.118
357 2HG LYS 51 2HG LYS 51 -3.886 -17.985 1.537
358 1HD LYS 51 1HD LYS 51 -5.743 -18.539 0.211
359 2HD LYS 51 2HD LYS 51 -5.474 -16.821 -0.088
360 1HE LYS 51 1HE LYS 51 -3.982 -18.532 -1.910
361 2HE LYS 51 2HE LYS 51 -5.723 -18.793 -2.003
362 1HZ LYS 51 1HZ LYS 51 -4.396 -16.146 -2.223
363 2HZ LYS 51 2HZ LYS 51 -4.934 -17.067 -3.535
364 3HZ LYS 51 3HZ LYS 51 -6.047 -16.460 -2.414
365 H LYS 52 H LYS 52 -0.664 -14.622 2.735
366 HA LYS 52 HA LYS 52 1.654 -16.227 2.544
367 1HB LYS 52 1HB LYS 52 1.185 -14.292 0.396
368 2HB LYS 52 2HB LYS 52 2.741 -14.093 1.186
369 1HG LYS 52 1HG LYS 52 2.835 -16.715 0.838
370 2HG LYS 52 2HG LYS 52 1.719 -16.327 -0.472
371 1HD LYS 52 1HD LYS 52 3.434 -15.689 -1.734
372 2HD LYS 52 2HD LYS 52 3.830 -14.436 -0.557
373 1HE LYS 52 1HE LYS 52 5.770 -15.541 -0.346
374 2HE LYS 52 2HE LYS 52 4.838 -16.655 0.653
375 1HZ LYS 52 1HZ LYS 52 4.404 -17.956 -1.400
376 2HZ LYS 52 2HZ LYS 52 5.482 -16.950 -2.229
377 3HZ LYS 52 3HZ LYS 52 6.035 -17.914 -0.952
378 HA PRO 53 HA PRO 53 1.645 -13.194 5.991
379 1HB PRO 53 1HB PRO 53 3.206 -15.323 7.298
380 2HB PRO 53 2HB PRO 53 1.725 -14.527 7.835
381 1HG PRO 53 1HG PRO 53 1.726 -17.070 6.974
382 2HG PRO 53 2HG PRO 53 0.363 -15.979 6.666
383 1HD PRO 53 1HD PRO 53 2.572 -16.820 4.824
384 2HD PRO 53 2HD PRO 53 0.837 -16.630 4.490
385 H TYR 54 H TYR 54 3.250 -12.474 4.053
386 HA TYR 54 HA TYR 54 5.486 -11.381 5.194
387 1HB TYR 54 1HB TYR 54 5.957 -14.097 4.805
388 2HB TYR 54 2HB TYR 54 6.816 -13.284 3.509
389 HD1 TYR 54 HD1 TYR 54 9.067 -13.210 4.031
390 HD2 TYR 54 HD2 TYR 54 6.219 -12.358 7.074
391 HE1 TYR 54 HE1 TYR 54 10.895 -12.650 5.577
392 HE2 TYR 54 HE2 TYR 54 8.039 -11.796 8.629
393 HH TYR 54 HH TYR 54 11.317 -12.501 7.955
394 H GLU 55 H GLU 55 3.962 -12.635 2.320
395 HA GLU 55 HA GLU 55 4.782 -10.233 0.889
396 1HB GLU 55 1HB GLU 55 5.312 -13.022 -0.142
397 2HB GLU 55 2HB GLU 55 5.423 -11.566 -1.120
398 1HG GLU 55 1HG GLU 55 7.178 -10.721 0.383
399 2HG GLU 55 2HG GLU 55 7.095 -12.229 1.292
400 H GLU 56 H GLU 56 2.470 -9.885 1.360
401 HA GLU 56 HA GLU 56 0.887 -10.562 -0.921
402 1HB GLU 56 1HB GLU 56 0.687 -12.219 1.392
403 2HB GLU 56 2HB GLU 56 -0.799 -11.304 1.216
404 1HG GLU 56 1HG GLU 56 0.402 -12.800 -1.081
405 2HG GLU 56 2HG GLU 56 -0.663 -13.582 0.085
406 H VAL 57 H VAL 57 -1.598 -9.902 -0.096
407 HA VAL 57 HA VAL 57 -1.315 -7.289 1.218
408 HB VAL 57 HB VAL 57 -1.428 -6.710 -1.062
409 1HG1 VAL 57 1HG1 VAL 57 -3.663 -8.708 -1.313
410 2HG1 VAL 57 2HG1 VAL 57 -3.214 -7.562 -2.577
411 3HG1 VAL 57 3HG1 VAL 57 -2.062 -8.790 -2.049
412 1HG2 VAL 57 1HG2 VAL 57 -2.940 -5.414 0.379
413 2HG2 VAL 57 2HG2 VAL 57 -3.505 -5.499 -1.289
414 3HG2 VAL 57 3HG2 VAL 57 -4.257 -6.506 -0.052
415 H THR 58 H THR 58 -3.364 -6.421 2.004
416 HA THR 58 HA THR 58 -5.471 -8.394 2.453
417 HB THR 58 HB THR 58 -5.175 -7.096 4.931
418 HG1 THR 58 HG1 THR 58 -3.076 -6.586 4.611
419 1HG2 THR 58 1HG2 THR 58 -5.350 -9.738 3.954
420 2HG2 THR 58 2HG2 THR 58 -3.990 -9.665 5.074
421 3HG2 THR 58 3HG2 THR 58 -5.593 -9.153 5.600
422 H CYS 59 H CYS 59 -7.504 -7.505 2.873
423 HA CYS 59 HA CYS 59 -7.663 -4.622 2.387
424 1HB CYS 59 1HB CYS 59 -9.022 -6.768 1.151
425 2HB CYS 59 2HB CYS 59 -10.203 -5.859 2.082
426 H CYS 60 H CYS 60 -9.168 -3.344 3.491
427 HA CYS 60 HA CYS 60 -10.241 -4.517 5.968
428 1HB CYS 60 1HB CYS 60 -9.710 -2.167 6.983
429 2HB CYS 60 2HB CYS 60 -8.446 -3.386 6.894
430 H SER 61 H SER 61 -12.157 -3.599 6.749
431 HA SER 61 HA SER 61 -13.674 -2.173 4.699
432 1HB SER 61 1HB SER 61 -15.664 -2.867 6.014
433 2HB SER 61 2HB SER 61 -14.670 -4.232 5.505
434 HG SER 61 HG SER 61 -14.584 -2.999 8.061
435 H THR 62 H THR 62 -12.182 -0.289 5.555
436 HA THR 62 HA THR 62 -13.942 1.427 7.061
437 HB THR 62 HB THR 62 -11.288 1.647 8.237
438 HG1 THR 62 HG1 THR 62 -11.123 -0.274 9.171
439 1HG2 THR 62 1HG2 THR 62 -13.854 2.245 8.992
440 2HG2 THR 62 2HG2 THR 62 -13.454 0.852 9.997
441 3HG2 THR 62 3HG2 THR 62 -12.428 2.287 10.029
442 H ASP 63 H ASP 63 -13.477 3.648 6.759
443 HA ASP 63 HA ASP 63 -12.239 4.296 4.325
444 1HB ASP 63 1HB ASP 63 -13.969 5.643 5.719
445 2HB ASP 63 2HB ASP 63 -12.555 6.319 6.518
446 H LYS 64 H LYS 64 -10.332 5.479 3.897
447 HA LYS 64 HA LYS 64 -8.004 5.393 3.992
448 1HB LYS 64 1HB LYS 64 -7.198 7.126 5.445
449 2HB LYS 64 2HB LYS 64 -8.788 7.601 4.874
450 1HG LYS 64 1HG LYS 64 -9.561 7.758 6.943
451 2HG LYS 64 2HG LYS 64 -8.991 6.138 7.346
452 1HD LYS 64 1HD LYS 64 -7.982 7.827 8.801
453 2HD LYS 64 2HD LYS 64 -6.765 7.025 7.807
454 1HE LYS 64 1HE LYS 64 -7.619 9.219 6.303
455 2HE LYS 64 2HE LYS 64 -7.470 9.818 7.954
456 1HZ LYS 64 1HZ LYS 64 -5.293 8.165 6.932
457 2HZ LYS 64 2HZ LYS 64 -5.430 9.728 6.301
458 3HZ LYS 64 3HZ LYS 64 -5.242 9.503 7.967
459 H CYS 65 H CYS 65 -8.893 2.988 4.986
460 HA CYS 65 HA CYS 65 -7.602 2.488 7.529
461 1HB CYS 65 1HB CYS 65 -8.672 0.359 7.466
462 2HB CYS 65 2HB CYS 65 -9.843 1.546 6.925
463 H ASN 66 H ASN 66 -6.648 2.407 4.280
464 HA ASN 66 HA ASN 66 -4.572 0.432 4.886
465 1HB ASN 66 1HB ASN 66 -4.521 -0.103 2.561
466 2HB ASN 66 2HB ASN 66 -6.188 -0.176 3.102
467 2HD2 ASN 66 2HD2 ASN 66 -4.504 0.558 0.569
468 1HD2 ASN 66 1HD2 ASN 66 -5.373 1.907 -0.068
469 HA PRO 67 HA PRO 67 -2.450 4.476 3.818
470 1HB PRO 67 1HB PRO 67 -1.926 5.566 6.180
471 2HB PRO 67 2HB PRO 67 -3.539 5.714 5.469
472 1HG PRO 67 1HG PRO 67 -2.580 3.877 7.626
473 2HG PRO 67 2HG PRO 67 -4.109 4.767 7.510
474 1HD PRO 67 1HD PRO 67 -3.751 2.091 6.831
475 2HD PRO 67 2HD PRO 67 -5.089 3.119 6.291
476 H HIS 68 H HIS 68 -0.218 4.744 3.783
477 HA HIS 68 HA HIS 68 1.442 2.579 4.148
478 1HB HIS 68 1HB HIS 68 1.819 5.029 3.103
479 2HB HIS 68 2HB HIS 68 2.679 5.241 4.620
480 HD1 HIS 68 HD1 HIS 68 4.881 3.974 4.917
481 HD2 HIS 68 HD2 HIS 68 3.002 3.205 1.300
482 HE1 HIS 68 HE1 HIS 68 6.587 2.777 3.516
483 HE2 HIS 68 HE2 HIS 68 5.465 2.428 1.290
484 HA PRO 69 HA PRO 69 1.609 2.210 8.596
485 1HB PRO 69 1HB PRO 69 3.810 0.550 8.670
486 2HB PRO 69 2HB PRO 69 2.148 0.009 8.414
487 1HG PRO 69 1HG PRO 69 4.307 0.511 6.410
488 2HG PRO 69 2HG PRO 69 3.106 -0.792 6.465
489 1HD PRO 69 1HD PRO 69 2.833 1.307 4.813
490 2HD PRO 69 2HD PRO 69 1.429 0.547 5.593
491 H LYS 70 H LYS 70 4.100 3.472 6.576
492 HA LYS 70 HA LYS 70 5.594 4.419 8.920
493 1HB LYS 70 1HB LYS 70 6.375 4.082 6.030
494 2HB LYS 70 2HB LYS 70 7.337 5.039 7.147
495 1HG LYS 70 1HG LYS 70 6.641 2.350 8.097
496 2HG LYS 70 2HG LYS 70 7.692 2.401 6.681
497 1HD LYS 70 1HD LYS 70 9.030 4.150 8.056
498 2HD LYS 70 2HD LYS 70 8.171 3.467 9.438
499 1HE LYS 70 1HE LYS 70 9.185 1.342 7.817
500 2HE LYS 70 2HE LYS 70 10.487 2.481 8.155
501 1HZ LYS 70 1HZ LYS 70 8.724 1.289 10.225
502 2HZ LYS 70 2HZ LYS 70 10.268 0.715 9.837
503 3HZ LYS 70 3HZ LYS 70 10.081 2.263 10.492
504 H GLN 71 H GLN 71 3.050 5.558 7.940
505 HA GLN 71 HA GLN 71 3.883 8.173 6.929
506 1HB GLN 71 1HB GLN 71 1.425 6.596 6.847
507 2HB GLN 71 2HB GLN 71 1.135 8.271 7.288
508 1HG GLN 71 1HG GLN 71 2.582 8.843 5.246
509 2HG GLN 71 2HG GLN 71 2.310 7.167 4.771
510 2HE2 GLN 71 2HE2 GLN 71 1.036 7.500 3.031
511 1HE2 GLN 71 1HE2 GLN 71 -0.526 8.236 3.097
512 H ARG 72 H ARG 72 4.828 7.737 9.440
513 HA ARG 72 HA ARG 72 3.051 8.702 11.461
514 1HB ARG 72 1HB ARG 72 6.042 8.770 11.701
515 2HB ARG 72 2HB ARG 72 4.843 8.493 12.955
516 1HG ARG 72 1HG ARG 72 5.716 6.591 10.797
517 2HG ARG 72 2HG ARG 72 5.940 6.431 12.540
518 1HD ARG 72 1HD ARG 72 3.331 6.338 11.031
519 2HD ARG 72 2HD ARG 72 4.144 4.988 11.821
520 HE ARG 72 HE ARG 72 3.568 7.118 13.634
521 1HH1 ARG 72 1HH1 ARG 72 2.187 4.353 12.014
522 2HH1 ARG 72 2HH1 ARG 72 0.970 4.097 13.219
523 1HH2 ARG 72 1HH2 ARG 72 1.969 6.783 15.221
524 2HH2 ARG 72 2HH2 ARG 72 0.846 5.477 15.040
525 HA PRO 73 HA PRO 73 3.570 13.014 10.393
526 1HB PRO 73 1HB PRO 73 2.104 14.062 12.404
527 2HB PRO 73 2HB PRO 73 1.364 13.255 11.017
528 1HG PRO 73 1HG PRO 73 1.902 12.190 13.762
529 2HG PRO 73 2HG PRO 73 0.456 12.002 12.753
530 1HD PRO 73 1HD PRO 73 2.362 10.077 12.985
531 2HD PRO 73 2HD PRO 73 1.387 10.300 11.519
532 H GLY 74 H GLY 74 3.788 15.077 12.088
533 1HA GLY 74 1HA GLY 74 5.767 16.087 12.939
534 2HA GLY 74 2HA GLY 74 6.320 14.501 13.455
535 H1 TRP 75 H1 TRP 75 5.025 0.518 -10.709
536 H2 TRP 75 H2 TRP 75 6.165 1.249 -11.765
537 H3 TRP 75 H3 TRP 75 6.636 0.788 -10.183
538 HA TRP 75 HA TRP 75 6.363 3.055 -10.097
539 1HB TRP 75 1HB TRP 75 5.076 3.027 -12.304
540 2HB TRP 75 2HB TRP 75 3.631 2.740 -11.341
541 HD1 TRP 75 HD1 TRP 75 3.608 4.752 -9.131
542 HE1 TRP 75 HE1 TRP 75 3.690 7.294 -9.520
543 HE3 TRP 75 HE3 TRP 75 5.653 4.792 -13.818
544 HZ2 TRP 75 HZ2 TRP 75 4.517 9.081 -11.542
545 HZ3 TRP 75 HZ3 TRP 75 6.058 6.960 -14.908
546 HH2 TRP 75 HH2 TRP 75 5.501 9.059 -13.793
547 H ARG 76 H ARG 76 6.385 2.135 -7.933
548 HA ARG 76 HA ARG 76 3.852 2.628 -6.580
549 1HB ARG 76 1HB ARG 76 3.831 0.575 -5.362
550 2HB ARG 76 2HB ARG 76 3.950 0.169 -7.068
551 1HG ARG 76 1HG ARG 76 6.433 0.369 -5.427
552 2HG ARG 76 2HG ARG 76 5.410 -1.061 -5.307
553 1HD ARG 76 1HD ARG 76 5.653 -1.522 -7.632
554 2HD ARG 76 2HD ARG 76 6.457 0.022 -7.912
555 HE ARG 76 HE ARG 76 8.131 -1.091 -6.185
556 1HH1 ARG 76 1HH1 ARG 76 6.583 -2.473 -8.997
557 2HH1 ARG 76 2HH1 ARG 76 7.860 -3.602 -9.295
558 1HH2 ARG 76 1HH2 ARG 76 9.807 -2.576 -6.581
559 2HH2 ARG 76 2HH2 ARG 76 9.690 -3.660 -7.927
560 H TYR 77 H TYR 77 4.547 1.855 -4.035
561 HA TYR 77 HA TYR 77 6.959 3.481 -3.535
562 1HB TYR 77 1HB TYR 77 4.613 3.250 -1.659
563 2HB TYR 77 2HB TYR 77 5.961 4.373 -1.562
564 HD1 TYR 77 HD1 TYR 77 3.302 3.453 -4.045
565 HD2 TYR 77 HD2 TYR 77 5.523 6.546 -2.148
566 HE1 TYR 77 HE1 TYR 77 2.025 5.136 -5.302
567 HE2 TYR 77 HE2 TYR 77 4.246 8.235 -3.397
568 HH TYR 77 HH TYR 77 1.402 7.591 -4.973
569 H TYR 78 H TYR 78 8.202 2.887 -1.685
570 HA TYR 78 HA TYR 78 7.913 0.058 -1.017
571 1HB TYR 78 1HB TYR 78 10.367 1.827 -0.965
572 2HB TYR 78 2HB TYR 78 10.340 0.142 -0.485
573 HD1 TYR 78 HD1 TYR 78 11.591 -1.026 -2.033
574 HD2 TYR 78 HD2 TYR 78 8.786 1.839 -3.454
575 HE1 TYR 78 HE1 TYR 78 12.040 -1.731 -4.344
576 HE2 TYR 78 HE2 TYR 78 9.224 1.132 -5.758
577 HH TYR 78 HH TYR 78 10.109 -0.655 -7.006
578 H GLU 79 H GLU 79 8.698 -0.500 1.224
579 HA GLU 79 HA GLU 79 7.131 0.911 3.086
580 1HB GLU 79 1HB GLU 79 7.522 -1.420 3.432
581 2HB GLU 79 2HB GLU 79 9.265 -1.193 3.446
582 1HG GLU 79 1HG GLU 79 8.559 -1.560 5.681
583 2HG GLU 79 2HG GLU 79 9.002 0.139 5.536
584 H SER 80 H SER 80 10.670 0.665 2.845
585 HA SER 80 HA SER 80 11.295 2.360 4.950
586 1HB SER 80 1HB SER 80 12.692 1.026 2.885
587 2HB SER 80 2HB SER 80 13.286 2.680 2.983
588 HG SER 80 HG SER 80 13.636 2.339 5.213
589 H SER 81 H SER 81 10.363 3.162 1.673
590 HA SER 81 HA SER 81 10.568 6.003 2.402
591 1HB SER 81 1HB SER 81 10.889 6.083 -0.292
592 2HB SER 81 2HB SER 81 12.223 6.071 0.857
593 HG SER 81 HG SER 81 11.093 3.695 -0.178
594 H LEU 82 H LEU 82 8.786 7.116 2.201
595 HA LEU 82 HA LEU 82 6.414 5.907 1.099
596 1HB LEU 82 1HB LEU 82 7.084 8.184 2.822
597 2HB LEU 82 2HB LEU 82 5.660 8.390 1.815
598 HG LEU 82 HG LEU 82 4.855 6.170 2.718
599 1HD1 LEU 82 1HD1 LEU 82 7.206 6.636 4.518
600 2HD1 LEU 82 2HD1 LEU 82 5.813 5.678 5.019
601 3HD1 LEU 82 3HD1 LEU 82 6.770 5.179 3.625
602 1HD2 LEU 82 1HD2 LEU 82 5.148 8.672 4.292
603 2HD2 LEU 82 2HD2 LEU 82 3.720 7.993 3.511
604 3HD2 LEU 82 3HD2 LEU 82 4.338 7.274 4.998
605 H GLU 83 H GLU 83 8.874 7.300 -0.430
606 HA GLU 83 HA GLU 83 7.437 9.198 -2.066
607 1HB GLU 83 1HB GLU 83 10.264 8.186 -1.985
608 2HB GLU 83 2HB GLU 83 9.689 9.140 -3.343
609 1HG GLU 83 1HG GLU 83 9.520 10.057 -0.487
610 2HG GLU 83 2HG GLU 83 10.881 10.415 -1.549
611 HA PRO 84 HA PRO 84 6.462 6.460 -5.391
612 1HB PRO 84 1HB PRO 84 7.223 8.287 -7.487
613 2HB PRO 84 2HB PRO 84 5.610 7.971 -6.847
614 1HG PRO 84 1HG PRO 84 6.954 10.347 -6.539
615 2HG PRO 84 2HG PRO 84 5.678 9.775 -5.451
616 1HD PRO 84 1HD PRO 84 8.650 9.665 -5.112
617 2HD PRO 84 2HD PRO 84 7.391 10.017 -3.910
618 H TYR 85 H TYR 85 7.431 4.813 -6.402
619 HA TYR 85 HA TYR 85 10.207 5.189 -7.308
620 1HB TYR 85 1HB TYR 85 8.992 3.101 -5.579
621 2HB TYR 85 2HB TYR 85 10.234 2.587 -6.716
622 HD1 TYR 85 HD1 TYR 85 12.296 2.352 -5.695
623 HD2 TYR 85 HD2 TYR 85 9.773 5.558 -4.473
624 HE1 TYR 85 HE1 TYR 85 14.038 3.129 -4.144
625 HE2 TYR 85 HE2 TYR 85 11.509 6.335 -2.917
626 HH TYR 85 HH TYR 85 14.330 5.946 -2.963
627 HA PRO 86 HA PRO 86 7.967 3.699 -10.994
628 1HB PRO 86 1HB PRO 86 9.439 5.031 -12.800
629 2HB PRO 86 2HB PRO 86 8.183 5.837 -11.853
630 1HG PRO 86 1HG PRO 86 11.148 5.816 -11.439
631 2HG PRO 86 2HG PRO 86 10.014 7.174 -11.328
632 1HD PRO 86 1HD PRO 86 10.956 5.805 -9.155
633 2HD PRO 86 2HD PRO 86 9.387 6.634 -9.190
634 H ASP 87 H ASP 87 8.791 1.563 -10.588
635 HA ASP 87 HA ASP 87 11.482 0.928 -11.453
636 1HB ASP 87 1HB ASP 87 10.929 -1.366 -10.774
637 2HB ASP 87 2HB ASP 87 10.539 -0.215 -9.499
No H/Q in entry = 637
Start of MODEL 5
1 H1 ILE 1 H1 ILE 1 -16.992 4.146 -0.709
2 H2 ILE 1 H2 ILE 1 -17.990 3.744 0.628
3 H3 ILE 1 H3 ILE 1 -17.716 5.388 0.227
4 HA ILE 1 HA ILE 1 -16.341 5.086 1.975
5 HB ILE 1 HB ILE 1 -16.668 2.676 2.155
6 1HG1 ILE 1 1HG1 ILE 1 -13.758 3.449 2.168
7 2HG1 ILE 1 2HG1 ILE 1 -14.902 3.791 3.459
8 1HG2 ILE 1 1HG2 ILE 1 -15.630 2.600 -0.427
9 2HG2 ILE 1 2HG2 ILE 1 -14.434 1.791 0.586
10 3HG2 ILE 1 3HG2 ILE 1 -16.105 1.228 0.574
11 1HD1 ILE 1 1HD1 ILE 1 -15.134 1.072 3.100
12 2HD1 ILE 1 2HD1 ILE 1 -13.410 1.378 2.884
13 3HD1 ILE 1 3HD1 ILE 1 -14.218 1.887 4.367
14 H VAL 2 H VAL 2 -14.055 5.415 2.165
15 HA VAL 2 HA VAL 2 -12.785 5.920 -0.435
16 HB VAL 2 HB VAL 2 -12.368 7.529 2.090
17 1HG1 VAL 2 1HG1 VAL 2 -10.723 7.283 -0.101
18 2HG1 VAL 2 2HG1 VAL 2 -11.649 8.739 -0.459
19 3HG1 VAL 2 3HG1 VAL 2 -10.730 8.624 1.042
20 1HG2 VAL 2 1HG2 VAL 2 -14.027 8.151 -0.351
21 2HG2 VAL 2 2HG2 VAL 2 -14.613 7.898 1.293
22 3HG2 VAL 2 3HG2 VAL 2 -13.626 9.310 0.916
23 H CYS 3 H CYS 3 -10.640 5.377 -0.678
24 HA CYS 3 HA CYS 3 -9.230 4.265 1.635
25 1HB CYS 3 1HB CYS 3 -9.619 2.837 -1.002
26 2HB CYS 3 2HB CYS 3 -8.500 2.318 0.251
27 H HIS 4 H HIS 4 -6.905 3.780 1.058
28 HA HIS 4 HA HIS 4 -5.869 6.053 -0.456
29 1HB HIS 4 1HB HIS 4 -4.351 4.147 1.325
30 2HB HIS 4 2HB HIS 4 -3.791 5.698 0.711
31 HD1 HIS 4 HD1 HIS 4 -5.494 7.772 1.550
32 HD2 HIS 4 HD2 HIS 4 -5.254 4.330 3.860
33 HE1 HIS 4 HE1 HIS 4 -6.321 8.431 3.828
34 HE2 HIS 4 HE2 HIS 4 -5.991 6.378 5.248
35 H THR 5 H THR 5 -4.712 5.872 -2.282
36 HA THR 5 HA THR 5 -4.027 3.158 -3.189
37 HB THR 5 HB THR 5 -5.978 4.622 -4.333
38 HG1 THR 5 HG1 THR 5 -5.946 3.020 -5.687
39 1HG2 THR 5 1HG2 THR 5 -3.519 5.262 -5.946
40 2HG2 THR 5 2HG2 THR 5 -5.191 5.533 -6.447
41 3HG2 THR 5 3HG2 THR 5 -4.527 6.424 -5.077
42 H THR 6 H THR 6 -2.252 2.981 -4.601
43 HA THR 6 HA THR 6 -0.393 5.261 -4.568
44 HB THR 6 HB THR 6 1.379 3.340 -4.383
45 HG1 THR 6 HG1 THR 6 0.350 1.511 -4.203
46 1HG2 THR 6 1HG2 THR 6 -0.109 4.737 -2.264
47 2HG2 THR 6 2HG2 THR 6 0.873 3.359 -1.768
48 3HG2 THR 6 3HG2 THR 6 1.620 4.711 -2.617
49 H ALA 7 H ALA 7 -2.214 3.851 -6.617
50 HA ALA 7 HA ALA 7 -0.425 2.664 -8.513
51 1HB ALA 7 1HB ALA 7 -3.016 3.688 -9.474
52 2HB ALA 7 2HB ALA 7 -2.278 2.098 -9.667
53 3HB ALA 7 3HB ALA 7 -3.088 2.517 -8.158
54 H THR 8 H THR 8 -1.621 5.868 -7.895
55 HA THR 8 HA THR 8 -0.780 6.934 -10.447
56 HB THR 8 HB THR 8 -1.918 8.815 -9.861
57 HG1 THR 8 HG1 THR 8 -1.237 8.617 -7.131
58 1HG2 THR 8 1HG2 THR 8 -3.270 6.747 -8.904
59 2HG2 THR 8 2HG2 THR 8 -2.983 7.598 -7.384
60 3HG2 THR 8 3HG2 THR 8 -3.823 8.410 -8.709
61 H SER 9 H SER 9 0.531 9.249 -9.959
62 HA SER 9 HA SER 9 3.146 8.340 -9.281
63 1HB SER 9 1HB SER 9 2.100 10.561 -10.632
64 2HB SER 9 2HB SER 9 2.951 11.221 -9.238
65 HG SER 9 HG SER 9 4.815 10.321 -9.936
66 HA PRO 10 HA PRO 10 2.517 10.620 -5.196
67 1HB PRO 10 1HB PRO 10 0.332 12.362 -5.062
68 2HB PRO 10 2HB PRO 10 2.008 12.815 -5.343
69 1HG PRO 10 1HG PRO 10 -0.109 13.078 -7.172
70 2HG PRO 10 2HG PRO 10 1.617 13.215 -7.545
71 1HD PRO 10 1HD PRO 10 -0.222 10.892 -7.897
72 2HD PRO 10 2HD PRO 10 1.137 11.415 -8.906
73 H ILE 11 H ILE 11 1.525 9.797 -3.363
74 HA ILE 11 HA ILE 11 -0.628 7.962 -3.826
75 HB ILE 11 HB ILE 11 -0.359 7.291 -1.543
76 1HG1 ILE 11 1HG1 ILE 11 1.544 9.618 -1.241
77 2HG1 ILE 11 2HG1 ILE 11 -0.072 9.527 -0.541
78 1HG2 ILE 11 1HG2 ILE 11 1.304 6.619 -3.311
79 2HG2 ILE 11 2HG2 ILE 11 2.394 7.819 -2.615
80 3HG2 ILE 11 3HG2 ILE 11 1.846 6.455 -1.640
81 1HD1 ILE 11 1HD1 ILE 11 1.620 7.249 0.099
82 2HD1 ILE 11 2HD1 ILE 11 2.227 8.791 0.704
83 3HD1 ILE 11 3HD1 ILE 11 0.608 8.246 1.144
84 H SER 12 H SER 12 -2.730 8.188 -3.412
85 HA SER 12 HA SER 12 -3.652 10.309 -1.638
86 1HB SER 12 1HB SER 12 -5.368 10.935 -3.496
87 2HB SER 12 2HB SER 12 -3.738 11.600 -3.579
88 HG SER 12 HG SER 12 -3.217 9.974 -5.078
89 H ALA 13 H ALA 13 -6.223 10.264 -1.744
90 HA ALA 13 HA ALA 13 -7.140 7.481 -1.893
91 1HB ALA 13 1HB ALA 13 -6.806 9.070 0.520
92 2HB ALA 13 2HB ALA 13 -8.448 8.453 0.336
93 3HB ALA 13 3HB ALA 13 -7.082 7.339 0.337
94 H VAL 14 H VAL 14 -9.319 7.217 -2.373
95 HA VAL 14 HA VAL 14 -10.998 9.591 -2.619
96 HB VAL 14 HB VAL 14 -9.678 9.007 -4.827
97 1HG1 VAL 14 1HG1 VAL 14 -10.586 6.616 -4.691
98 2HG1 VAL 14 2HG1 VAL 14 -12.109 7.305 -5.253
99 3HG1 VAL 14 3HG1 VAL 14 -10.660 7.433 -6.254
100 1HG2 VAL 14 1HG2 VAL 14 -11.887 10.487 -4.222
101 2HG2 VAL 14 2HG2 VAL 14 -11.084 10.456 -5.793
102 3HG2 VAL 14 3HG2 VAL 14 -12.487 9.428 -5.498
103 H THR 15 H THR 15 -13.151 8.769 -3.767
104 HA THR 15 HA THR 15 -14.173 6.676 -2.037
105 HB THR 15 HB THR 15 -16.096 7.767 -3.906
106 HG1 THR 15 HG1 THR 15 -14.768 9.664 -2.277
107 1HG2 THR 15 1HG2 THR 15 -16.548 6.774 -1.644
108 2HG2 THR 15 2HG2 THR 15 -15.921 8.272 -0.957
109 3HG2 THR 15 3HG2 THR 15 -17.350 8.306 -1.989
110 H CYS 16 H CYS 16 -13.679 4.693 -2.804
111 HA CYS 16 HA CYS 16 -13.449 4.015 -5.527
112 1HB CYS 16 1HB CYS 16 -14.193 1.894 -3.566
113 2HB CYS 16 2HB CYS 16 -12.993 1.867 -4.846
114 HA PRO 17 HA PRO 17 -17.691 3.630 -6.739
115 1HB PRO 17 1HB PRO 17 -17.374 1.888 -8.814
116 2HB PRO 17 2HB PRO 17 -16.981 3.606 -8.924
117 1HG PRO 17 1HG PRO 17 -15.167 1.272 -8.457
118 2HG PRO 17 2HG PRO 17 -14.926 2.687 -9.500
119 1HD PRO 17 1HD PRO 17 -13.771 2.481 -7.072
120 2HD PRO 17 2HD PRO 17 -14.304 4.040 -7.733
121 HA PRO 18 HA PRO 18 -19.757 0.061 -5.141
122 1HB PRO 18 1HB PRO 18 -20.575 -1.249 -7.530
123 2HB PRO 18 2HB PRO 18 -21.536 -0.174 -6.514
124 1HG PRO 18 1HG PRO 18 -20.055 0.411 -9.017
125 2HG PRO 18 2HG PRO 18 -21.521 1.169 -8.371
126 1HD PRO 18 1HD PRO 18 -19.162 2.431 -8.311
127 2HD PRO 18 2HD PRO 18 -20.320 2.586 -6.974
128 H GLY 19 H GLY 19 -17.462 -0.408 -7.739
129 1HA GLY 19 1HA GLY 19 -15.855 -2.000 -8.089
130 2HA GLY 19 2HA GLY 19 -17.090 -3.162 -7.630
131 H GLU 20 H GLU 20 -15.253 -0.657 -5.837
132 HA GLU 20 HA GLU 20 -14.425 -2.795 -3.977
133 1HB GLU 20 1HB GLU 20 -12.934 -0.219 -4.202
134 2HB GLU 20 2HB GLU 20 -12.355 -1.798 -3.697
135 1HG GLU 20 1HG GLU 20 -11.475 -2.013 -5.714
136 2HG GLU 20 2HG GLU 20 -13.116 -2.164 -6.336
137 H ASN 21 H ASN 21 -14.748 -2.550 -1.877
138 HA ASN 21 HA ASN 21 -15.912 -0.031 -0.921
139 1HB ASN 21 1HB ASN 21 -17.090 -2.621 -0.975
140 2HB ASN 21 2HB ASN 21 -16.884 -2.117 0.691
141 2HD2 ASN 21 2HD2 ASN 21 -19.325 -2.408 0.167
142 1HD2 ASN 21 1HD2 ASN 21 -20.145 -0.936 -0.186
143 H LEU 22 H LEU 22 -13.610 -2.519 -0.495
144 HA LEU 22 HA LEU 22 -12.995 -1.613 2.223
145 1HB LEU 22 1HB LEU 22 -12.025 -4.087 0.809
146 2HB LEU 22 2HB LEU 22 -11.850 -3.702 2.501
147 HG LEU 22 HG LEU 22 -14.577 -3.990 1.306
148 1HD1 LEU 22 1HD1 LEU 22 -13.064 -5.995 0.803
149 2HD1 LEU 22 2HD1 LEU 22 -13.113 -6.296 2.540
150 3HD1 LEU 22 3HD1 LEU 22 -14.606 -6.302 1.602
151 1HD2 LEU 22 1HD2 LEU 22 -13.386 -4.230 4.056
152 2HD2 LEU 22 2HD2 LEU 22 -14.610 -3.095 3.486
153 3HD2 LEU 22 3HD2 LEU 22 -15.008 -4.804 3.667
154 H CYS 23 H CYS 23 -10.690 -1.515 2.792
155 HA CYS 23 HA CYS 23 -9.107 -0.383 0.583
156 1HB CYS 23 1HB CYS 23 -8.596 -0.069 3.543
157 2HB CYS 23 2HB CYS 23 -7.889 0.865 2.233
158 H TYR 24 H TYR 24 -6.732 -0.814 0.658
159 HA TYR 24 HA TYR 24 -5.941 -3.153 2.163
160 1HB TYR 24 1HB TYR 24 -5.537 -4.631 0.431
161 2HB TYR 24 2HB TYR 24 -7.057 -3.894 -0.047
162 HD1 TYR 24 HD1 TYR 24 -3.356 -3.396 -0.584
163 HD2 TYR 24 HD2 TYR 24 -7.285 -3.207 -2.229
164 HE1 TYR 24 HE1 TYR 24 -2.409 -2.834 -2.773
165 HE2 TYR 24 HE2 TYR 24 -6.337 -2.635 -4.423
166 HH TYR 24 HH TYR 24 -4.321 -1.701 -5.373
167 H ARG 25 H ARG 25 -3.809 -3.416 2.447
168 HA ARG 25 HA ARG 25 -1.957 -1.583 1.108
169 1HB ARG 25 1HB ARG 25 -2.652 -0.668 3.364
170 2HB ARG 25 2HB ARG 25 -1.909 -2.086 4.089
171 1HG ARG 25 1HG ARG 25 0.133 -1.215 2.570
172 2HG ARG 25 2HG ARG 25 -0.672 0.315 2.922
173 1HD ARG 25 1HD ARG 25 0.418 -1.700 4.873
174 2HD ARG 25 2HD ARG 25 0.939 -0.032 4.633
175 HE ARG 25 HE ARG 25 -1.658 0.222 5.357
176 1HH1 ARG 25 1HH1 ARG 25 1.067 -1.447 6.760
177 2HH1 ARG 25 2HH1 ARG 25 0.498 -1.269 8.386
178 1HH2 ARG 25 1HH2 ARG 25 -2.409 0.456 7.493
179 2HH2 ARG 25 2HH2 ARG 25 -1.477 -0.189 8.803
180 H LYS 26 H LYS 26 -0.579 -2.906 0.097
181 HA LYS 26 HA LYS 26 -0.055 -5.550 1.198
182 1HB LYS 26 1HB LYS 26 -0.529 -5.151 -1.241
183 2HB LYS 26 2HB LYS 26 1.035 -4.372 -1.349
184 1HG LYS 26 1HG LYS 26 1.290 -6.941 -0.097
185 2HG LYS 26 2HG LYS 26 0.456 -7.087 -1.644
186 1HD LYS 26 1HD LYS 26 2.693 -5.293 -1.883
187 2HD LYS 26 2HD LYS 26 3.216 -6.833 -1.200
188 1HE LYS 26 1HE LYS 26 3.404 -7.196 -3.482
189 2HE LYS 26 2HE LYS 26 1.824 -7.883 -3.106
190 1HZ LYS 26 1HZ LYS 26 2.174 -5.109 -4.088
191 2HZ LYS 26 2HZ LYS 26 1.929 -6.424 -5.125
192 3HZ LYS 26 3HZ LYS 26 0.742 -6.005 -3.996
193 H MET 27 H MET 27 1.953 -6.354 1.735
194 HA MET 27 HA MET 27 4.221 -4.542 1.768
195 1HB MET 27 1HB MET 27 2.970 -5.680 4.246
196 2HB MET 27 2HB MET 27 4.624 -5.099 4.203
197 1HG MET 27 1HG MET 27 3.881 -2.882 3.616
198 2HG MET 27 2HG MET 27 2.213 -3.439 3.514
199 1HE MET 27 1HE MET 27 4.909 -1.908 5.614
200 2HE MET 27 2HE MET 27 4.602 -2.428 7.271
201 3HE MET 27 3HE MET 27 5.264 -3.566 6.097
202 H TRP 28 H TRP 28 6.082 -5.510 1.456
203 HA TRP 28 HA TRP 28 6.746 -8.141 2.317
204 1HB TRP 28 1HB TRP 28 6.905 -9.273 0.143
205 2HB TRP 28 2HB TRP 28 5.242 -8.842 0.508
206 HD1 TRP 28 HD1 TRP 28 5.534 -5.772 -0.453
207 HE1 TRP 28 HE1 TRP 28 5.567 -5.289 -2.985
208 HE3 TRP 28 HE3 TRP 28 6.932 -10.382 -2.132
209 HZ2 TRP 28 HZ2 TRP 28 6.131 -6.669 -5.365
210 HZ3 TRP 28 HZ3 TRP 28 7.201 -10.723 -4.555
211 HH2 TRP 28 HH2 TRP 28 6.807 -8.905 -6.138
212 H CYS 29 H CYS 29 8.887 -8.007 2.668
213 HA CYS 29 HA CYS 29 10.378 -5.849 1.948
214 1HB CYS 29 1HB CYS 29 11.443 -8.568 2.635
215 2HB CYS 29 2HB CYS 29 12.412 -7.129 2.506
216 H ASP 30 H ASP 30 10.987 -5.118 0.071
217 HA ASP 30 HA ASP 30 11.415 -6.845 -2.192
218 1HB ASP 30 1HB ASP 30 12.041 -4.849 -3.413
219 2HB ASP 30 2HB ASP 30 10.621 -4.467 -2.462
220 H ALA 31 H ALA 31 13.460 -7.363 -3.020
221 HA ALA 31 HA ALA 31 15.362 -8.310 -1.424
222 1HB ALA 31 1HB ALA 31 16.598 -8.686 -3.264
223 2HB ALA 31 2HB ALA 31 15.168 -8.070 -4.091
224 3HB ALA 31 3HB ALA 31 16.538 -7.002 -3.784
225 H PHE 32 H PHE 32 14.953 -6.350 0.153
226 HA PHE 32 HA PHE 32 17.457 -5.259 0.688
227 1HB PHE 32 1HB PHE 32 15.797 -3.697 -1.040
228 2HB PHE 32 2HB PHE 32 15.974 -2.879 0.496
229 HD1 PHE 32 HD1 PHE 32 17.448 -3.439 -2.651
230 HD2 PHE 32 HD2 PHE 32 18.401 -2.736 1.434
231 HE1 PHE 32 HE1 PHE 32 19.689 -2.667 -3.312
232 HE2 PHE 32 HE2 PHE 32 20.642 -1.957 0.783
233 HZ PHE 32 HZ PHE 32 21.289 -1.922 -1.594
234 H CYS 33 H CYS 33 15.123 -6.733 1.909
235 HA CYS 33 HA CYS 33 13.573 -5.389 3.661
236 1HB CYS 33 1HB CYS 33 13.904 -7.924 3.352
237 2HB CYS 33 2HB CYS 33 15.104 -7.776 4.629
238 H SER 34 H SER 34 17.030 -5.508 3.779
239 HA SER 34 HA SER 34 17.250 -4.612 6.500
240 1HB SER 34 1HB SER 34 19.010 -5.798 4.824
241 2HB SER 34 2HB SER 34 19.491 -4.114 4.620
242 HG SER 34 HG SER 34 19.180 -5.355 7.149
243 H SER 35 H SER 35 17.668 -3.086 3.297
244 HA SER 35 HA SER 35 17.568 -0.443 4.571
245 1HB SER 35 1HB SER 35 19.211 -1.371 2.582
246 2HB SER 35 2HB SER 35 17.962 -0.540 1.655
247 HG SER 35 HG SER 35 18.478 1.339 2.611
248 H ARG 36 H ARG 36 16.370 -1.577 1.395
249 HA ARG 36 HA ARG 36 14.085 0.121 1.542
250 1HB ARG 36 1HB ARG 36 14.222 -2.239 -0.304
251 2HB ARG 36 2HB ARG 36 13.498 -0.676 -0.574
252 1HG ARG 36 1HG ARG 36 15.618 0.356 -0.881
253 2HG ARG 36 2HG ARG 36 16.460 -1.110 -0.383
254 1HD ARG 36 1HD ARG 36 15.942 -2.228 -2.348
255 2HD ARG 36 2HD ARG 36 14.579 -1.176 -2.702
256 HE ARG 36 HE ARG 36 16.987 0.299 -2.751
257 1HH1 ARG 36 1HH1 ARG 36 15.191 -2.056 -4.597
258 2HH1 ARG 36 2HH1 ARG 36 15.860 -1.560 -6.115
259 1HH2 ARG 36 1HH2 ARG 36 17.867 0.953 -4.748
260 2HH2 ARG 36 2HH2 ARG 36 17.379 0.148 -6.201
261 H GLY 37 H GLY 37 13.843 -3.430 0.932
262 1HA GLY 37 1HA GLY 37 12.510 -3.767 3.459
263 2HA GLY 37 2HA GLY 37 12.795 -4.995 2.243
264 H LYS 38 H LYS 38 10.476 -4.411 3.881
265 HA LYS 38 HA LYS 38 8.519 -5.278 2.340
266 1HB LYS 38 1HB LYS 38 7.462 -3.291 4.159
267 2HB LYS 38 2HB LYS 38 7.143 -5.003 4.044
268 1HG LYS 38 1HG LYS 38 8.063 -4.805 6.140
269 2HG LYS 38 2HG LYS 38 9.454 -5.267 5.164
270 1HD LYS 38 1HD LYS 38 10.020 -2.837 4.967
271 2HD LYS 38 2HD LYS 38 8.726 -2.504 6.118
272 1HE LYS 38 1HE LYS 38 9.865 -4.036 7.727
273 2HE LYS 38 2HE LYS 38 11.209 -4.145 6.591
274 1HZ LYS 38 1HZ LYS 38 10.396 -1.450 7.257
275 2HZ LYS 38 2HZ LYS 38 11.030 -2.332 8.554
276 3HZ LYS 38 3HZ LYS 38 11.946 -2.118 7.147
277 H VAL 39 H VAL 39 7.935 -4.692 0.428
278 HA VAL 39 HA VAL 39 7.836 -1.982 -0.468
279 HB VAL 39 HB VAL 39 6.245 -4.130 -1.798
280 1HG1 VAL 39 1HG1 VAL 39 6.389 -1.755 -2.614
281 2HG1 VAL 39 2HG1 VAL 39 8.072 -2.091 -3.022
282 3HG1 VAL 39 3HG1 VAL 39 6.778 -3.007 -3.797
283 1HG2 VAL 39 1HG2 VAL 39 9.081 -4.338 -1.242
284 2HG2 VAL 39 2HG2 VAL 39 7.970 -5.536 -1.904
285 3HG2 VAL 39 3HG2 VAL 39 8.736 -4.361 -2.972
286 H VAL 40 H VAL 40 6.183 -0.594 -0.259
287 HA VAL 40 HA VAL 40 3.756 -1.567 1.054
288 HB VAL 40 HB VAL 40 4.622 1.299 0.691
289 1HG1 VAL 40 1HG1 VAL 40 2.376 -0.069 2.035
290 2HG1 VAL 40 2HG1 VAL 40 3.123 1.268 2.910
291 3HG1 VAL 40 3HG1 VAL 40 2.455 1.532 1.298
292 1HG2 VAL 40 1HG2 VAL 40 5.424 -0.750 2.676
293 2HG2 VAL 40 2HG2 VAL 40 6.324 0.629 2.043
294 3HG2 VAL 40 3HG2 VAL 40 5.088 0.874 3.278
295 H GLU 41 H GLU 41 1.946 -1.773 -0.029
296 HA GLU 41 HA GLU 41 1.593 -0.277 -2.542
297 1HB GLU 41 1HB GLU 41 1.784 -2.938 -2.451
298 2HB GLU 41 2HB GLU 41 0.074 -2.794 -2.067
299 1HG GLU 41 1HG GLU 41 -0.240 -2.796 -4.268
300 2HG GLU 41 2HG GLU 41 0.319 -1.125 -4.213
301 H LEU 42 H LEU 42 -0.635 0.276 -3.062
302 HA LEU 42 HA LEU 42 -2.504 0.294 -0.826
303 1HB LEU 42 1HB LEU 42 -0.904 2.531 -1.570
304 2HB LEU 42 2HB LEU 42 -2.564 2.893 -1.991
305 HG LEU 42 HG LEU 42 -3.275 2.549 0.288
306 1HD1 LEU 42 1HD1 LEU 42 -0.468 1.577 0.647
307 2HD1 LEU 42 2HD1 LEU 42 -1.395 2.203 2.012
308 3HD1 LEU 42 3HD1 LEU 42 -1.983 0.803 1.114
309 1HD2 LEU 42 1HD2 LEU 42 -2.349 4.751 -0.368
310 2HD2 LEU 42 2HD2 LEU 42 -2.156 4.398 1.349
311 3HD2 LEU 42 3HD2 LEU 42 -0.781 4.240 0.257
312 H GLY 43 H GLY 43 -4.618 0.289 -1.430
313 1HA GLY 43 1HA GLY 43 -5.243 -0.427 -4.101
314 2HA GLY 43 2HA GLY 43 -5.695 1.245 -3.807
315 H CYS 44 H CYS 44 -7.836 0.240 -4.358
316 HA CYS 44 HA CYS 44 -9.181 -0.436 -1.856
317 1HB CYS 44 1HB CYS 44 -9.844 1.311 -3.852
318 2HB CYS 44 2HB CYS 44 -10.811 -0.093 -4.288
319 H ALA 45 H ALA 45 -10.624 -2.212 -1.692
320 HA ALA 45 HA ALA 45 -10.582 -4.192 -3.833
321 1HB ALA 45 1HB ALA 45 -8.678 -4.920 -2.658
322 2HB ALA 45 2HB ALA 45 -9.444 -4.658 -1.092
323 3HB ALA 45 3HB ALA 45 -9.986 -5.977 -2.128
324 H ALA 46 H ALA 46 -12.215 -5.786 -3.661
325 HA ALA 46 HA ALA 46 -14.548 -4.864 -2.213
326 1HB ALA 46 1HB ALA 46 -15.804 -6.312 -3.562
327 2HB ALA 46 2HB ALA 46 -14.521 -5.727 -4.622
328 3HB ALA 46 3HB ALA 46 -14.413 -7.338 -3.911
329 H THR 47 H THR 47 -12.236 -7.480 -2.092
330 HA THR 47 HA THR 47 -13.403 -8.351 0.453
331 HB THR 47 HB THR 47 -12.363 -10.675 -0.604
332 HG1 THR 47 HG1 THR 47 -13.845 -9.376 -2.637
333 1HG2 THR 47 1HG2 THR 47 -15.096 -9.618 -0.231
334 2HG2 THR 47 2HG2 THR 47 -14.906 -11.071 -1.213
335 3HG2 THR 47 3HG2 THR 47 -14.326 -11.049 0.452
336 H CYS 48 H CYS 48 -11.617 -10.300 1.140
337 HA CYS 48 HA CYS 48 -9.011 -8.944 1.046
338 1HB CYS 48 1HB CYS 48 -10.332 -8.747 3.238
339 2HB CYS 48 2HB CYS 48 -9.960 -10.449 3.443
340 HA PRO 49 HA PRO 49 -8.454 -13.397 -0.083
341 1HB PRO 49 1HB PRO 49 -7.846 -13.173 -2.662
342 2HB PRO 49 2HB PRO 49 -9.525 -13.071 -2.119
343 1HG PRO 49 1HG PRO 49 -7.659 -10.890 -2.929
344 2HG PRO 49 2HG PRO 49 -9.396 -11.052 -3.235
345 1HD PRO 49 1HD PRO 49 -8.224 -9.520 -1.208
346 2HD PRO 49 2HD PRO 49 -9.925 -10.013 -1.284
347 H SER 50 H SER 50 -6.471 -14.443 -1.096
348 HA SER 50 HA SER 50 -4.088 -12.955 -1.440
349 1HB SER 50 1HB SER 50 -3.419 -14.530 0.858
350 2HB SER 50 2HB SER 50 -3.269 -12.788 0.633
351 HG SER 50 HG SER 50 -4.731 -12.758 2.157
352 H LYS 51 H LYS 51 -2.667 -14.137 -2.559
353 HA LYS 51 HA LYS 51 -2.274 -16.916 -2.228
354 1HB LYS 51 1HB LYS 51 -4.414 -16.158 -3.939
355 2HB LYS 51 2HB LYS 51 -3.153 -16.921 -4.891
356 1HG LYS 51 1HG LYS 51 -4.476 -18.087 -2.455
357 2HG LYS 51 2HG LYS 51 -4.786 -18.546 -4.129
358 1HD LYS 51 1HD LYS 51 -2.816 -19.683 -4.328
359 2HD LYS 51 2HD LYS 51 -1.979 -18.647 -3.170
360 1HE LYS 51 1HE LYS 51 -3.940 -20.856 -2.580
361 2HE LYS 51 2HE LYS 51 -2.222 -20.810 -2.184
362 1HZ LYS 51 1HZ LYS 51 -3.056 -18.621 -0.942
363 2HZ LYS 51 2HZ LYS 51 -4.469 -19.545 -0.843
364 3HZ LYS 51 3HZ LYS 51 -3.022 -20.143 -0.203
365 H LYS 52 H LYS 52 -0.193 -15.732 -2.087
366 HA LYS 52 HA LYS 52 1.173 -15.884 -4.637
367 1HB LYS 52 1HB LYS 52 0.779 -13.314 -3.147
368 2HB LYS 52 2HB LYS 52 2.259 -13.573 -4.061
369 1HG LYS 52 1HG LYS 52 -0.530 -13.718 -5.189
370 2HG LYS 52 2HG LYS 52 0.569 -12.346 -5.341
371 1HD LYS 52 1HD LYS 52 1.627 -13.293 -7.059
372 2HD LYS 52 2HD LYS 52 1.851 -14.799 -6.168
373 1HE LYS 52 1HE LYS 52 -0.146 -15.700 -6.942
374 2HE LYS 52 2HE LYS 52 -0.809 -14.121 -7.360
375 1HZ LYS 52 1HZ LYS 52 1.589 -15.020 -8.775
376 2HZ LYS 52 2HZ LYS 52 0.117 -15.747 -9.182
377 3HZ LYS 52 3HZ LYS 52 0.302 -14.071 -9.327
378 HA PRO 53 HA PRO 53 4.712 -17.439 -2.550
379 1HB PRO 53 1HB PRO 53 6.143 -14.969 -3.449
380 2HB PRO 53 2HB PRO 53 6.649 -16.659 -3.551
381 1HG PRO 53 1HG PRO 53 5.692 -15.378 -5.690
382 2HG PRO 53 2HG PRO 53 5.323 -17.087 -5.396
383 1HD PRO 53 1HD PRO 53 3.575 -14.708 -5.137
384 2HD PRO 53 2HD PRO 53 3.147 -16.396 -5.468
385 H TYR 54 H TYR 54 4.950 -13.881 -2.287
386 HA TYR 54 HA TYR 54 4.561 -14.000 0.569
387 1HB TYR 54 1HB TYR 54 7.181 -14.031 -0.523
388 2HB TYR 54 2HB TYR 54 6.929 -12.505 0.310
389 HD1 TYR 54 HD1 TYR 54 6.989 -16.166 0.707
390 HD2 TYR 54 HD2 TYR 54 6.757 -12.412 2.695
391 HE1 TYR 54 HE1 TYR 54 7.393 -17.287 2.858
392 HE2 TYR 54 HE2 TYR 54 7.161 -13.522 4.852
393 HH TYR 54 HH TYR 54 8.172 -16.798 5.073
394 H GLU 55 H GLU 55 2.765 -12.684 0.003
395 HA GLU 55 HA GLU 55 3.450 -9.863 -0.121
396 1HB GLU 55 1HB GLU 55 1.796 -11.265 -2.214
397 2HB GLU 55 2HB GLU 55 1.642 -9.541 -1.909
398 1HG GLU 55 1HG GLU 55 3.878 -9.134 -2.574
399 2HG GLU 55 2HG GLU 55 4.253 -10.856 -2.597
400 H GLU 56 H GLU 56 2.632 -9.727 1.977
401 HA GLU 56 HA GLU 56 -0.059 -10.600 2.543
402 1HB GLU 56 1HB GLU 56 1.700 -8.933 4.327
403 2HB GLU 56 2HB GLU 56 0.388 -10.001 4.786
404 1HG GLU 56 1HG GLU 56 1.772 -11.706 5.012
405 2HG GLU 56 2HG GLU 56 2.377 -11.488 3.371
406 H VAL 57 H VAL 57 -1.840 -9.387 2.487
407 HA VAL 57 HA VAL 57 -1.537 -6.470 2.230
408 HB VAL 57 HB VAL 57 -3.893 -6.887 0.978
409 1HG1 VAL 57 1HG1 VAL 57 -1.955 -5.542 0.221
410 2HG1 VAL 57 2HG1 VAL 57 -1.229 -7.018 -0.415
411 3HG1 VAL 57 3HG1 VAL 57 -2.752 -6.427 -1.080
412 1HG2 VAL 57 1HG2 VAL 57 -3.535 -9.369 1.147
413 2HG2 VAL 57 2HG2 VAL 57 -3.831 -8.756 -0.480
414 3HG2 VAL 57 3HG2 VAL 57 -2.192 -9.175 0.020
415 H THR 58 H THR 58 -2.498 -5.406 3.843
416 HA THR 58 HA THR 58 -4.448 -6.785 5.502
417 HB THR 58 HB THR 58 -4.268 -4.552 6.803
418 HG1 THR 58 HG1 THR 58 -3.187 -3.392 5.178
419 1HG2 THR 58 1HG2 THR 58 -3.134 -6.808 7.332
420 2HG2 THR 58 2HG2 THR 58 -1.675 -6.022 6.731
421 3HG2 THR 58 3HG2 THR 58 -2.540 -5.340 8.108
422 H CYS 59 H CYS 59 -6.510 -6.667 4.972
423 HA CYS 59 HA CYS 59 -7.497 -4.267 3.616
424 1HB CYS 59 1HB CYS 59 -9.304 -6.556 3.610
425 2HB CYS 59 2HB CYS 59 -8.714 -5.583 2.275
426 H CYS 60 H CYS 60 -9.183 -3.103 4.464
427 HA CYS 60 HA CYS 60 -10.569 -4.168 6.812
428 1HB CYS 60 1HB CYS 60 -10.222 -2.123 8.062
429 2HB CYS 60 2HB CYS 60 -8.656 -2.767 7.580
430 H SER 61 H SER 61 -12.015 -1.865 7.426
431 HA SER 61 HA SER 61 -13.261 -0.881 5.015
432 1HB SER 61 1HB SER 61 -15.340 -1.896 5.208
433 2HB SER 61 2HB SER 61 -14.270 -3.209 5.697
434 HG SER 61 HG SER 61 -14.711 -2.694 7.857
435 H THR 62 H THR 62 -11.856 0.333 7.218
436 HA THR 62 HA THR 62 -14.079 1.830 8.467
437 HB THR 62 HB THR 62 -12.710 0.631 10.100
438 HG1 THR 62 HG1 THR 62 -12.196 3.415 10.213
439 1HG2 THR 62 1HG2 THR 62 -10.571 0.876 8.660
440 2HG2 THR 62 2HG2 THR 62 -10.387 2.400 9.528
441 3HG2 THR 62 3HG2 THR 62 -10.456 0.880 10.420
442 H ASP 63 H ASP 63 -12.867 2.316 5.842
443 HA ASP 63 HA ASP 63 -12.222 4.061 4.542
444 1HB ASP 63 1HB ASP 63 -14.008 5.096 6.205
445 2HB ASP 63 2HB ASP 63 -12.616 6.027 6.736
446 H LYS 64 H LYS 64 -10.493 5.264 4.007
447 HA LYS 64 HA LYS 64 -8.136 5.325 4.006
448 1HB LYS 64 1HB LYS 64 -7.594 7.385 5.547
449 2HB LYS 64 2HB LYS 64 -8.571 7.573 4.100
450 1HG LYS 64 1HG LYS 64 -10.066 6.958 6.556
451 2HG LYS 64 2HG LYS 64 -9.247 8.520 6.531
452 1HD LYS 64 1HD LYS 64 -11.058 7.544 4.329
453 2HD LYS 64 2HD LYS 64 -11.603 8.548 5.674
454 1HE LYS 64 1HE LYS 64 -9.443 9.287 3.703
455 2HE LYS 64 2HE LYS 64 -11.107 9.868 3.657
456 1HZ LYS 64 1HZ LYS 64 -10.436 10.519 6.141
457 2HZ LYS 64 2HZ LYS 64 -8.919 10.645 5.402
458 3HZ LYS 64 3HZ LYS 64 -10.219 11.558 4.824
459 H CYS 65 H CYS 65 -8.718 3.181 5.681
460 HA CYS 65 HA CYS 65 -7.193 3.582 8.119
461 1HB CYS 65 1HB CYS 65 -8.564 2.040 8.944
462 2HB CYS 65 2HB CYS 65 -9.334 1.918 7.377
463 H ASN 66 H ASN 66 -6.436 2.875 4.978
464 HA ASN 66 HA ASN 66 -4.230 1.107 5.713
465 1HB ASN 66 1HB ASN 66 -4.154 0.539 3.339
466 2HB ASN 66 2HB ASN 66 -5.737 0.224 4.029
467 2HD2 ASN 66 2HD2 ASN 66 -4.284 1.281 1.396
468 1HD2 ASN 66 1HD2 ASN 66 -5.455 2.400 0.793
469 HA PRO 67 HA PRO 67 -2.249 5.161 4.431
470 1HB PRO 67 1HB PRO 67 -1.462 6.173 6.758
471 2HB PRO 67 2HB PRO 67 -3.143 6.341 6.234
472 1HG PRO 67 1HG PRO 67 -1.953 4.402 8.182
473 2HG PRO 67 2HG PRO 67 -3.459 5.329 8.307
474 1HD PRO 67 1HD PRO 67 -3.312 2.694 7.495
475 2HD PRO 67 2HD PRO 67 -4.630 3.804 7.086
476 H HIS 68 H HIS 68 -0.215 4.942 3.725
477 HA HIS 68 HA HIS 68 1.491 2.870 4.220
478 1HB HIS 68 1HB HIS 68 1.754 4.574 2.416
479 2HB HIS 68 2HB HIS 68 2.386 5.691 3.617
480 HD1 HIS 68 HD1 HIS 68 4.538 4.459 5.021
481 HD2 HIS 68 HD2 HIS 68 3.752 3.356 1.093
482 HE1 HIS 68 HE1 HIS 68 6.669 3.428 4.174
483 HE2 HIS 68 HE2 HIS 68 6.194 2.834 1.772
484 HA PRO 69 HA PRO 69 2.687 3.662 8.479
485 1HB PRO 69 1HB PRO 69 4.389 1.557 8.724
486 2HB PRO 69 2HB PRO 69 2.631 1.389 8.800
487 1HG PRO 69 1HG PRO 69 4.483 0.898 6.497
488 2HG PRO 69 2HG PRO 69 3.116 -0.082 7.061
489 1HD PRO 69 1HD PRO 69 2.913 1.587 4.950
490 2HD PRO 69 2HD PRO 69 1.554 1.289 6.053
491 H LYS 70 H LYS 70 3.792 5.619 7.533
492 HA LYS 70 HA LYS 70 6.372 5.886 8.452
493 1HB LYS 70 1HB LYS 70 7.139 4.372 6.733
494 2HB LYS 70 2HB LYS 70 6.298 5.283 5.490
495 1HG LYS 70 1HG LYS 70 8.533 5.895 5.256
496 2HG LYS 70 2HG LYS 70 7.811 7.235 6.149
497 1HD LYS 70 1HD LYS 70 9.637 6.915 7.461
498 2HD LYS 70 2HD LYS 70 8.576 5.724 8.214
499 1HE LYS 70 1HE LYS 70 9.967 4.615 5.933
500 2HE LYS 70 2HE LYS 70 11.095 5.274 7.116
501 1HZ LYS 70 1HZ LYS 70 9.775 3.969 8.814
502 2HZ LYS 70 2HZ LYS 70 9.064 3.159 7.510
503 3HZ LYS 70 3HZ LYS 70 10.735 3.066 7.752
504 H GLN 71 H GLN 71 3.917 6.892 6.196
505 HA GLN 71 HA GLN 71 4.725 9.333 5.307
506 1HB GLN 71 1HB GLN 71 1.973 8.805 6.420
507 2HB GLN 71 2HB GLN 71 2.408 9.978 5.188
508 1HG GLN 71 1HG GLN 71 3.272 7.772 3.977
509 2HG GLN 71 2HG GLN 71 2.014 7.060 4.985
510 2HE2 GLN 71 2HE2 GLN 71 0.115 6.921 4.047
511 1HE2 GLN 71 1HE2 GLN 71 -0.507 7.980 2.832
512 H ARG 72 H ARG 72 4.123 11.525 6.017
513 HA ARG 72 HA ARG 72 4.845 11.903 8.811
514 1HB ARG 72 1HB ARG 72 6.039 13.219 7.145
515 2HB ARG 72 2HB ARG 72 4.524 13.867 6.533
516 1HG ARG 72 1HG ARG 72 4.260 14.698 9.016
517 2HG ARG 72 2HG ARG 72 6.017 14.545 9.010
518 1HD ARG 72 1HD ARG 72 5.577 16.766 8.368
519 2HD ARG 72 2HD ARG 72 5.986 15.917 6.879
520 HE ARG 72 HE ARG 72 3.215 15.823 7.186
521 1HH1 ARG 72 1HH1 ARG 72 5.716 18.193 6.633
522 2HH1 ARG 72 2HH1 ARG 72 4.677 19.269 5.760
523 1HH2 ARG 72 1HH2 ARG 72 1.846 17.236 6.038
524 2HH2 ARG 72 2HH2 ARG 72 2.480 18.725 5.420
525 HA PRO 73 HA PRO 73 0.697 12.632 10.182
526 1HB PRO 73 1HB PRO 73 1.210 14.415 12.198
527 2HB PRO 73 2HB PRO 73 1.412 12.668 12.348
528 1HG PRO 73 1HG PRO 73 3.467 14.773 11.796
529 2HG PRO 73 2HG PRO 73 3.570 13.359 12.862
530 1HD PRO 73 1HD PRO 73 4.709 13.369 10.433
531 2HD PRO 73 2HD PRO 73 3.963 11.902 11.101
532 H GLY 74 H GLY 74 -0.642 13.787 8.946
533 1HA GLY 74 1HA GLY 74 -0.084 16.671 8.613
534 2HA GLY 74 2HA GLY 74 -1.701 16.052 8.910
535 H1 TRP 75 H1 TRP 75 3.441 1.691 -10.514
536 H2 TRP 75 H2 TRP 75 4.690 1.382 -11.646
537 H3 TRP 75 H3 TRP 75 4.071 0.104 -10.683
538 HA TRP 75 HA TRP 75 6.087 0.675 -9.753
539 1HB TRP 75 1HB TRP 75 6.595 3.044 -9.174
540 2HB TRP 75 2HB TRP 75 6.405 2.782 -10.903
541 HD1 TRP 75 HD1 TRP 75 3.920 3.752 -8.061
542 HE1 TRP 75 HE1 TRP 75 2.497 5.723 -8.915
543 HE3 TRP 75 HE3 TRP 75 5.978 4.291 -12.710
544 HZ2 TRP 75 HZ2 TRP 75 2.277 7.294 -11.247
545 HZ3 TRP 75 HZ3 TRP 75 5.104 6.052 -14.190
546 HH2 TRP 75 HH2 TRP 75 3.291 7.521 -13.472
547 H ARG 76 H ARG 76 6.512 1.234 -7.449
548 HA ARG 76 HA ARG 76 4.127 1.720 -5.842
549 1HB ARG 76 1HB ARG 76 5.171 -0.345 -4.410
550 2HB ARG 76 2HB ARG 76 3.819 -0.492 -5.521
551 1HG ARG 76 1HG ARG 76 5.519 -2.246 -5.818
552 2HG ARG 76 2HG ARG 76 5.274 -1.273 -7.269
553 1HD ARG 76 1HD ARG 76 7.401 -0.608 -7.276
554 2HD ARG 76 2HD ARG 76 7.330 -0.150 -5.576
555 HE ARG 76 HE ARG 76 8.252 -2.179 -5.008
556 1HH1 ARG 76 1HH1 ARG 76 7.356 -2.215 -8.382
557 2HH1 ARG 76 2HH1 ARG 76 8.200 -3.688 -8.717
558 1HH2 ARG 76 1HH2 ARG 76 9.360 -4.118 -5.449
559 2HH2 ARG 76 2HH2 ARG 76 9.336 -4.770 -7.054
560 H TYR 77 H TYR 77 5.042 1.295 -3.339
561 HA TYR 77 HA TYR 77 7.530 2.882 -3.218
562 1HB TYR 77 1HB TYR 77 5.287 3.079 -1.213
563 2HB TYR 77 2HB TYR 77 6.674 4.140 -1.388
564 HD1 TYR 77 HD1 TYR 77 3.955 2.927 -3.687
565 HD2 TYR 77 HD2 TYR 77 6.111 6.235 -2.104
566 HE1 TYR 77 HE1 TYR 77 2.640 4.453 -5.091
567 HE2 TYR 77 HE2 TYR 77 4.796 7.767 -3.502
568 HH TYR 77 HH TYR 77 1.987 6.749 -5.197
569 H TYR 78 H TYR 78 8.819 2.551 -1.296
570 HA TYR 78 HA TYR 78 8.516 -0.149 -0.226
571 1HB TYR 78 1HB TYR 78 10.905 1.706 -0.101
572 2HB TYR 78 2HB TYR 78 10.865 0.040 0.435
573 HD1 TYR 78 HD1 TYR 78 8.991 -0.534 -2.187
574 HD2 TYR 78 HD2 TYR 78 12.897 0.983 -1.449
575 HE1 TYR 78 HE1 TYR 78 9.705 -1.289 -4.414
576 HE2 TYR 78 HE2 TYR 78 13.614 0.231 -3.674
577 HH TYR 78 HH TYR 78 12.267 -0.233 -5.985
578 H GLU 79 H GLU 79 9.086 -0.409 2.118
579 HA GLU 79 HA GLU 79 7.396 1.195 3.684
580 1HB GLU 79 1HB GLU 79 8.768 -1.209 4.017
581 2HB GLU 79 2HB GLU 79 9.416 -0.157 5.267
582 1HG GLU 79 1HG GLU 79 6.529 0.012 5.083
583 2HG GLU 79 2HG GLU 79 7.089 -1.630 5.393
584 H SER 80 H SER 80 10.940 1.044 3.602
585 HA SER 80 HA SER 80 11.370 3.072 5.492
586 1HB SER 80 1HB SER 80 12.953 1.380 3.873
587 2HB SER 80 2HB SER 80 13.548 3.026 3.699
588 HG SER 80 HG SER 80 14.339 1.636 5.534
589 H SER 81 H SER 81 10.970 3.214 1.992
590 HA SER 81 HA SER 81 11.372 6.113 2.102
591 1HB SER 81 1HB SER 81 12.337 5.978 0.088
592 2HB SER 81 2HB SER 81 12.428 4.252 0.394
593 HG SER 81 HG SER 81 10.568 5.683 -1.163
594 H LEU 82 H LEU 82 9.638 7.351 2.169
595 HA LEU 82 HA LEU 82 7.011 6.392 1.606
596 1HB LEU 82 1HB LEU 82 8.190 8.507 3.009
597 2HB LEU 82 2HB LEU 82 7.275 9.275 1.731
598 HG LEU 82 HG LEU 82 6.208 8.856 4.053
599 1HD1 LEU 82 1HD1 LEU 82 5.219 9.292 1.509
600 2HD1 LEU 82 2HD1 LEU 82 4.240 7.959 2.124
601 3HD1 LEU 82 3HD1 LEU 82 4.334 9.474 3.023
602 1HD2 LEU 82 1HD2 LEU 82 6.778 6.380 3.935
603 2HD2 LEU 82 2HD2 LEU 82 5.139 6.809 4.431
604 3HD2 LEU 82 3HD2 LEU 82 5.446 6.247 2.787
605 H GLU 83 H GLU 83 9.499 7.816 -0.271
606 HA GLU 83 HA GLU 83 7.905 9.162 -2.190
607 1HB GLU 83 1HB GLU 83 10.744 8.364 -1.934
608 2HB GLU 83 2HB GLU 83 10.157 8.626 -3.570
609 1HG GLU 83 1HG GLU 83 11.181 10.629 -2.603
610 2HG GLU 83 2HG GLU 83 9.485 10.872 -3.018
611 HA PRO 84 HA PRO 84 6.640 5.890 -4.870
612 1HB PRO 84 1HB PRO 84 7.123 7.443 -7.271
613 2HB PRO 84 2HB PRO 84 5.587 7.097 -6.475
614 1HG PRO 84 1HG PRO 84 6.701 9.585 -6.573
615 2HG PRO 84 2HG PRO 84 5.626 9.044 -5.270
616 1HD PRO 84 1HD PRO 84 8.619 9.211 -5.311
617 2HD PRO 84 2HD PRO 84 7.487 9.648 -4.017
618 H TYR 85 H TYR 85 7.550 4.151 -5.777
619 HA TYR 85 HA TYR 85 10.244 4.457 -6.921
620 1HB TYR 85 1HB TYR 85 9.153 2.549 -4.925
621 2HB TYR 85 2HB TYR 85 10.333 1.929 -6.074
622 HD1 TYR 85 HD1 TYR 85 12.382 1.726 -5.003
623 HD2 TYR 85 HD2 TYR 85 10.034 5.202 -4.259
624 HE1 TYR 85 HE1 TYR 85 14.192 2.648 -3.623
625 HE2 TYR 85 HE2 TYR 85 11.843 6.130 -2.881
626 HH TYR 85 HH TYR 85 14.365 4.339 -1.702
627 HA PRO 86 HA PRO 86 8.285 2.963 -10.672
628 1HB PRO 86 1HB PRO 86 11.134 2.293 -11.252
629 2HB PRO 86 2HB PRO 86 9.950 3.139 -12.255
630 1HG PRO 86 1HG PRO 86 11.866 4.490 -11.002
631 2HG PRO 86 2HG PRO 86 10.221 5.144 -11.119
632 1HD PRO 86 1HD PRO 86 11.607 3.899 -8.789
633 2HD PRO 86 2HD PRO 86 10.426 5.224 -8.827
634 H ASP 87 H ASP 87 8.181 0.928 -11.862
635 HA ASP 87 HA ASP 87 8.203 -1.320 -10.106
636 1HB ASP 87 1HB ASP 87 6.976 -0.632 -12.556
637 2HB ASP 87 2HB ASP 87 7.830 -2.150 -12.786
No H/Q in entry = 637
Start of MODEL 6
1 H1 ILE 1 H1 ILE 1 -17.152 5.496 -0.631
2 H2 ILE 1 H2 ILE 1 -17.190 3.792 -0.431
3 H3 ILE 1 H3 ILE 1 -18.006 4.803 0.687
4 HA ILE 1 HA ILE 1 -16.141 5.463 1.705
5 HB ILE 1 HB ILE 1 -16.480 2.996 1.906
6 1HG1 ILE 1 1HG1 ILE 1 -13.596 3.811 2.121
7 2HG1 ILE 1 2HG1 ILE 1 -14.838 4.360 3.239
8 1HG2 ILE 1 1HG2 ILE 1 -15.851 2.385 -0.387
9 2HG2 ILE 1 2HG2 ILE 1 -14.183 2.826 -0.024
10 3HG2 ILE 1 3HG2 ILE 1 -14.942 1.478 0.821
11 1HD1 ILE 1 1HD1 ILE 1 -15.208 1.672 3.302
12 2HD1 ILE 1 2HD1 ILE 1 -13.465 1.788 3.064
13 3HD1 ILE 1 3HD1 ILE 1 -14.221 2.586 4.442
14 H VAL 2 H VAL 2 -13.781 5.678 1.769
15 HA VAL 2 HA VAL 2 -12.659 6.067 -0.915
16 HB VAL 2 HB VAL 2 -12.242 7.887 1.464
17 1HG1 VAL 2 1HG1 VAL 2 -10.503 7.440 -0.614
18 2HG1 VAL 2 2HG1 VAL 2 -11.414 8.848 -1.160
19 3HG1 VAL 2 3HG1 VAL 2 -10.564 8.892 0.384
20 1HG2 VAL 2 1HG2 VAL 2 -14.427 7.811 -0.156
21 2HG2 VAL 2 2HG2 VAL 2 -13.850 9.246 0.693
22 3HG2 VAL 2 3HG2 VAL 2 -13.402 8.979 -0.991
23 H CYS 3 H CYS 3 -10.788 5.077 -1.253
24 HA CYS 3 HA CYS 3 -9.193 4.251 1.089
25 1HB CYS 3 1HB CYS 3 -9.538 2.765 -1.529
26 2HB CYS 3 2HB CYS 3 -8.475 2.274 -0.217
27 H HIS 4 H HIS 4 -6.877 3.814 0.522
28 HA HIS 4 HA HIS 4 -5.883 6.075 -1.017
29 1HB HIS 4 1HB HIS 4 -4.413 4.121 0.759
30 2HB HIS 4 2HB HIS 4 -3.733 5.584 0.052
31 HD1 HIS 4 HD1 HIS 4 -5.577 7.746 0.713
32 HD2 HIS 4 HD2 HIS 4 -4.949 4.610 3.361
33 HE1 HIS 4 HE1 HIS 4 -6.267 8.614 2.965
34 HE2 HIS 4 HE2 HIS 4 -5.659 6.774 4.573
35 H THR 5 H THR 5 -4.232 5.872 -2.601
36 HA THR 5 HA THR 5 -3.952 3.191 -3.761
37 HB THR 5 HB THR 5 -5.565 5.060 -4.885
38 HG1 THR 5 HG1 THR 5 -5.790 3.304 -5.975
39 1HG2 THR 5 1HG2 THR 5 -3.731 6.574 -5.446
40 2HG2 THR 5 2HG2 THR 5 -2.951 5.279 -6.357
41 3HG2 THR 5 3HG2 THR 5 -4.509 5.919 -6.888
42 H THR 6 H THR 6 -2.114 2.834 -4.987
43 HA THR 6 HA THR 6 0.073 4.761 -4.548
44 HB THR 6 HB THR 6 1.537 2.650 -4.691
45 HG1 THR 6 HG1 THR 6 -0.102 1.229 -5.360
46 1HG2 THR 6 1HG2 THR 6 0.239 3.849 -2.480
47 2HG2 THR 6 2HG2 THR 6 0.284 2.106 -2.219
48 3HG2 THR 6 3HG2 THR 6 1.777 2.990 -2.526
49 H ALA 7 H ALA 7 -1.671 2.861 -6.827
50 HA ALA 7 HA ALA 7 0.041 2.339 -8.874
51 1HB ALA 7 1HB ALA 7 -2.051 3.137 -10.326
52 2HB ALA 7 2HB ALA 7 -2.044 1.633 -9.405
53 3HB ALA 7 3HB ALA 7 -2.821 3.071 -8.741
54 H THR 8 H THR 8 -1.055 5.477 -7.838
55 HA THR 8 HA THR 8 -0.103 6.836 -10.206
56 HB THR 8 HB THR 8 -1.265 8.614 -9.446
57 HG1 THR 8 HG1 THR 8 -0.646 8.362 -6.735
58 1HG2 THR 8 1HG2 THR 8 -2.617 6.519 -8.573
59 2HG2 THR 8 2HG2 THR 8 -2.240 7.244 -7.008
60 3HG2 THR 8 3HG2 THR 8 -3.122 8.172 -8.223
61 H SER 9 H SER 9 1.388 8.893 -9.641
62 HA SER 9 HA SER 9 3.881 7.778 -8.829
63 1HB SER 9 1HB SER 9 3.094 10.047 -10.257
64 2HB SER 9 2HB SER 9 3.906 10.674 -8.824
65 HG SER 9 HG SER 9 5.748 9.844 -9.487
66 HA PRO 10 HA PRO 10 3.268 10.136 -4.785
67 1HB PRO 10 1HB PRO 10 1.329 12.124 -4.741
68 2HB PRO 10 2HB PRO 10 3.040 12.378 -5.062
69 1HG PRO 10 1HG PRO 10 0.897 12.753 -6.875
70 2HG PRO 10 2HG PRO 10 2.627 12.802 -7.249
71 1HD PRO 10 1HD PRO 10 0.671 10.584 -7.604
72 2HD PRO 10 2HD PRO 10 2.102 10.993 -8.566
73 H ILE 11 H ILE 11 1.970 9.697 -2.917
74 HA ILE 11 HA ILE 11 -0.080 7.804 -3.357
75 HB ILE 11 HB ILE 11 0.255 9.310 -0.780
76 1HG1 ILE 11 1HG1 ILE 11 1.819 6.937 -1.804
77 2HG1 ILE 11 2HG1 ILE 11 2.463 8.537 -1.457
78 1HG2 ILE 11 1HG2 ILE 11 -1.707 7.892 -0.936
79 2HG2 ILE 11 2HG2 ILE 11 -0.698 6.524 -1.409
80 3HG2 ILE 11 3HG2 ILE 11 -0.546 7.215 0.207
81 1HD1 ILE 11 1HD1 ILE 11 1.254 6.706 0.597
82 2HD1 ILE 11 2HD1 ILE 11 2.981 6.865 0.279
83 3HD1 ILE 11 3HD1 ILE 11 2.066 8.243 0.891
84 H SER 12 H SER 12 -2.244 7.877 -3.009
85 HA SER 12 HA SER 12 -3.607 10.365 -2.473
86 1HB SER 12 1HB SER 12 -4.867 10.364 -4.623
87 2HB SER 12 2HB SER 12 -3.146 10.684 -4.837
88 HG SER 12 HG SER 12 -4.651 8.668 -5.826
89 H ALA 13 H ALA 13 -6.113 9.889 -3.154
90 HA ALA 13 HA ALA 13 -6.843 7.151 -2.521
91 1HB ALA 13 1HB ALA 13 -6.723 9.137 -0.496
92 2HB ALA 13 2HB ALA 13 -7.282 7.469 -0.369
93 3HB ALA 13 3HB ALA 13 -8.420 8.751 -0.783
94 H VAL 14 H VAL 14 -8.742 6.568 -3.429
95 HA VAL 14 HA VAL 14 -10.325 8.705 -4.699
96 HB VAL 14 HB VAL 14 -9.058 6.831 -6.082
97 1HG1 VAL 14 1HG1 VAL 14 -10.465 5.102 -4.709
98 2HG1 VAL 14 2HG1 VAL 14 -11.702 5.473 -5.910
99 3HG1 VAL 14 3HG1 VAL 14 -10.139 4.834 -6.422
100 1HG2 VAL 14 1HG2 VAL 14 -11.055 8.644 -6.600
101 2HG2 VAL 14 2HG2 VAL 14 -10.172 7.705 -7.804
102 3HG2 VAL 14 3HG2 VAL 14 -11.725 7.127 -7.198
103 H THR 15 H THR 15 -12.549 7.396 -5.411
104 HA THR 15 HA THR 15 -13.686 6.422 -2.885
105 HB THR 15 HB THR 15 -14.766 8.306 -4.961
106 HG1 THR 15 HG1 THR 15 -14.923 8.456 -2.145
107 1HG2 THR 15 1HG2 THR 15 -16.376 6.757 -2.961
108 2HG2 THR 15 2HG2 THR 15 -16.942 8.211 -3.786
109 3HG2 THR 15 3HG2 THR 15 -16.553 6.764 -4.716
110 H CYS 16 H CYS 16 -14.047 4.305 -3.090
111 HA CYS 16 HA CYS 16 -14.332 3.011 -5.605
112 1HB CYS 16 1HB CYS 16 -15.215 1.623 -3.121
113 2HB CYS 16 2HB CYS 16 -14.249 1.030 -4.463
114 HA PRO 17 HA PRO 17 -18.706 3.728 -6.066
115 1HB PRO 17 1HB PRO 17 -19.085 2.211 -8.274
116 2HB PRO 17 2HB PRO 17 -18.293 3.788 -8.327
117 1HG PRO 17 1HG PRO 17 -17.086 1.056 -8.347
118 2HG PRO 17 2HG PRO 17 -16.626 2.492 -9.278
119 1HD PRO 17 1HD PRO 17 -15.310 1.658 -7.035
120 2HD PRO 17 2HD PRO 17 -15.371 3.350 -7.561
121 HA PRO 18 HA PRO 18 -21.230 0.492 -4.439
122 1HB PRO 18 1HB PRO 18 -22.454 0.063 -7.129
123 2HB PRO 18 2HB PRO 18 -23.235 0.304 -5.562
124 1HG PRO 18 1HG PRO 18 -23.124 2.283 -7.336
125 2HG PRO 18 2HG PRO 18 -22.912 2.601 -5.605
126 1HD PRO 18 1HD PRO 18 -20.884 2.536 -7.783
127 2HD PRO 18 2HD PRO 18 -20.935 3.531 -6.316
128 H GLY 19 H GLY 19 -19.157 -0.789 -4.398
129 1HA GLY 19 1HA GLY 19 -18.406 -2.612 -6.368
130 2HA GLY 19 2HA GLY 19 -19.593 -3.411 -5.345
131 H GLU 20 H GLU 20 -17.077 -1.055 -4.486
132 HA GLU 20 HA GLU 20 -15.879 -3.113 -2.742
133 1HB GLU 20 1HB GLU 20 -14.339 -0.729 -3.654
134 2HB GLU 20 2HB GLU 20 -13.752 -2.310 -3.171
135 1HG GLU 20 1HG GLU 20 -13.519 -2.779 -5.320
136 2HG GLU 20 2HG GLU 20 -15.277 -2.804 -5.434
137 H ASN 21 H ASN 21 -15.624 -2.667 -0.669
138 HA ASN 21 HA ASN 21 -16.276 0.034 0.283
139 1HB ASN 21 1HB ASN 21 -17.617 -2.416 0.804
140 2HB ASN 21 2HB ASN 21 -16.920 -1.821 2.298
141 2HD2 ASN 21 2HD2 ASN 21 -19.425 -1.900 2.477
142 1HD2 ASN 21 1HD2 ASN 21 -20.193 -0.380 2.223
143 H LEU 22 H LEU 22 -14.125 -2.619 0.356
144 HA LEU 22 HA LEU 22 -12.805 -1.613 2.765
145 1HB LEU 22 1HB LEU 22 -12.283 -4.174 1.276
146 2HB LEU 22 2HB LEU 22 -11.705 -3.734 2.864
147 HG LEU 22 HG LEU 22 -14.643 -3.940 2.345
148 1HD1 LEU 22 1HD1 LEU 22 -13.005 -6.048 1.806
149 2HD1 LEU 22 2HD1 LEU 22 -13.380 -6.306 3.510
150 3HD1 LEU 22 3HD1 LEU 22 -14.684 -6.174 2.329
151 1HD2 LEU 22 1HD2 LEU 22 -12.828 -3.842 4.688
152 2HD2 LEU 22 2HD2 LEU 22 -14.407 -3.096 4.444
153 3HD2 LEU 22 3HD2 LEU 22 -14.293 -4.814 4.824
154 H CYS 23 H CYS 23 -10.375 -1.873 2.713
155 HA CYS 23 HA CYS 23 -9.274 -1.005 0.122
156 1HB CYS 23 1HB CYS 23 -8.204 -0.012 2.750
157 2HB CYS 23 2HB CYS 23 -7.993 0.681 1.146
158 H TYR 24 H TYR 24 -6.869 -1.390 -0.026
159 HA TYR 24 HA TYR 24 -5.952 -3.487 1.785
160 1HB TYR 24 1HB TYR 24 -5.411 -5.057 0.139
161 2HB TYR 24 2HB TYR 24 -7.019 -4.501 -0.294
162 HD1 TYR 24 HD1 TYR 24 -3.432 -3.617 -1.095
163 HD2 TYR 24 HD2 TYR 24 -7.422 -4.128 -2.512
164 HE1 TYR 24 HE1 TYR 24 -2.670 -3.196 -3.385
165 HE2 TYR 24 HE2 TYR 24 -6.660 -3.694 -4.807
166 HH TYR 24 HH TYR 24 -3.409 -3.706 -5.701
167 H ARG 25 H ARG 25 -3.791 -3.728 2.014
168 HA ARG 25 HA ARG 25 -2.032 -1.815 0.647
169 1HB ARG 25 1HB ARG 25 -2.836 -1.469 3.247
170 2HB ARG 25 2HB ARG 25 -1.352 -2.387 3.456
171 1HG ARG 25 1HG ARG 25 -0.525 -0.537 1.681
172 2HG ARG 25 2HG ARG 25 -1.758 0.378 2.548
173 1HD ARG 25 1HD ARG 25 0.747 -0.884 3.608
174 2HD ARG 25 2HD ARG 25 0.215 0.790 3.732
175 HE ARG 25 HE ARG 25 -1.257 0.179 5.457
176 1HH1 ARG 25 1HH1 ARG 25 0.601 -2.550 4.304
177 2HH1 ARG 25 2HH1 ARG 25 0.273 -3.515 5.702
178 1HH2 ARG 25 1HH2 ARG 25 -1.685 -1.097 7.287
179 2HH2 ARG 25 2HH2 ARG 25 -1.023 -2.694 7.392
180 H LYS 26 H LYS 26 -0.608 -3.026 -0.442
181 HA LYS 26 HA LYS 26 0.014 -5.710 0.491
182 1HB LYS 26 1HB LYS 26 -0.512 -5.256 -1.890
183 2HB LYS 26 2HB LYS 26 0.953 -4.298 -2.005
184 1HG LYS 26 1HG LYS 26 2.328 -6.194 -1.691
185 2HG LYS 26 2HG LYS 26 0.958 -7.189 -1.193
186 1HD LYS 26 1HD LYS 26 1.192 -5.952 -3.930
187 2HD LYS 26 2HD LYS 26 1.788 -7.567 -3.547
188 1HE LYS 26 1HE LYS 26 -1.023 -6.859 -2.857
189 2HE LYS 26 2HE LYS 26 -0.619 -7.213 -4.535
190 1HZ LYS 26 1HZ LYS 26 0.515 -9.284 -3.446
191 2HZ LYS 26 2HZ LYS 26 -0.594 -8.988 -2.204
192 3HZ LYS 26 3HZ LYS 26 -1.145 -9.282 -3.776
193 H MET 27 H MET 27 2.008 -6.456 1.067
194 HA MET 27 HA MET 27 4.234 -4.588 1.150
195 1HB MET 27 1HB MET 27 2.998 -5.852 3.576
196 2HB MET 27 2HB MET 27 4.653 -5.267 3.567
197 1HG MET 27 1HG MET 27 3.813 -3.026 2.937
198 2HG MET 27 2HG MET 27 2.168 -3.640 3.091
199 1HE MET 27 1HE MET 27 5.485 -3.817 4.663
200 2HE MET 27 2HE MET 27 5.344 -2.598 5.930
201 3HE MET 27 3HE MET 27 5.107 -4.303 6.316
202 H TRP 28 H TRP 28 6.170 -5.490 0.920
203 HA TRP 28 HA TRP 28 6.829 -8.168 1.615
204 1HB TRP 28 1HB TRP 28 7.142 -9.111 -0.647
205 2HB TRP 28 2HB TRP 28 5.451 -8.790 -0.298
206 HD1 TRP 28 HD1 TRP 28 5.841 -5.569 -1.009
207 HE1 TRP 28 HE1 TRP 28 5.836 -4.932 -3.504
208 HE3 TRP 28 HE3 TRP 28 6.942 -10.127 -3.012
209 HZ2 TRP 28 HZ2 TRP 28 6.255 -6.183 -5.981
210 HZ3 TRP 28 HZ3 TRP 28 7.124 -10.330 -5.458
211 HH2 TRP 28 HH2 TRP 28 6.785 -8.397 -6.913
212 H CYS 29 H CYS 29 8.960 -8.057 2.076
213 HA CYS 29 HA CYS 29 10.443 -5.821 1.573
214 1HB CYS 29 1HB CYS 29 11.521 -8.558 2.152
215 2HB CYS 29 2HB CYS 29 12.466 -7.097 2.158
216 H ASP 30 H ASP 30 11.012 -4.988 -0.266
217 HA ASP 30 HA ASP 30 11.647 -6.569 -2.584
218 1HB ASP 30 1HB ASP 30 12.515 -4.333 -3.473
219 2HB ASP 30 2HB ASP 30 10.802 -4.370 -3.077
220 H ALA 31 H ALA 31 13.741 -7.073 -3.258
221 HA ALA 31 HA ALA 31 15.597 -7.923 -1.568
222 1HB ALA 31 1HB ALA 31 16.184 -8.480 -3.682
223 2HB ALA 31 2HB ALA 31 17.324 -7.156 -3.446
224 3HB ALA 31 3HB ALA 31 15.821 -6.879 -4.325
225 H PHE 32 H PHE 32 15.058 -6.095 0.002
226 HA PHE 32 HA PHE 32 17.432 -4.758 0.614
227 1HB PHE 32 1HB PHE 32 15.377 -3.337 -0.894
228 2HB PHE 32 2HB PHE 32 15.888 -2.525 0.564
229 HD1 PHE 32 HD1 PHE 32 18.712 -3.096 0.740
230 HD2 PHE 32 HD2 PHE 32 16.330 -2.265 -2.686
231 HE1 PHE 32 HE1 PHE 32 20.708 -2.272 -0.444
232 HE2 PHE 32 HE2 PHE 32 18.319 -1.439 -3.876
233 HZ PHE 32 HZ PHE 32 20.512 -1.443 -2.754
234 H CYS 33 H CYS 33 15.132 -6.519 1.703
235 HA CYS 33 HA CYS 33 13.520 -5.337 3.529
236 1HB CYS 33 1HB CYS 33 13.931 -7.841 3.010
237 2HB CYS 33 2HB CYS 33 15.074 -7.762 4.346
238 H SER 34 H SER 34 16.977 -5.433 3.654
239 HA SER 34 HA SER 34 17.160 -4.692 6.434
240 1HB SER 34 1HB SER 34 19.279 -4.511 4.275
241 2HB SER 34 2HB SER 34 19.545 -4.463 6.018
242 HG SER 34 HG SER 34 19.772 -6.558 4.710
243 H SER 35 H SER 35 17.593 -3.079 3.295
244 HA SER 35 HA SER 35 17.616 -0.463 4.606
245 1HB SER 35 1HB SER 35 18.499 -1.506 1.971
246 2HB SER 35 2HB SER 35 17.861 0.138 1.982
247 HG SER 35 HG SER 35 19.421 0.716 3.461
248 H ARG 36 H ARG 36 16.218 -1.198 1.424
249 HA ARG 36 HA ARG 36 13.906 0.367 1.987
250 1HB ARG 36 1HB ARG 36 14.448 -1.535 -0.294
251 2HB ARG 36 2HB ARG 36 13.063 -0.491 -0.186
252 1HG ARG 36 1HG ARG 36 14.793 0.396 -1.672
253 2HG ARG 36 2HG ARG 36 14.437 1.471 -0.321
254 1HD ARG 36 1HD ARG 36 16.443 0.885 0.788
255 2HD ARG 36 2HD ARG 36 16.722 -0.482 -0.288
256 HE ARG 36 HE ARG 36 16.646 2.028 -1.664
257 1HH1 ARG 36 1HH1 ARG 36 18.677 -0.137 0.171
258 2HH1 ARG 36 2HH1 ARG 36 20.147 0.437 -0.542
259 1HH2 ARG 36 1HH2 ARG 36 18.577 2.783 -2.603
260 2HH2 ARG 36 2HH2 ARG 36 20.091 2.098 -2.115
261 H GLY 37 H GLY 37 13.836 -3.071 0.830
262 1HA GLY 37 1HA GLY 37 12.487 -3.803 3.273
263 2HA GLY 37 2HA GLY 37 12.885 -4.859 1.931
264 H LYS 38 H LYS 38 10.449 -4.414 3.595
265 HA LYS 38 HA LYS 38 8.580 -5.264 1.913
266 1HB LYS 38 1HB LYS 38 7.388 -3.420 3.792
267 2HB LYS 38 2HB LYS 38 7.153 -5.140 3.592
268 1HG LYS 38 1HG LYS 38 9.347 -5.440 4.812
269 2HG LYS 38 2HG LYS 38 9.241 -3.727 5.219
270 1HD LYS 38 1HD LYS 38 7.664 -4.085 6.773
271 2HD LYS 38 2HD LYS 38 6.781 -5.213 5.743
272 1HE LYS 38 1HE LYS 38 9.366 -6.108 6.901
273 2HE LYS 38 2HE LYS 38 7.973 -5.993 7.976
274 1HZ LYS 38 1HZ LYS 38 7.700 -7.393 5.406
275 2HZ LYS 38 2HZ LYS 38 8.448 -8.182 6.701
276 3HZ LYS 38 3HZ LYS 38 6.855 -7.632 6.852
277 H VAL 39 H VAL 39 8.038 -4.567 0.017
278 HA VAL 39 HA VAL 39 7.948 -1.811 -0.723
279 HB VAL 39 HB VAL 39 6.419 -3.915 -2.196
280 1HG1 VAL 39 1HG1 VAL 39 6.443 -1.527 -2.906
281 2HG1 VAL 39 2HG1 VAL 39 8.161 -1.717 -3.248
282 3HG1 VAL 39 3HG1 VAL 39 6.978 -2.677 -4.134
283 1HG2 VAL 39 1HG2 VAL 39 9.290 -3.978 -1.672
284 2HG2 VAL 39 2HG2 VAL 39 8.220 -5.245 -2.269
285 3HG2 VAL 39 3HG2 VAL 39 8.873 -4.048 -3.384
286 H VAL 40 H VAL 40 6.195 -0.464 -0.736
287 HA VAL 40 HA VAL 40 3.779 -1.497 0.571
288 HB VAL 40 HB VAL 40 4.672 1.377 0.371
289 1HG1 VAL 40 1HG1 VAL 40 2.326 0.000 1.506
290 2HG1 VAL 40 2HG1 VAL 40 3.061 1.241 2.522
291 3HG1 VAL 40 3HG1 VAL 40 2.495 1.649 0.902
292 1HG2 VAL 40 1HG2 VAL 40 5.062 -0.651 2.564
293 2HG2 VAL 40 2HG2 VAL 40 6.308 0.215 1.666
294 3HG2 VAL 40 3HG2 VAL 40 5.262 1.086 2.787
295 H GLU 41 H GLU 41 2.011 -1.692 -0.534
296 HA GLU 41 HA GLU 41 1.564 -0.032 -2.925
297 1HB GLU 41 1HB GLU 41 1.988 -2.719 -3.014
298 2HB GLU 41 2HB GLU 41 0.238 -2.667 -2.852
299 1HG GLU 41 1HG GLU 41 -0.067 -1.741 -4.901
300 2HG GLU 41 2HG GLU 41 1.474 -0.886 -4.868
301 H LEU 42 H LEU 42 -0.778 0.196 -3.461
302 HA LEU 42 HA LEU 42 -2.535 0.013 -1.111
303 1HB LEU 42 1HB LEU 42 -1.633 2.416 -2.568
304 2HB LEU 42 2HB LEU 42 -3.350 2.338 -2.264
305 HG LEU 42 HG LEU 42 -3.110 2.565 0.006
306 1HD1 LEU 42 1HD1 LEU 42 -0.304 1.529 -0.293
307 2HD1 LEU 42 2HD1 LEU 42 -0.944 2.201 1.206
308 3HD1 LEU 42 3HD1 LEU 42 -1.664 0.748 0.514
309 1HD2 LEU 42 1HD2 LEU 42 -2.056 4.463 -1.474
310 2HD2 LEU 42 2HD2 LEU 42 -1.992 4.533 0.287
311 3HD2 LEU 42 3HD2 LEU 42 -0.584 3.990 -0.626
312 H GLY 43 H GLY 43 -4.841 0.256 -1.648
313 1HA GLY 43 1HA GLY 43 -5.537 -1.264 -3.963
314 2HA GLY 43 2HA GLY 43 -5.918 0.431 -4.185
315 H CYS 44 H CYS 44 -8.105 -0.501 -4.418
316 HA CYS 44 HA CYS 44 -9.403 -0.738 -1.783
317 1HB CYS 44 1HB CYS 44 -10.046 1.296 -2.988
318 2HB CYS 44 2HB CYS 44 -10.531 0.332 -4.379
319 H ALA 45 H ALA 45 -11.281 -2.133 -1.646
320 HA ALA 45 HA ALA 45 -11.990 -3.910 -3.743
321 1HB ALA 45 1HB ALA 45 -9.908 -4.985 -3.391
322 2HB ALA 45 2HB ALA 45 -10.107 -4.949 -1.639
323 3HB ALA 45 3HB ALA 45 -11.129 -5.998 -2.621
324 H ALA 46 H ALA 46 -13.539 -5.565 -3.038
325 HA ALA 46 HA ALA 46 -15.122 -4.566 -0.798
326 1HB ALA 46 1HB ALA 46 -16.944 -5.269 -1.905
327 2HB ALA 46 2HB ALA 46 -15.860 -5.331 -3.294
328 3HB ALA 46 3HB ALA 46 -16.198 -6.796 -2.372
329 H THR 47 H THR 47 -12.821 -6.935 -1.327
330 HA THR 47 HA THR 47 -13.519 -8.250 1.163
331 HB THR 47 HB THR 47 -14.662 -9.736 -0.260
332 HG1 THR 47 HG1 THR 47 -12.101 -10.918 -0.152
333 1HG2 THR 47 1HG2 THR 47 -13.752 -8.900 -2.405
334 2HG2 THR 47 2HG2 THR 47 -12.294 -9.846 -2.106
335 3HG2 THR 47 3HG2 THR 47 -13.846 -10.658 -2.306
336 H CYS 48 H CYS 48 -11.760 -9.891 1.740
337 HA CYS 48 HA CYS 48 -9.179 -8.652 1.146
338 1HB CYS 48 1HB CYS 48 -10.023 -8.960 3.526
339 2HB CYS 48 2HB CYS 48 -9.722 -10.671 3.282
340 HA PRO 49 HA PRO 49 -8.501 -12.222 -1.538
341 1HB PRO 49 1HB PRO 49 -5.975 -11.486 -2.289
342 2HB PRO 49 2HB PRO 49 -7.447 -10.873 -3.046
343 1HG PRO 49 1HG PRO 49 -5.726 -9.610 -0.950
344 2HG PRO 49 2HG PRO 49 -6.490 -8.869 -2.369
345 1HD PRO 49 1HD PRO 49 -7.525 -8.604 0.097
346 2HD PRO 49 2HD PRO 49 -8.559 -8.733 -1.340
347 H SER 50 H SER 50 -7.066 -14.028 -1.561
348 HA SER 50 HA SER 50 -6.253 -14.886 0.991
349 1HB SER 50 1HB SER 50 -4.937 -16.604 -0.645
350 2HB SER 50 2HB SER 50 -6.655 -16.736 -0.267
351 HG SER 50 HG SER 50 -6.888 -16.579 -2.349
352 H LYS 51 H LYS 51 -3.872 -16.046 0.939
353 HA LYS 51 HA LYS 51 -2.042 -13.784 0.903
354 1HB LYS 51 1HB LYS 51 -2.412 -15.996 2.594
355 2HB LYS 51 2HB LYS 51 -0.828 -16.168 1.863
356 1HG LYS 51 1HG LYS 51 -0.356 -13.807 2.573
357 2HG LYS 51 2HG LYS 51 -1.855 -13.874 3.501
358 1HD LYS 51 1HD LYS 51 0.360 -15.886 3.826
359 2HD LYS 51 2HD LYS 51 0.271 -14.399 4.772
360 1HE LYS 51 1HE LYS 51 -0.847 -15.774 6.194
361 2HE LYS 51 2HE LYS 51 -2.205 -15.278 5.184
362 1HZ LYS 51 1HZ LYS 51 -1.307 -17.387 3.827
363 2HZ LYS 51 2HZ LYS 51 -0.904 -17.861 5.401
364 3HZ LYS 51 3HZ LYS 51 -2.507 -17.484 5.014
365 H LYS 52 H LYS 52 -0.422 -13.544 -0.509
366 HA LYS 52 HA LYS 52 -0.240 -15.266 -2.774
367 1HB LYS 52 1HB LYS 52 1.002 -12.739 -1.878
368 2HB LYS 52 2HB LYS 52 1.983 -13.715 -2.963
369 1HG LYS 52 1HG LYS 52 -0.174 -13.805 -4.407
370 2HG LYS 52 2HG LYS 52 -0.645 -12.393 -3.460
371 1HD LYS 52 1HD LYS 52 1.515 -11.327 -4.106
372 2HD LYS 52 2HD LYS 52 1.818 -12.700 -5.173
373 1HE LYS 52 1HE LYS 52 0.349 -11.983 -6.719
374 2HE LYS 52 2HE LYS 52 -0.809 -11.433 -5.509
375 1HZ LYS 52 1HZ LYS 52 1.360 -9.729 -5.332
376 2HZ LYS 52 2HZ LYS 52 1.070 -9.922 -6.988
377 3HZ LYS 52 3HZ LYS 52 -0.166 -9.379 -5.970
378 HA PRO 53 HA PRO 53 2.893 -18.227 -1.909
379 1HB PRO 53 1HB PRO 53 4.991 -17.398 -3.589
380 2HB PRO 53 2HB PRO 53 3.708 -18.538 -3.998
381 1HG PRO 53 1HG PRO 53 3.934 -15.636 -4.618
382 2HG PRO 53 2HG PRO 53 3.216 -16.941 -5.580
383 1HD PRO 53 1HD PRO 53 1.689 -15.181 -4.266
384 2HD PRO 53 2HD PRO 53 1.223 -16.890 -4.383
385 H TYR 54 H TYR 54 3.981 -14.880 -2.045
386 HA TYR 54 HA TYR 54 5.318 -15.171 0.473
387 1HB TYR 54 1HB TYR 54 7.409 -15.472 -0.215
388 2HB TYR 54 2HB TYR 54 6.812 -15.621 -1.855
389 HD1 TYR 54 HD1 TYR 54 6.920 -13.698 -3.392
390 HD2 TYR 54 HD2 TYR 54 8.563 -13.503 0.528
391 HE1 TYR 54 HE1 TYR 54 8.217 -11.713 -4.040
392 HE2 TYR 54 HE2 TYR 54 9.860 -11.513 -0.108
393 HH TYR 54 HH TYR 54 9.659 -9.665 -1.860
394 H GLU 55 H GLU 55 3.194 -13.582 -0.941
395 HA GLU 55 HA GLU 55 4.171 -10.912 -0.171
396 1HB GLU 55 1HB GLU 55 3.060 -11.790 -2.680
397 2HB GLU 55 2HB GLU 55 2.015 -10.575 -1.957
398 1HG GLU 55 1HG GLU 55 4.945 -10.074 -2.066
399 2HG GLU 55 2HG GLU 55 3.987 -9.901 -3.535
400 H GLU 56 H GLU 56 2.896 -9.768 1.219
401 HA GLU 56 HA GLU 56 0.332 -10.990 1.978
402 1HB GLU 56 1HB GLU 56 1.334 -9.357 4.089
403 2HB GLU 56 2HB GLU 56 1.055 -11.088 4.074
404 1HG GLU 56 1HG GLU 56 3.341 -11.303 2.997
405 2HG GLU 56 2HG GLU 56 3.584 -9.616 3.449
406 H VAL 57 H VAL 57 -1.435 -9.704 2.192
407 HA VAL 57 HA VAL 57 -1.079 -6.815 1.758
408 HB VAL 57 HB VAL 57 -3.564 -7.251 0.741
409 1HG1 VAL 57 1HG1 VAL 57 -1.850 -5.841 -0.237
410 2HG1 VAL 57 2HG1 VAL 57 -0.964 -7.266 -0.778
411 3HG1 VAL 57 3HG1 VAL 57 -2.550 -6.902 -1.459
412 1HG2 VAL 57 1HG2 VAL 57 -1.879 -9.593 -0.130
413 2HG2 VAL 57 2HG2 VAL 57 -3.362 -9.669 0.821
414 3HG2 VAL 57 3HG2 VAL 57 -3.414 -9.110 -0.851
415 H THR 58 H THR 58 -2.176 -5.511 3.129
416 HA THR 58 HA THR 58 -3.837 -6.820 5.155
417 HB THR 58 HB THR 58 -3.575 -4.395 6.174
418 HG1 THR 58 HG1 THR 58 -1.222 -4.609 4.617
419 1HG2 THR 58 1HG2 THR 58 -2.160 -6.814 6.506
420 2HG2 THR 58 2HG2 THR 58 -0.992 -5.493 6.564
421 3HG2 THR 58 3HG2 THR 58 -2.375 -5.496 7.659
422 H CYS 59 H CYS 59 -5.956 -6.721 4.941
423 HA CYS 59 HA CYS 59 -7.145 -4.544 3.389
424 1HB CYS 59 1HB CYS 59 -8.717 -6.942 4.188
425 2HB CYS 59 2HB CYS 59 -8.789 -5.990 2.720
426 H CYS 60 H CYS 60 -8.630 -3.180 4.285
427 HA CYS 60 HA CYS 60 -9.516 -3.744 7.033
428 1HB CYS 60 1HB CYS 60 -9.300 -1.172 7.348
429 2HB CYS 60 2HB CYS 60 -7.859 -2.174 7.477
430 H SER 61 H SER 61 -11.395 -2.367 7.690
431 HA SER 61 HA SER 61 -13.137 -1.858 5.367
432 1HB SER 61 1HB SER 61 -15.005 -2.681 6.586
433 2HB SER 61 2HB SER 61 -13.712 -3.853 6.839
434 HG SER 61 HG SER 61 -13.891 -3.475 8.885
435 H THR 62 H THR 62 -11.915 0.313 5.749
436 HA THR 62 HA THR 62 -13.828 2.110 6.888
437 HB THR 62 HB THR 62 -11.188 2.637 8.086
438 HG1 THR 62 HG1 THR 62 -12.793 0.574 9.170
439 1HG2 THR 62 1HG2 THR 62 -14.031 2.952 8.810
440 2HG2 THR 62 2HG2 THR 62 -12.879 2.737 10.128
441 3HG2 THR 62 3HG2 THR 62 -12.679 4.069 8.989
442 H ASP 63 H ASP 63 -13.055 4.435 6.654
443 HA ASP 63 HA ASP 63 -11.994 4.753 4.014
444 1HB ASP 63 1HB ASP 63 -13.738 6.225 5.274
445 2HB ASP 63 2HB ASP 63 -12.321 7.033 5.933
446 H LYS 64 H LYS 64 -10.112 5.880 3.418
447 HA LYS 64 HA LYS 64 -7.790 5.917 3.495
448 1HB LYS 64 1HB LYS 64 -7.121 7.600 5.426
449 2HB LYS 64 2HB LYS 64 -8.003 8.149 4.007
450 1HG LYS 64 1HG LYS 64 -10.100 7.998 5.257
451 2HG LYS 64 2HG LYS 64 -9.208 7.453 6.679
452 1HD LYS 64 1HD LYS 64 -7.872 9.741 6.017
453 2HD LYS 64 2HD LYS 64 -9.530 10.146 5.570
454 1HE LYS 64 1HE LYS 64 -9.659 10.739 7.748
455 2HE LYS 64 2HE LYS 64 -9.983 9.019 7.956
456 1HZ LYS 64 1HZ LYS 64 -7.481 8.802 8.236
457 2HZ LYS 64 2HZ LYS 64 -7.461 10.482 8.437
458 3HZ LYS 64 3HZ LYS 64 -8.338 9.511 9.510
459 H CYS 65 H CYS 65 -8.710 3.615 4.770
460 HA CYS 65 HA CYS 65 -7.297 3.352 7.281
461 1HB CYS 65 1HB CYS 65 -8.413 1.256 7.492
462 2HB CYS 65 2HB CYS 65 -9.587 2.417 6.896
463 H ASN 66 H ASN 66 -6.492 2.940 4.023
464 HA ASN 66 HA ASN 66 -4.466 0.941 4.718
465 1HB ASN 66 1HB ASN 66 -4.475 0.324 2.361
466 2HB ASN 66 2HB ASN 66 -6.076 0.163 3.062
467 2HD2 ASN 66 2HD2 ASN 66 -4.430 1.185 0.452
468 1HD2 ASN 66 1HD2 ASN 66 -5.549 2.338 -0.184
469 HA PRO 67 HA PRO 67 -2.211 4.780 3.248
470 1HB PRO 67 1HB PRO 67 -1.655 6.114 5.467
471 2HB PRO 67 2HB PRO 67 -3.275 6.210 4.764
472 1HG PRO 67 1HG PRO 67 -2.314 4.602 7.096
473 2HG PRO 67 2HG PRO 67 -3.828 5.504 6.905
474 1HD PRO 67 1HD PRO 67 -3.518 2.761 6.505
475 2HD PRO 67 2HD PRO 67 -4.856 3.750 5.898
476 H HIS 68 H HIS 68 0.074 5.358 3.657
477 HA HIS 68 HA HIS 68 1.719 3.122 3.973
478 1HB HIS 68 1HB HIS 68 2.172 5.557 2.985
479 2HB HIS 68 2HB HIS 68 2.853 5.812 4.587
480 HD1 HIS 68 HD1 HIS 68 5.125 4.816 5.057
481 HD2 HIS 68 HD2 HIS 68 3.526 3.552 1.437
482 HE1 HIS 68 HE1 HIS 68 6.989 3.603 3.886
483 HE2 HIS 68 HE2 HIS 68 5.969 2.763 1.742
484 HA PRO 69 HA PRO 69 1.852 2.404 8.350
485 1HB PRO 69 1HB PRO 69 4.710 1.749 7.816
486 2HB PRO 69 2HB PRO 69 3.477 0.803 8.657
487 1HG PRO 69 1HG PRO 69 4.225 0.158 6.187
488 2HG PRO 69 2HG PRO 69 2.527 0.040 6.683
489 1HD PRO 69 1HD PRO 69 3.868 2.096 4.986
490 2HD PRO 69 2HD PRO 69 2.233 1.417 4.859
491 H LYS 70 H LYS 70 4.152 4.435 6.691
492 HA LYS 70 HA LYS 70 4.585 5.929 9.193
493 1HB LYS 70 1HB LYS 70 6.574 5.339 6.999
494 2HB LYS 70 2HB LYS 70 6.841 6.537 8.256
495 1HG LYS 70 1HG LYS 70 6.252 3.662 8.883
496 2HG LYS 70 2HG LYS 70 7.889 4.255 8.595
497 1HD LYS 70 1HD LYS 70 7.124 6.069 10.383
498 2HD LYS 70 2HD LYS 70 6.054 4.754 10.874
499 1HE LYS 70 1HE LYS 70 7.842 4.188 12.142
500 2HE LYS 70 2HE LYS 70 8.336 3.384 10.653
501 1HZ LYS 70 1HZ LYS 70 9.556 5.483 10.100
502 2HZ LYS 70 2HZ LYS 70 9.252 6.008 11.680
503 3HZ LYS 70 3HZ LYS 70 10.179 4.619 11.414
504 H GLN 71 H GLN 71 2.538 6.405 7.257
505 HA GLN 71 HA GLN 71 2.999 8.232 5.285
506 1HB GLN 71 1HB GLN 71 0.742 7.699 7.099
507 2HB GLN 71 2HB GLN 71 0.704 9.234 6.251
508 1HG GLN 71 1HG GLN 71 1.363 7.433 4.278
509 2HG GLN 71 2HG GLN 71 0.213 6.547 5.277
510 2HE2 GLN 71 2HE2 GLN 71 0.483 8.515 2.684
511 1HE2 GLN 71 1HE2 GLN 71 -1.102 9.202 2.666
512 H ARG 72 H ARG 72 2.249 10.630 5.398
513 HA ARG 72 HA ARG 72 4.180 12.114 6.706
514 1HB ARG 72 1HB ARG 72 2.271 12.670 4.860
515 2HB ARG 72 2HB ARG 72 1.608 13.497 6.263
516 1HG ARG 72 1HG ARG 72 3.536 14.865 6.473
517 2HG ARG 72 2HG ARG 72 4.424 13.902 5.291
518 1HD ARG 72 1HD ARG 72 2.584 14.567 3.644
519 2HD ARG 72 2HD ARG 72 2.128 15.783 4.836
520 HE ARG 72 HE ARG 72 3.968 17.007 4.244
521 1HH1 ARG 72 1HH1 ARG 72 4.316 13.768 2.993
522 2HH1 ARG 72 2HH1 ARG 72 5.728 14.143 2.064
523 1HH2 ARG 72 1HH2 ARG 72 5.825 17.504 3.020
524 2HH2 ARG 72 2HH2 ARG 72 6.586 16.264 2.080
525 HA PRO 73 HA PRO 73 2.763 12.250 10.906
526 1HB PRO 73 1HB PRO 73 4.211 14.355 11.791
527 2HB PRO 73 2HB PRO 73 4.937 12.780 11.447
528 1HG PRO 73 1HG PRO 73 4.877 15.249 9.752
529 2HG PRO 73 2HG PRO 73 6.226 14.141 10.067
530 1HD PRO 73 1HD PRO 73 4.747 14.041 7.797
531 2HD PRO 73 2HD PRO 73 5.487 12.601 8.524
532 H GLY 74 H GLY 74 1.300 13.344 12.190
533 1HA GLY 74 1HA GLY 74 -0.790 14.550 11.957
534 2HA GLY 74 2HA GLY 74 0.051 15.702 10.931
535 H1 TRP 75 H1 TRP 75 4.662 2.326 -10.912
536 H2 TRP 75 H2 TRP 75 6.176 2.066 -11.673
537 H3 TRP 75 H3 TRP 75 5.514 0.861 -10.646
538 HA TRP 75 HA TRP 75 7.224 1.978 -9.510
539 1HB TRP 75 1HB TRP 75 6.875 4.469 -9.075
540 2HB TRP 75 2HB TRP 75 7.370 4.023 -10.703
541 HD1 TRP 75 HD1 TRP 75 3.951 4.581 -8.923
542 HE1 TRP 75 HE1 TRP 75 2.442 5.905 -10.533
543 HE3 TRP 75 HE3 TRP 75 7.157 4.999 -12.882
544 HZ2 TRP 75 HZ2 TRP 75 2.591 6.986 -13.136
545 HZ3 TRP 75 HZ3 TRP 75 6.397 6.194 -14.894
546 HH2 TRP 75 HH2 TRP 75 4.161 7.166 -15.018
547 H ARG 76 H ARG 76 7.097 2.222 -7.275
548 HA ARG 76 HA ARG 76 4.516 2.709 -6.033
549 1HB ARG 76 1HB ARG 76 4.464 0.638 -4.787
550 2HB ARG 76 2HB ARG 76 4.505 0.278 -6.507
551 1HG ARG 76 1HG ARG 76 7.043 0.336 -4.937
552 2HG ARG 76 2HG ARG 76 5.979 -1.069 -4.864
553 1HD ARG 76 1HD ARG 76 6.365 -1.654 -7.033
554 2HD ARG 76 2HD ARG 76 6.655 0.009 -7.544
555 HE ARG 76 HE ARG 76 8.764 -0.583 -5.919
556 1HH1 ARG 76 1HH1 ARG 76 7.398 -2.028 -8.785
557 2HH1 ARG 76 2HH1 ARG 76 8.913 -2.652 -9.344
558 1HH2 ARG 76 1HH2 ARG 76 10.758 -1.403 -6.652
559 2HH2 ARG 76 2HH2 ARG 76 10.821 -2.299 -8.132
560 H TYR 77 H TYR 77 5.095 1.955 -3.442
561 HA TYR 77 HA TYR 77 7.549 3.517 -2.904
562 1HB TYR 77 1HB TYR 77 5.271 3.441 -0.960
563 2HB TYR 77 2HB TYR 77 6.529 4.653 -1.150
564 HD1 TYR 77 HD1 TYR 77 3.635 3.221 -3.031
565 HD2 TYR 77 HD2 TYR 77 5.986 6.655 -2.162
566 HE1 TYR 77 HE1 TYR 77 2.101 4.603 -4.366
567 HE2 TYR 77 HE2 TYR 77 4.458 8.047 -3.493
568 HH TYR 77 HH TYR 77 1.424 6.904 -4.597
569 H TYR 78 H TYR 78 8.772 2.916 -1.046
570 HA TYR 78 HA TYR 78 8.386 0.120 -0.291
571 1HB TYR 78 1HB TYR 78 10.785 1.942 -0.016
572 2HB TYR 78 2HB TYR 78 10.745 0.275 0.526
573 HD1 TYR 78 HD1 TYR 78 8.921 -0.388 -2.073
574 HD2 TYR 78 HD2 TYR 78 12.763 1.296 -1.389
575 HE1 TYR 78 HE1 TYR 78 9.653 -1.166 -4.288
576 HE2 TYR 78 HE2 TYR 78 13.504 0.522 -3.601
577 HH TYR 78 HH TYR 78 12.578 -0.131 -5.729
578 H GLU 79 H GLU 79 8.965 -0.396 2.032
579 HA GLU 79 HA GLU 79 7.219 1.036 3.727
580 1HB GLU 79 1HB GLU 79 7.945 -1.416 3.901
581 2HB GLU 79 2HB GLU 79 9.383 -0.814 4.711
582 1HG GLU 79 1HG GLU 79 6.564 -0.298 5.625
583 2HG GLU 79 2HG GLU 79 7.608 -1.573 6.250
584 H SER 80 H SER 80 10.716 1.093 3.340
585 HA SER 80 HA SER 80 11.027 2.952 5.541
586 1HB SER 80 1HB SER 80 12.702 1.095 4.226
587 2HB SER 80 2HB SER 80 13.435 2.688 4.088
588 HG SER 80 HG SER 80 12.993 2.832 6.435
589 H SER 81 H SER 81 9.560 3.716 3.026
590 HA SER 81 HA SER 81 10.585 6.342 2.818
591 1HB SER 81 1HB SER 81 11.881 4.526 1.170
592 2HB SER 81 2HB SER 81 10.736 5.356 0.125
593 HG SER 81 HG SER 81 12.604 6.624 1.838
594 H LEU 82 H LEU 82 8.956 7.622 2.439
595 HA LEU 82 HA LEU 82 6.435 6.561 1.518
596 1HB LEU 82 1HB LEU 82 7.393 8.974 2.892
597 2HB LEU 82 2HB LEU 82 5.983 9.184 1.866
598 HG LEU 82 HG LEU 82 4.934 7.255 3.086
599 1HD1 LEU 82 1HD1 LEU 82 7.008 6.308 3.996
600 2HD1 LEU 82 2HD1 LEU 82 7.185 7.729 5.026
601 3HD1 LEU 82 3HD1 LEU 82 5.812 6.644 5.247
602 1HD2 LEU 82 1HD2 LEU 82 5.497 9.944 4.102
603 2HD2 LEU 82 2HD2 LEU 82 3.959 9.139 3.794
604 3HD2 LEU 82 3HD2 LEU 82 4.849 8.801 5.277
605 H GLU 83 H GLU 83 9.130 8.033 0.095
606 HA GLU 83 HA GLU 83 7.790 9.536 -1.927
607 1HB GLU 83 1HB GLU 83 10.612 8.638 -1.466
608 2HB GLU 83 2HB GLU 83 10.152 9.310 -3.023
609 1HG GLU 83 1HG GLU 83 10.406 11.348 -2.218
610 2HG GLU 83 2HG GLU 83 9.142 11.038 -1.030
611 HA PRO 84 HA PRO 84 7.055 6.403 -4.946
612 1HB PRO 84 1HB PRO 84 7.950 8.021 -7.174
613 2HB PRO 84 2HB PRO 84 6.297 7.690 -6.653
614 1HG PRO 84 1HG PRO 84 7.477 10.153 -6.485
615 2HG PRO 84 2HG PRO 84 6.166 9.612 -5.422
616 1HD PRO 84 1HD PRO 84 9.115 9.705 -4.899
617 2HD PRO 84 2HD PRO 84 7.768 10.118 -3.820
618 H TYR 85 H TYR 85 8.065 4.731 -5.930
619 HA TYR 85 HA TYR 85 10.944 5.029 -6.469
620 1HB TYR 85 1HB TYR 85 9.463 2.990 -4.878
621 2HB TYR 85 2HB TYR 85 10.896 2.484 -5.762
622 HD1 TYR 85 HD1 TYR 85 9.947 5.461 -3.668
623 HD2 TYR 85 HD2 TYR 85 12.779 2.369 -4.434
624 HE1 TYR 85 HE1 TYR 85 11.359 6.301 -1.842
625 HE2 TYR 85 HE2 TYR 85 14.191 3.204 -2.606
626 HH TYR 85 HH TYR 85 14.043 4.534 -0.622
627 HA PRO 86 HA PRO 86 9.171 3.508 -10.397
628 1HB PRO 86 1HB PRO 86 11.643 4.598 -11.528
629 2HB PRO 86 2HB PRO 86 9.969 5.019 -11.892
630 1HG PRO 86 1HG PRO 86 11.625 6.694 -10.573
631 2HG PRO 86 2HG PRO 86 9.880 6.637 -10.260
632 1HD PRO 86 1HD PRO 86 12.129 5.424 -8.695
633 2HD PRO 86 2HD PRO 86 10.671 6.255 -8.112
634 H ASP 87 H ASP 87 10.217 2.161 -12.159
635 HA ASP 87 HA ASP 87 12.021 0.231 -10.889
636 1HB ASP 87 1HB ASP 87 11.309 -1.239 -12.839
637 2HB ASP 87 2HB ASP 87 10.050 -0.831 -11.677
No H/Q in entry = 637
Start of MODEL 7
1 H1 ILE 1 H1 ILE 1 -16.832 5.296 0.070
2 H2 ILE 1 H2 ILE 1 -16.258 3.711 0.393
3 H3 ILE 1 H3 ILE 1 -17.471 4.401 1.388
4 HA ILE 1 HA ILE 1 -16.004 5.991 2.228
5 HB ILE 1 HB ILE 1 -15.892 3.379 2.844
6 1HG1 ILE 1 1HG1 ILE 1 -13.842 5.113 4.138
7 2HG1 ILE 1 2HG1 ILE 1 -15.524 5.629 4.184
8 1HG2 ILE 1 1HG2 ILE 1 -13.918 3.202 1.202
9 2HG2 ILE 1 2HG2 ILE 1 -12.986 3.973 2.485
10 3HG2 ILE 1 3HG2 ILE 1 -13.781 2.427 2.780
11 1HD1 ILE 1 1HD1 ILE 1 -14.633 2.913 5.094
12 2HD1 ILE 1 2HD1 ILE 1 -14.706 4.314 6.163
13 3HD1 ILE 1 3HD1 ILE 1 -16.175 3.714 5.392
14 H VAL 2 H VAL 2 -13.428 6.150 2.564
15 HA VAL 2 HA VAL 2 -12.299 6.496 -0.130
16 HB VAL 2 HB VAL 2 -11.777 8.221 2.298
17 1HG1 VAL 2 1HG1 VAL 2 -10.384 7.900 -0.236
18 2HG1 VAL 2 2HG1 VAL 2 -10.882 9.565 0.063
19 3HG1 VAL 2 3HG1 VAL 2 -9.875 8.721 1.239
20 1HG2 VAL 2 1HG2 VAL 2 -14.007 8.580 1.379
21 2HG2 VAL 2 2HG2 VAL 2 -12.965 9.969 1.064
22 3HG2 VAL 2 3HG2 VAL 2 -13.315 8.819 -0.226
23 H CYS 3 H CYS 3 -10.448 5.475 -0.526
24 HA CYS 3 HA CYS 3 -8.859 4.516 1.767
25 1HB CYS 3 1HB CYS 3 -9.335 3.076 -0.854
26 2HB CYS 3 2HB CYS 3 -8.331 2.490 0.464
27 H HIS 4 H HIS 4 -6.599 4.001 1.194
28 HA HIS 4 HA HIS 4 -5.502 6.162 -0.420
29 1HB HIS 4 1HB HIS 4 -4.056 4.178 1.341
30 2HB HIS 4 2HB HIS 4 -3.385 5.650 0.649
31 HD1 HIS 4 HD1 HIS 4 -4.987 7.867 1.440
32 HD2 HIS 4 HD2 HIS 4 -4.712 4.560 3.930
33 HE1 HIS 4 HE1 HIS 4 -5.665 8.677 3.715
34 HE2 HIS 4 HE2 HIS 4 -5.252 6.714 5.238
35 H THR 5 H THR 5 -4.373 5.902 -2.265
36 HA THR 5 HA THR 5 -3.880 3.150 -3.169
37 HB THR 5 HB THR 5 -5.850 4.619 -4.239
38 HG1 THR 5 HG1 THR 5 -4.093 2.855 -5.577
39 1HG2 THR 5 1HG2 THR 5 -3.451 5.278 -5.932
40 2HG2 THR 5 2HG2 THR 5 -5.135 5.494 -6.416
41 3HG2 THR 5 3HG2 THR 5 -4.480 6.424 -5.068
42 H THR 6 H THR 6 -2.182 2.867 -4.624
43 HA THR 6 HA THR 6 -0.221 5.065 -4.682
44 HB THR 6 HB THR 6 1.432 3.029 -4.714
45 HG1 THR 6 HG1 THR 6 -0.328 1.502 -4.694
46 1HG2 THR 6 1HG2 THR 6 0.157 4.360 -2.402
47 2HG2 THR 6 2HG2 THR 6 1.166 2.948 -2.088
48 3HG2 THR 6 3HG2 THR 6 1.843 4.349 -2.917
49 H ALA 7 H ALA 7 -2.244 4.016 -6.686
50 HA ALA 7 HA ALA 7 -0.549 2.916 -8.780
51 1HB ALA 7 1HB ALA 7 -2.822 2.028 -8.425
52 2HB ALA 7 2HB ALA 7 -2.584 2.656 -10.056
53 3HB ALA 7 3HB ALA 7 -3.483 3.601 -8.870
54 H THR 8 H THR 8 0.160 5.516 -7.967
55 HA THR 8 HA THR 8 -0.014 6.899 -10.504
56 HB THR 8 HB THR 8 -1.234 8.720 -9.872
57 HG1 THR 8 HG1 THR 8 -0.689 8.473 -7.125
58 1HG2 THR 8 1HG2 THR 8 -2.710 6.797 -9.281
59 2HG2 THR 8 2HG2 THR 8 -2.191 6.994 -7.604
60 3HG2 THR 8 3HG2 THR 8 -3.063 8.294 -8.418
61 H SER 9 H SER 9 1.143 9.308 -9.831
62 HA SER 9 HA SER 9 3.811 8.502 -9.225
63 1HB SER 9 1HB SER 9 2.622 10.770 -10.379
64 2HB SER 9 2HB SER 9 3.467 11.350 -8.946
65 HG SER 9 HG SER 9 5.350 10.725 -9.780
66 HA PRO 10 HA PRO 10 3.025 10.343 -4.958
67 1HB PRO 10 1HB PRO 10 0.942 12.141 -4.679
68 2HB PRO 10 2HB PRO 10 2.603 12.574 -5.066
69 1HG PRO 10 1HG PRO 10 0.322 12.867 -6.735
70 2HG PRO 10 2HG PRO 10 2.014 13.140 -7.182
71 1HD PRO 10 1HD PRO 10 0.295 10.749 -7.630
72 2HD PRO 10 2HD PRO 10 1.616 11.390 -8.623
73 H ILE 11 H ILE 11 1.840 9.605 -3.128
74 HA ILE 11 HA ILE 11 -0.324 7.813 -3.804
75 HB ILE 11 HB ILE 11 -0.199 7.062 -1.506
76 1HG1 ILE 11 1HG1 ILE 11 1.906 9.198 -1.156
77 2HG1 ILE 11 2HG1 ILE 11 0.302 9.203 -0.424
78 1HG2 ILE 11 1HG2 ILE 11 1.447 6.367 -3.353
79 2HG2 ILE 11 2HG2 ILE 11 2.630 7.300 -2.436
80 3HG2 ILE 11 3HG2 ILE 11 1.817 5.927 -1.685
81 1HD1 ILE 11 1HD1 ILE 11 1.604 6.746 0.179
82 2HD1 ILE 11 2HD1 ILE 11 2.666 8.093 0.593
83 3HD1 ILE 11 3HD1 ILE 11 1.041 8.010 1.275
84 H SER 12 H SER 12 -2.428 8.148 -3.483
85 HA SER 12 HA SER 12 -3.274 10.280 -1.658
86 1HB SER 12 1HB SER 12 -4.930 11.044 -3.438
87 2HB SER 12 2HB SER 12 -3.241 11.471 -3.711
88 HG SER 12 HG SER 12 -3.139 9.558 -5.061
89 H ALA 13 H ALA 13 -5.784 10.321 -1.594
90 HA ALA 13 HA ALA 13 -6.869 7.602 -1.793
91 1HB ALA 13 1HB ALA 13 -6.334 9.086 0.649
92 2HB ALA 13 2HB ALA 13 -8.017 8.576 0.522
93 3HB ALA 13 3HB ALA 13 -6.725 7.381 0.426
94 H VAL 14 H VAL 14 -9.075 7.477 -2.190
95 HA VAL 14 HA VAL 14 -10.645 9.926 -2.220
96 HB VAL 14 HB VAL 14 -9.421 9.547 -4.498
97 1HG1 VAL 14 1HG1 VAL 14 -10.208 7.165 -4.635
98 2HG1 VAL 14 2HG1 VAL 14 -11.830 7.798 -4.920
99 3HG1 VAL 14 3HG1 VAL 14 -10.532 8.145 -6.067
100 1HG2 VAL 14 1HG2 VAL 14 -11.591 10.969 -3.723
101 2HG2 VAL 14 2HG2 VAL 14 -10.875 11.038 -5.334
102 3HG2 VAL 14 3HG2 VAL 14 -12.264 9.993 -5.029
103 H THR 15 H THR 15 -12.868 9.383 -3.246
104 HA THR 15 HA THR 15 -13.978 7.222 -1.703
105 HB THR 15 HB THR 15 -15.788 8.530 -3.577
106 HG1 THR 15 HG1 THR 15 -14.466 10.185 -1.697
107 1HG2 THR 15 1HG2 THR 15 -15.644 8.309 -0.591
108 2HG2 THR 15 2HG2 THR 15 -16.901 9.216 -1.431
109 3HG2 THR 15 3HG2 THR 15 -16.739 7.480 -1.698
110 H CYS 16 H CYS 16 -13.660 5.233 -2.517
111 HA CYS 16 HA CYS 16 -13.489 4.686 -5.303
112 1HB CYS 16 1HB CYS 16 -14.106 2.485 -3.389
113 2HB CYS 16 2HB CYS 16 -12.972 2.523 -4.727
114 HA PRO 17 HA PRO 17 -17.811 4.387 -6.258
115 1HB PRO 17 1HB PRO 17 -17.613 2.793 -8.467
116 2HB PRO 17 2HB PRO 17 -17.262 4.523 -8.481
117 1HG PRO 17 1HG PRO 17 -15.375 2.207 -8.301
118 2HG PRO 17 2HG PRO 17 -15.234 3.695 -9.257
119 1HD PRO 17 1HD PRO 17 -13.905 3.360 -6.941
120 2HD PRO 17 2HD PRO 17 -14.534 4.944 -7.440
121 HA PRO 18 HA PRO 18 -19.782 0.701 -4.818
122 1HB PRO 18 1HB PRO 18 -20.666 -0.470 -7.261
123 2HB PRO 18 2HB PRO 18 -21.608 0.505 -6.132
124 1HG PRO 18 1HG PRO 18 -20.253 1.304 -8.645
125 2HG PRO 18 2HG PRO 18 -21.698 1.984 -7.877
126 1HD PRO 18 1HD PRO 18 -19.361 3.284 -7.835
127 2HD PRO 18 2HD PRO 18 -20.455 3.317 -6.436
128 H GLY 19 H GLY 19 -17.589 0.409 -7.534
129 1HA GLY 19 1HA GLY 19 -15.970 -1.138 -8.023
130 2HA GLY 19 2HA GLY 19 -17.179 -2.339 -7.596
131 H GLU 20 H GLU 20 -15.308 0.075 -5.726
132 HA GLU 20 HA GLU 20 -14.406 -2.148 -4.005
133 1HB GLU 20 1HB GLU 20 -12.943 0.448 -4.112
134 2HB GLU 20 2HB GLU 20 -12.338 -1.158 -3.742
135 1HG GLU 20 1HG GLU 20 -11.522 -1.220 -5.796
136 2HG GLU 20 2HG GLU 20 -13.182 -1.339 -6.376
137 H ASN 21 H ASN 21 -14.720 -2.031 -1.897
138 HA ASN 21 HA ASN 21 -15.866 0.431 -0.781
139 1HB ASN 21 1HB ASN 21 -17.036 -2.159 -0.955
140 2HB ASN 21 2HB ASN 21 -16.804 -1.742 0.732
141 2HD2 ASN 21 2HD2 ASN 21 -19.254 -2.021 0.216
142 1HD2 ASN 21 1HD2 ASN 21 -20.084 -0.535 -0.039
143 H LEU 22 H LEU 22 -13.560 -2.086 -0.516
144 HA LEU 22 HA LEU 22 -12.878 -1.256 2.214
145 1HB LEU 22 1HB LEU 22 -12.179 -3.775 0.714
146 2HB LEU 22 2HB LEU 22 -11.679 -3.397 2.344
147 HG LEU 22 HG LEU 22 -14.583 -3.553 1.611
148 1HD1 LEU 22 1HD1 LEU 22 -13.559 -5.663 0.941
149 2HD1 LEU 22 2HD1 LEU 22 -12.829 -5.822 2.538
150 3HD1 LEU 22 3HD1 LEU 22 -14.583 -5.872 2.361
151 1HD2 LEU 22 1HD2 LEU 22 -13.021 -3.746 4.176
152 2HD2 LEU 22 2HD2 LEU 22 -14.198 -2.517 3.712
153 3HD2 LEU 22 3HD2 LEU 22 -14.729 -4.165 4.043
154 H CYS 23 H CYS 23 -10.492 -1.431 2.695
155 HA CYS 23 HA CYS 23 -8.932 -0.330 0.446
156 1HB CYS 23 1HB CYS 23 -8.212 0.152 3.319
157 2HB CYS 23 2HB CYS 23 -7.832 1.124 1.903
158 H TYR 24 H TYR 24 -6.632 -0.886 0.402
159 HA TYR 24 HA TYR 24 -5.876 -3.155 2.069
160 1HB TYR 24 1HB TYR 24 -5.383 -4.644 0.336
161 2HB TYR 24 2HB TYR 24 -6.940 -3.963 -0.114
162 HD1 TYR 24 HD1 TYR 24 -3.275 -3.417 -0.728
163 HD2 TYR 24 HD2 TYR 24 -7.238 -3.191 -2.272
164 HE1 TYR 24 HE1 TYR 24 -2.375 -2.809 -2.927
165 HE2 TYR 24 HE2 TYR 24 -6.344 -2.574 -4.477
166 HH TYR 24 HH TYR 24 -3.605 -1.370 -5.084
167 H ARG 25 H ARG 25 -3.713 -3.503 2.322
168 HA ARG 25 HA ARG 25 -1.828 -1.686 1.014
169 1HB ARG 25 1HB ARG 25 -2.485 -0.666 3.186
170 2HB ARG 25 2HB ARG 25 -1.941 -2.122 4.008
171 1HG ARG 25 1HG ARG 25 0.283 -1.512 2.627
172 2HG ARG 25 2HG ARG 25 -0.391 0.102 2.861
173 1HD ARG 25 1HD ARG 25 0.310 -1.925 4.976
174 2HD ARG 25 2HD ARG 25 1.067 -0.358 4.697
175 HE ARG 25 HE ARG 25 -1.742 -0.199 5.287
176 1HH1 ARG 25 1HH1 ARG 25 1.466 -0.343 6.655
177 2HH1 ARG 25 2HH1 ARG 25 1.001 0.409 8.143
178 1HH2 ARG 25 1HH2 ARG 25 -2.356 0.791 7.242
179 2HH2 ARG 25 2HH2 ARG 25 -1.171 1.053 8.478
180 H LYS 26 H LYS 26 -0.574 -3.128 -0.029
181 HA LYS 26 HA LYS 26 0.047 -5.683 1.238
182 1HB LYS 26 1HB LYS 26 -0.682 -5.488 -1.170
183 2HB LYS 26 2HB LYS 26 0.874 -4.749 -1.505
184 1HG LYS 26 1HG LYS 26 1.373 -7.142 -0.091
185 2HG LYS 26 2HG LYS 26 0.190 -7.507 -1.346
186 1HD LYS 26 1HD LYS 26 2.057 -5.877 -2.607
187 2HD LYS 26 2HD LYS 26 3.023 -6.934 -1.577
188 1HE LYS 26 1HE LYS 26 2.711 -8.652 -2.952
189 2HE LYS 26 2HE LYS 26 0.962 -8.444 -2.892
190 1HZ LYS 26 1HZ LYS 26 1.663 -6.442 -4.510
191 2HZ LYS 26 2HZ LYS 26 2.860 -7.572 -4.900
192 3HZ LYS 26 3HZ LYS 26 1.227 -7.982 -5.058
193 H MET 27 H MET 27 2.144 -6.468 1.553
194 HA MET 27 HA MET 27 4.353 -4.597 1.271
195 1HB MET 27 1HB MET 27 3.313 -5.617 3.878
196 2HB MET 27 2HB MET 27 5.025 -5.275 3.695
197 1HG MET 27 1HG MET 27 4.718 -3.040 3.631
198 2HG MET 27 2HG MET 27 3.162 -3.164 2.813
199 1HE MET 27 1HE MET 27 4.758 -1.803 5.497
200 2HE MET 27 2HE MET 27 3.787 -1.968 6.961
201 3HE MET 27 3HE MET 27 4.909 -3.248 6.498
202 H TRP 28 H TRP 28 6.303 -5.505 0.990
203 HA TRP 28 HA TRP 28 6.997 -8.164 1.721
204 1HB TRP 28 1HB TRP 28 7.143 -9.210 -0.489
205 2HB TRP 28 2HB TRP 28 5.479 -8.797 -0.107
206 HD1 TRP 28 HD1 TRP 28 5.798 -5.683 -0.957
207 HE1 TRP 28 HE1 TRP 28 5.816 -5.116 -3.471
208 HE3 TRP 28 HE3 TRP 28 7.118 -10.253 -2.805
209 HZ2 TRP 28 HZ2 TRP 28 6.336 -6.423 -5.903
210 HZ3 TRP 28 HZ3 TRP 28 7.359 -10.515 -5.241
211 HH2 TRP 28 HH2 TRP 28 6.974 -8.640 -6.758
212 H CYS 29 H CYS 29 9.144 -8.056 2.037
213 HA CYS 29 HA CYS 29 10.606 -5.843 1.396
214 1HB CYS 29 1HB CYS 29 11.685 -8.575 1.999
215 2HB CYS 29 2HB CYS 29 12.657 -7.137 1.886
216 H ASP 30 H ASP 30 11.185 -5.044 -0.441
217 HA ASP 30 HA ASP 30 11.672 -6.690 -2.767
218 1HB ASP 30 1HB ASP 30 12.493 -4.441 -3.732
219 2HB ASP 30 2HB ASP 30 10.782 -4.555 -3.346
220 H ALA 31 H ALA 31 13.772 -7.056 -3.607
221 HA ALA 31 HA ALA 31 15.722 -7.903 -2.022
222 1HB ALA 31 1HB ALA 31 16.161 -8.349 -4.216
223 2HB ALA 31 2HB ALA 31 17.359 -7.090 -3.915
224 3HB ALA 31 3HB ALA 31 15.848 -6.692 -4.732
225 H PHE 32 H PHE 32 15.180 -6.099 -0.367
226 HA PHE 32 HA PHE 32 17.567 -4.767 0.201
227 1HB PHE 32 1HB PHE 32 15.620 -3.320 -1.349
228 2HB PHE 32 2HB PHE 32 15.869 -2.561 0.205
229 HD1 PHE 32 HD1 PHE 32 18.743 -3.184 0.639
230 HD2 PHE 32 HD2 PHE 32 16.662 -1.848 -2.821
231 HE1 PHE 32 HE1 PHE 32 20.813 -2.153 -0.202
232 HE2 PHE 32 HE2 PHE 32 18.727 -0.814 -3.671
233 HZ PHE 32 HZ PHE 32 20.807 -0.966 -2.360
234 H CYS 33 H CYS 33 15.288 -6.526 1.341
235 HA CYS 33 HA CYS 33 13.716 -5.401 3.212
236 1HB CYS 33 1HB CYS 33 14.225 -7.889 2.717
237 2HB CYS 33 2HB CYS 33 15.390 -7.741 4.027
238 H SER 34 H SER 34 17.185 -5.384 3.287
239 HA SER 34 HA SER 34 17.395 -4.609 6.047
240 1HB SER 34 1HB SER 34 19.436 -4.346 3.822
241 2HB SER 34 2HB SER 34 19.756 -4.226 5.552
242 HG SER 34 HG SER 34 20.227 -6.310 4.620
243 H SER 35 H SER 35 17.847 -2.920 2.928
244 HA SER 35 HA SER 35 17.657 -0.339 4.290
245 1HB SER 35 1HB SER 35 19.457 -0.569 2.656
246 2HB SER 35 2HB SER 35 18.296 -1.010 1.407
247 HG SER 35 HG SER 35 17.415 1.062 1.556
248 H ARG 36 H ARG 36 16.408 -1.228 1.069
249 HA ARG 36 HA ARG 36 14.045 0.309 1.463
250 1HB ARG 36 1HB ARG 36 14.335 -1.806 -0.659
251 2HB ARG 36 2HB ARG 36 13.411 -0.329 -0.713
252 1HG ARG 36 1HG ARG 36 16.411 -0.414 -0.645
253 2HG ARG 36 2HG ARG 36 15.450 -0.300 -2.120
254 1HD ARG 36 1HD ARG 36 14.383 1.758 -1.090
255 2HD ARG 36 2HD ARG 36 15.656 1.689 0.127
256 HE ARG 36 HE ARG 36 16.755 1.626 -2.486
257 1HH1 ARG 36 1HH1 ARG 36 15.295 3.785 -0.165
258 2HH1 ARG 36 2HH1 ARG 36 16.105 5.189 -0.774
259 1HH2 ARG 36 1HH2 ARG 36 17.822 3.473 -3.289
260 2HH2 ARG 36 2HH2 ARG 36 17.538 5.013 -2.548
261 H GLY 37 H GLY 37 14.029 -3.187 0.509
262 1HA GLY 37 1HA GLY 37 12.750 -3.844 2.988
263 2HA GLY 37 2HA GLY 37 13.062 -4.924 1.644
264 H LYS 38 H LYS 38 10.728 -4.421 3.431
265 HA LYS 38 HA LYS 38 8.766 -5.281 1.870
266 1HB LYS 38 1HB LYS 38 7.676 -3.405 3.768
267 2HB LYS 38 2HB LYS 38 7.449 -5.131 3.624
268 1HG LYS 38 1HG LYS 38 9.654 -5.427 4.760
269 2HG LYS 38 2HG LYS 38 9.666 -3.688 5.052
270 1HD LYS 38 1HD LYS 38 8.237 -3.871 6.760
271 2HD LYS 38 2HD LYS 38 7.160 -4.928 5.846
272 1HE LYS 38 1HE LYS 38 7.881 -6.698 6.976
273 2HE LYS 38 2HE LYS 38 9.546 -6.358 6.508
274 1HZ LYS 38 1HZ LYS 38 9.360 -4.600 8.401
275 2HZ LYS 38 2HZ LYS 38 8.113 -5.600 8.954
276 3HZ LYS 38 3HZ LYS 38 9.675 -6.220 8.773
277 H VAL 39 H VAL 39 8.227 -4.601 -0.028
278 HA VAL 39 HA VAL 39 8.093 -1.877 -0.822
279 HB VAL 39 HB VAL 39 6.506 -4.059 -2.132
280 1HG1 VAL 39 1HG1 VAL 39 6.350 -1.694 -2.901
281 2HG1 VAL 39 2HG1 VAL 39 8.050 -1.799 -3.362
282 3HG1 VAL 39 3HG1 VAL 39 6.859 -2.847 -4.135
283 1HG2 VAL 39 1HG2 VAL 39 9.390 -4.002 -1.787
284 2HG2 VAL 39 2HG2 VAL 39 8.344 -5.300 -2.364
285 3HG2 VAL 39 3HG2 VAL 39 8.902 -4.056 -3.482
286 H VAL 40 H VAL 40 6.368 -0.500 -0.784
287 HA VAL 40 HA VAL 40 4.042 -1.414 0.739
288 HB VAL 40 HB VAL 40 4.796 1.436 0.109
289 1HG1 VAL 40 1HG1 VAL 40 2.628 0.129 1.575
290 2HG1 VAL 40 2HG1 VAL 40 3.437 1.415 2.472
291 3HG1 VAL 40 3HG1 VAL 40 2.722 1.754 0.894
292 1HG2 VAL 40 1HG2 VAL 40 5.965 -0.439 1.997
293 2HG2 VAL 40 2HG2 VAL 40 6.519 1.157 1.498
294 3HG2 VAL 40 3HG2 VAL 40 5.327 1.004 2.785
295 H GLU 41 H GLU 41 2.215 -1.797 -0.230
296 HA GLU 41 HA GLU 41 1.648 -0.525 -2.825
297 1HB GLU 41 1HB GLU 41 1.920 -3.191 -2.422
298 2HB GLU 41 2HB GLU 41 0.200 -3.004 -2.111
299 1HG GLU 41 1HG GLU 41 -0.092 -3.176 -4.299
300 2HG GLU 41 2HG GLU 41 0.598 -1.558 -4.426
301 H LEU 42 H LEU 42 -0.477 0.188 -3.189
302 HA LEU 42 HA LEU 42 -2.336 0.142 -0.939
303 1HB LEU 42 1HB LEU 42 -0.701 2.379 -1.641
304 2HB LEU 42 2HB LEU 42 -2.371 2.781 -1.985
305 HG LEU 42 HG LEU 42 -2.994 2.313 0.310
306 1HD1 LEU 42 1HD1 LEU 42 -0.189 1.324 0.465
307 2HD1 LEU 42 2HD1 LEU 42 -0.959 1.989 1.906
308 3HD1 LEU 42 3HD1 LEU 42 -1.672 0.600 1.085
309 1HD2 LEU 42 1HD2 LEU 42 -2.059 4.550 -0.375
310 2HD2 LEU 42 2HD2 LEU 42 -1.969 4.180 1.347
311 3HD2 LEU 42 3HD2 LEU 42 -0.530 4.036 0.339
312 H GLY 43 H GLY 43 -4.473 0.279 -1.516
313 1HA GLY 43 1HA GLY 43 -5.157 -0.369 -4.186
314 2HA GLY 43 2HA GLY 43 -5.480 1.330 -3.896
315 H CYS 44 H CYS 44 -7.678 0.708 -4.382
316 HA CYS 44 HA CYS 44 -9.097 -0.045 -1.940
317 1HB CYS 44 1HB CYS 44 -9.546 2.002 -3.634
318 2HB CYS 44 2HB CYS 44 -10.591 0.790 -4.367
319 H ALA 45 H ALA 45 -10.291 -1.888 -1.762
320 HA ALA 45 HA ALA 45 -10.753 -3.486 -4.180
321 1HB ALA 45 1HB ALA 45 -8.955 -4.703 -3.525
322 2HB ALA 45 2HB ALA 45 -9.119 -4.243 -1.831
323 3HB ALA 45 3HB ALA 45 -10.172 -5.482 -2.514
324 H ALA 46 H ALA 46 -12.440 -5.041 -4.002
325 HA ALA 46 HA ALA 46 -14.550 -4.185 -2.215
326 1HB ALA 46 1HB ALA 46 -16.023 -5.320 -3.594
327 2HB ALA 46 2HB ALA 46 -14.756 -4.832 -4.720
328 3HB ALA 46 3HB ALA 46 -14.804 -6.486 -4.110
329 H THR 47 H THR 47 -12.346 -6.861 -2.578
330 HA THR 47 HA THR 47 -13.446 -8.054 -0.124
331 HB THR 47 HB THR 47 -12.276 -10.177 -1.387
332 HG1 THR 47 HG1 THR 47 -12.707 -10.109 -3.503
333 1HG2 THR 47 1HG2 THR 47 -15.050 -9.261 -1.056
334 2HG2 THR 47 2HG2 THR 47 -14.779 -10.505 -2.277
335 3HG2 THR 47 3HG2 THR 47 -14.290 -10.788 -0.606
336 H CYS 48 H CYS 48 -11.604 -9.916 0.454
337 HA CYS 48 HA CYS 48 -9.040 -8.482 0.521
338 1HB CYS 48 1HB CYS 48 -10.117 -8.224 2.677
339 2HB CYS 48 2HB CYS 48 -10.352 -9.959 2.778
340 HA PRO 49 HA PRO 49 -8.340 -12.797 -0.972
341 1HB PRO 49 1HB PRO 49 -7.063 -12.211 -3.250
342 2HB PRO 49 2HB PRO 49 -8.826 -12.155 -3.137
343 1HG PRO 49 1HG PRO 49 -6.849 -9.915 -3.068
344 2HG PRO 49 2HG PRO 49 -8.424 -9.994 -3.876
345 1HD PRO 49 1HD PRO 49 -7.967 -8.764 -1.448
346 2HD PRO 49 2HD PRO 49 -9.546 -9.360 -1.991
347 H SER 50 H SER 50 -6.288 -13.908 -1.438
348 HA SER 50 HA SER 50 -3.781 -12.633 -1.098
349 1HB SER 50 1HB SER 50 -3.537 -14.182 1.158
350 2HB SER 50 2HB SER 50 -3.808 -12.440 1.154
351 HG SER 50 HG SER 50 -5.361 -13.392 2.442
352 H LYS 51 H LYS 51 -2.030 -14.060 -1.392
353 HA LYS 51 HA LYS 51 -2.308 -16.873 -1.414
354 1HB LYS 51 1HB LYS 51 -1.767 -16.692 -4.098
355 2HB LYS 51 2HB LYS 51 -3.306 -17.154 -3.393
356 1HG LYS 51 1HG LYS 51 -4.275 -15.139 -3.827
357 2HG LYS 51 2HG LYS 51 -2.742 -14.268 -3.791
358 1HD LYS 51 1HD LYS 51 -3.609 -14.360 -6.062
359 2HD LYS 51 2HD LYS 51 -2.120 -15.299 -5.934
360 1HE LYS 51 1HE LYS 51 -3.421 -16.775 -7.099
361 2HE LYS 51 2HE LYS 51 -3.800 -17.267 -5.449
362 1HZ LYS 51 1HZ LYS 51 -5.445 -15.247 -6.836
363 2HZ LYS 51 2HZ LYS 51 -5.717 -16.899 -7.083
364 3HZ LYS 51 3HZ LYS 51 -5.861 -16.241 -5.532
365 H LYS 52 H LYS 52 -0.464 -15.249 -0.249
366 HA LYS 52 HA LYS 52 1.978 -16.229 -1.434
367 1HB LYS 52 1HB LYS 52 1.357 -13.288 -1.292
368 2HB LYS 52 2HB LYS 52 3.012 -13.882 -1.294
369 1HG LYS 52 1HG LYS 52 0.956 -14.309 -3.450
370 2HG LYS 52 2HG LYS 52 2.359 -13.240 -3.523
371 1HD LYS 52 1HD LYS 52 3.799 -15.270 -3.180
372 2HD LYS 52 2HD LYS 52 2.346 -16.251 -3.382
373 1HE LYS 52 1HE LYS 52 2.381 -14.449 -5.537
374 2HE LYS 52 2HE LYS 52 4.030 -15.054 -5.378
375 1HZ LYS 52 1HZ LYS 52 2.687 -17.319 -5.147
376 2HZ LYS 52 2HZ LYS 52 1.597 -16.469 -6.121
377 3HZ LYS 52 3HZ LYS 52 3.190 -16.705 -6.641
378 HA PRO 53 HA PRO 53 2.226 -16.651 3.085
379 1HB PRO 53 1HB PRO 53 4.798 -17.895 2.257
380 2HB PRO 53 2HB PRO 53 3.552 -18.506 3.351
381 1HG PRO 53 1HG PRO 53 3.812 -19.506 0.898
382 2HG PRO 53 2HG PRO 53 2.209 -19.257 1.615
383 1HD PRO 53 1HD PRO 53 3.639 -17.635 -0.449
384 2HD PRO 53 2HD PRO 53 1.913 -18.034 -0.323
385 H TYR 54 H TYR 54 4.523 -15.260 0.853
386 HA TYR 54 HA TYR 54 5.977 -13.979 3.045
387 1HB TYR 54 1HB TYR 54 6.976 -13.212 0.484
388 2HB TYR 54 2HB TYR 54 7.782 -14.113 1.754
389 HD1 TYR 54 HD1 TYR 54 6.308 -14.270 -1.516
390 HD2 TYR 54 HD2 TYR 54 7.480 -16.627 1.827
391 HE1 TYR 54 HE1 TYR 54 6.296 -16.278 -2.935
392 HE2 TYR 54 HE2 TYR 54 7.472 -18.641 0.417
393 HH TYR 54 HH TYR 54 7.744 -18.823 -2.535
394 H GLU 55 H GLU 55 4.089 -13.199 0.174
395 HA GLU 55 HA GLU 55 4.165 -10.360 0.850
396 1HB GLU 55 1HB GLU 55 3.033 -11.856 -1.517
397 2HB GLU 55 2HB GLU 55 2.845 -10.123 -1.289
398 1HG GLU 55 1HG GLU 55 4.809 -9.766 -2.226
399 2HG GLU 55 2HG GLU 55 5.595 -10.759 -1.000
400 H GLU 56 H GLU 56 2.772 -9.739 2.368
401 HA GLU 56 HA GLU 56 0.058 -10.881 2.320
402 1HB GLU 56 1HB GLU 56 1.915 -10.224 4.530
403 2HB GLU 56 2HB GLU 56 0.226 -9.823 4.797
404 1HG GLU 56 1HG GLU 56 0.683 -12.507 3.719
405 2HG GLU 56 2HG GLU 56 1.358 -12.228 5.324
406 H VAL 57 H VAL 57 -1.684 -9.466 2.924
407 HA VAL 57 HA VAL 57 -1.134 -6.603 2.604
408 HB VAL 57 HB VAL 57 -3.564 -7.735 1.361
409 1HG1 VAL 57 1HG1 VAL 57 -2.938 -5.234 1.753
410 2HG1 VAL 57 2HG1 VAL 57 -1.985 -5.464 0.289
411 3HG1 VAL 57 3HG1 VAL 57 -3.725 -5.739 0.259
412 1HG2 VAL 57 1HG2 VAL 57 -0.809 -7.982 0.308
413 2HG2 VAL 57 2HG2 VAL 57 -2.202 -9.041 0.088
414 3HG2 VAL 57 3HG2 VAL 57 -2.086 -7.538 -0.826
415 H THR 58 H THR 58 -2.548 -5.222 3.665
416 HA THR 58 HA THR 58 -4.274 -6.543 5.634
417 HB THR 58 HB THR 58 -4.193 -4.146 6.644
418 HG1 THR 58 HG1 THR 58 -2.815 -2.833 5.785
419 1HG2 THR 58 1HG2 THR 58 -1.866 -6.037 6.742
420 2HG2 THR 58 2HG2 THR 58 -2.029 -4.629 7.792
421 3HG2 THR 58 3HG2 THR 58 -3.221 -5.927 7.865
422 H CYS 59 H CYS 59 -6.297 -6.622 4.995
423 HA CYS 59 HA CYS 59 -7.417 -4.365 3.498
424 1HB CYS 59 1HB CYS 59 -9.081 -6.738 3.501
425 2HB CYS 59 2HB CYS 59 -8.429 -5.829 2.151
426 H CYS 60 H CYS 60 -8.731 -3.071 4.627
427 HA CYS 60 HA CYS 60 -10.379 -4.283 6.738
428 1HB CYS 60 1HB CYS 60 -9.530 -2.975 8.341
429 2HB CYS 60 2HB CYS 60 -8.259 -2.557 7.211
430 H SER 61 H SER 61 -12.044 -2.461 7.481
431 HA SER 61 HA SER 61 -13.244 -1.383 5.014
432 1HB SER 61 1HB SER 61 -15.400 -2.038 5.714
433 2HB SER 61 2HB SER 61 -14.377 -3.426 6.085
434 HG SER 61 HG SER 61 -15.731 -1.725 7.775
435 H THR 62 H THR 62 -11.659 0.353 6.147
436 HA THR 62 HA THR 62 -13.493 2.246 7.415
437 HB THR 62 HB THR 62 -10.680 2.028 8.441
438 HG1 THR 62 HG1 THR 62 -12.923 0.613 9.442
439 1HG2 THR 62 1HG2 THR 62 -13.201 3.301 9.358
440 2HG2 THR 62 2HG2 THR 62 -12.037 2.745 10.561
441 3HG2 THR 62 3HG2 THR 62 -11.553 3.928 9.346
442 H ASP 63 H ASP 63 -12.798 4.483 7.206
443 HA ASP 63 HA ASP 63 -11.643 4.993 4.653
444 1HB ASP 63 1HB ASP 63 -13.375 6.385 6.062
445 2HB ASP 63 2HB ASP 63 -11.928 7.157 6.694
446 H LYS 64 H LYS 64 -9.733 6.060 4.156
447 HA LYS 64 HA LYS 64 -7.415 6.052 4.269
448 1HB LYS 64 1HB LYS 64 -8.122 7.700 6.705
449 2HB LYS 64 2HB LYS 64 -6.622 7.794 5.795
450 1HG LYS 64 1HG LYS 64 -7.535 9.038 4.154
451 2HG LYS 64 2HG LYS 64 -9.090 8.210 4.244
452 1HD LYS 64 1HD LYS 64 -9.934 9.700 5.703
453 2HD LYS 64 2HD LYS 64 -8.426 9.807 6.613
454 1HE LYS 64 1HE LYS 64 -7.494 11.276 4.897
455 2HE LYS 64 2HE LYS 64 -8.993 11.160 3.976
456 1HZ LYS 64 1HZ LYS 64 -9.210 12.037 6.748
457 2HZ LYS 64 2HZ LYS 64 -8.509 13.126 5.660
458 3HZ LYS 64 3HZ LYS 64 -10.072 12.542 5.383
459 H CYS 65 H CYS 65 -8.408 3.712 5.445
460 HA CYS 65 HA CYS 65 -7.008 3.341 7.956
461 1HB CYS 65 1HB CYS 65 -8.566 1.799 8.376
462 2HB CYS 65 2HB CYS 65 -9.354 2.341 6.909
463 H ASN 66 H ASN 66 -6.209 2.989 4.694
464 HA ASN 66 HA ASN 66 -4.180 0.979 5.353
465 1HB ASN 66 1HB ASN 66 -4.246 0.300 3.048
466 2HB ASN 66 2HB ASN 66 -5.869 0.251 3.711
467 2HD2 ASN 66 2HD2 ASN 66 -4.301 0.897 1.043
468 1HD2 ASN 66 1HD2 ASN 66 -5.259 2.170 0.376
469 HA PRO 67 HA PRO 67 -2.010 4.880 3.902
470 1HB PRO 67 1HB PRO 67 -1.248 6.028 6.174
471 2HB PRO 67 2HB PRO 67 -2.904 6.222 5.582
472 1HG PRO 67 1HG PRO 67 -1.858 4.414 7.724
473 2HG PRO 67 2HG PRO 67 -3.346 5.377 7.700
474 1HD PRO 67 1HD PRO 67 -3.194 2.672 7.105
475 2HD PRO 67 2HD PRO 67 -4.502 3.756 6.601
476 H HIS 68 H HIS 68 0.278 5.383 4.055
477 HA HIS 68 HA HIS 68 1.947 3.145 4.129
478 1HB HIS 68 1HB HIS 68 2.278 5.592 3.145
479 2HB HIS 68 2HB HIS 68 3.105 5.845 4.675
480 HD1 HIS 68 HD1 HIS 68 5.462 5.046 4.826
481 HD2 HIS 68 HD2 HIS 68 3.482 3.487 1.529
482 HE1 HIS 68 HE1 HIS 68 7.222 3.844 3.495
483 HE2 HIS 68 HE2 HIS 68 6.026 3.050 1.426
484 HA PRO 69 HA PRO 69 2.693 2.598 8.467
485 1HB PRO 69 1HB PRO 69 5.039 1.240 8.371
486 2HB PRO 69 2HB PRO 69 3.488 0.508 7.941
487 1HG PRO 69 1HG PRO 69 5.616 1.626 6.156
488 2HG PRO 69 2HG PRO 69 4.675 0.133 5.977
489 1HD PRO 69 1HD PRO 69 4.088 2.400 4.619
490 2HD PRO 69 2HD PRO 69 2.844 1.241 5.124
491 H LYS 70 H LYS 70 4.569 4.591 6.493
492 HA LYS 70 HA LYS 70 6.155 5.508 8.799
493 1HB LYS 70 1HB LYS 70 6.890 4.971 6.028
494 2HB LYS 70 2HB LYS 70 7.372 6.578 6.552
495 1HG LYS 70 1HG LYS 70 9.138 4.921 6.892
496 2HG LYS 70 2HG LYS 70 8.602 5.638 8.412
497 1HD LYS 70 1HD LYS 70 7.976 3.655 9.220
498 2HD LYS 70 2HD LYS 70 7.069 3.271 7.756
499 1HE LYS 70 1HE LYS 70 9.077 2.482 6.671
500 2HE LYS 70 2HE LYS 70 10.057 2.983 8.048
501 1HZ LYS 70 1HZ LYS 70 8.766 1.382 9.409
502 2HZ LYS 70 2HZ LYS 70 8.020 0.826 7.995
503 3HZ LYS 70 3HZ LYS 70 9.690 0.650 8.196
504 H GLN 71 H GLN 71 3.401 6.294 7.890
505 HA GLN 71 HA GLN 71 3.893 9.172 7.923
506 1HB GLN 71 1HB GLN 71 2.363 9.644 6.134
507 2HB GLN 71 2HB GLN 71 3.561 8.501 5.545
508 1HG GLN 71 1HG GLN 71 1.819 7.356 4.768
509 2HG GLN 71 2HG GLN 71 1.590 6.842 6.438
510 2HE2 GLN 71 2HE2 GLN 71 0.103 8.162 3.816
511 1HE2 GLN 71 1HE2 GLN 71 -1.239 8.919 4.597
512 H ARG 72 H ARG 72 2.724 10.088 9.469
513 HA ARG 72 HA ARG 72 0.728 8.611 10.884
514 1HB ARG 72 1HB ARG 72 1.917 11.346 11.123
515 2HB ARG 72 2HB ARG 72 0.438 10.975 11.997
516 1HG ARG 72 1HG ARG 72 3.019 9.442 12.232
517 2HG ARG 72 2HG ARG 72 2.450 10.668 13.366
518 1HD ARG 72 1HD ARG 72 1.109 8.044 12.722
519 2HD ARG 72 2HD ARG 72 1.948 8.458 14.216
520 HE ARG 72 HE ARG 72 -0.102 10.322 13.787
521 1HH1 ARG 72 1HH1 ARG 72 0.310 6.948 14.574
522 2HH1 ARG 72 2HH1 ARG 72 -1.175 6.844 15.457
523 1HH2 ARG 72 1HH2 ARG 72 -2.057 10.187 14.949
524 2HH2 ARG 72 2HH2 ARG 72 -2.519 8.682 15.670
525 HA PRO 73 HA PRO 73 -2.517 10.000 8.069
526 1HB PRO 73 1HB PRO 73 -4.478 8.440 9.090
527 2HB PRO 73 2HB PRO 73 -3.232 7.813 8.004
528 1HG PRO 73 1HG PRO 73 -3.395 7.656 10.990
529 2HG PRO 73 2HG PRO 73 -2.941 6.397 9.827
530 1HD PRO 73 1HD PRO 73 -1.111 7.813 11.238
531 2HD PRO 73 2HD PRO 73 -0.795 7.201 9.602
532 H GLY 74 H GLY 74 -4.049 11.563 8.244
533 1HA GLY 74 1HA GLY 74 -4.867 13.466 9.352
534 2HA GLY 74 2HA GLY 74 -4.447 12.725 10.889
535 H1 TRP 75 H1 TRP 75 3.561 -0.171 -10.949
536 H2 TRP 75 H2 TRP 75 3.541 1.484 -11.394
537 H3 TRP 75 H3 TRP 75 4.637 0.405 -12.156
538 HA TRP 75 HA TRP 75 5.878 0.135 -10.233
539 1HB TRP 75 1HB TRP 75 6.628 2.431 -9.872
540 2HB TRP 75 2HB TRP 75 6.254 2.174 -11.573
541 HD1 TRP 75 HD1 TRP 75 4.894 3.974 -8.458
542 HE1 TRP 75 HE1 TRP 75 3.296 5.838 -9.235
543 HE3 TRP 75 HE3 TRP 75 4.769 2.904 -13.455
544 HZ2 TRP 75 HZ2 TRP 75 2.133 6.732 -11.647
545 HZ3 TRP 75 HZ3 TRP 75 3.388 4.311 -14.929
546 HH2 TRP 75 HH2 TRP 75 2.099 6.185 -14.042
547 H ARG 76 H ARG 76 6.314 1.064 -7.974
548 HA ARG 76 HA ARG 76 3.913 1.707 -6.467
549 1HB ARG 76 1HB ARG 76 3.962 -0.148 -5.004
550 2HB ARG 76 2HB ARG 76 4.051 -0.818 -6.625
551 1HG ARG 76 1HG ARG 76 6.306 -0.505 -4.661
552 2HG ARG 76 2HG ARG 76 5.562 -2.005 -5.215
553 1HD ARG 76 1HD ARG 76 6.303 -1.342 -7.546
554 2HD ARG 76 2HD ARG 76 7.282 -0.096 -6.774
555 HE ARG 76 HE ARG 76 8.135 -2.214 -5.465
556 1HH1 ARG 76 1HH1 ARG 76 7.515 -1.863 -8.885
557 2HH1 ARG 76 2HH1 ARG 76 8.703 -3.036 -9.344
558 1HH2 ARG 76 1HH2 ARG 76 9.697 -3.750 -6.072
559 2HH2 ARG 76 2HH2 ARG 76 9.940 -4.106 -7.750
560 H TYR 77 H TYR 77 4.913 1.270 -3.913
561 HA TYR 77 HA TYR 77 7.318 2.985 -3.912
562 1HB TYR 77 1HB TYR 77 5.140 3.068 -1.826
563 2HB TYR 77 2HB TYR 77 6.489 4.176 -2.009
564 HD1 TYR 77 HD1 TYR 77 5.879 6.261 -2.730
565 HD2 TYR 77 HD2 TYR 77 3.743 2.907 -4.236
566 HE1 TYR 77 HE1 TYR 77 4.490 7.764 -4.091
567 HE2 TYR 77 HE2 TYR 77 2.357 4.401 -5.604
568 HH TYR 77 HH TYR 77 1.628 6.815 -5.524
569 H TYR 78 H TYR 78 8.705 2.738 -2.047
570 HA TYR 78 HA TYR 78 8.654 0.009 -1.006
571 1HB TYR 78 1HB TYR 78 10.858 2.072 -1.150
572 2HB TYR 78 2HB TYR 78 11.025 0.535 -0.327
573 HD1 TYR 78 HD1 TYR 78 8.962 -0.088 -3.060
574 HD2 TYR 78 HD2 TYR 78 13.031 0.722 -2.116
575 HE1 TYR 78 HE1 TYR 78 9.662 -1.164 -5.155
576 HE2 TYR 78 HE2 TYR 78 13.738 -0.357 -4.205
577 HH TYR 78 HH TYR 78 12.139 -2.383 -5.864
578 H GLU 79 H GLU 79 9.566 -0.156 1.317
579 HA GLU 79 HA GLU 79 7.807 1.370 2.990
580 1HB GLU 79 1HB GLU 79 9.398 -1.032 3.234
581 2HB GLU 79 2HB GLU 79 9.629 0.000 4.638
582 1HG GLU 79 1HG GLU 79 6.964 0.118 4.449
583 2HG GLU 79 2HG GLU 79 7.237 -1.471 3.739
584 H SER 80 H SER 80 11.322 1.177 2.594
585 HA SER 80 HA SER 80 12.206 2.804 4.594
586 1HB SER 80 1HB SER 80 14.172 3.187 3.291
587 2HB SER 80 2HB SER 80 13.598 1.571 2.891
588 HG SER 80 HG SER 80 13.640 3.887 1.343
589 H SER 81 H SER 81 10.502 3.762 1.709
590 HA SER 81 HA SER 81 10.402 6.493 2.731
591 1HB SER 81 1HB SER 81 11.939 5.736 0.484
592 2HB SER 81 2HB SER 81 10.577 6.692 -0.085
593 HG SER 81 HG SER 81 12.727 7.671 0.840
594 H LEU 82 H LEU 82 8.988 7.725 0.799
595 HA LEU 82 HA LEU 82 6.590 6.071 0.414
596 1HB LEU 82 1HB LEU 82 6.864 8.743 1.703
597 2HB LEU 82 2HB LEU 82 5.392 8.365 0.827
598 HG LEU 82 HG LEU 82 5.593 6.160 2.360
599 1HD1 LEU 82 1HD1 LEU 82 6.848 8.392 3.935
600 2HD1 LEU 82 2HD1 LEU 82 6.157 6.938 4.656
601 3HD1 LEU 82 3HD1 LEU 82 7.538 6.811 3.566
602 1HD2 LEU 82 1HD2 LEU 82 4.281 8.799 2.882
603 2HD2 LEU 82 2HD2 LEU 82 3.566 7.299 2.289
604 3HD2 LEU 82 3HD2 LEU 82 4.067 7.432 3.976
605 H GLU 83 H GLU 83 8.896 7.236 -1.267
606 HA GLU 83 HA GLU 83 7.463 8.914 -3.151
607 1HB GLU 83 1HB GLU 83 10.284 8.140 -2.696
608 2HB GLU 83 2HB GLU 83 9.829 8.443 -4.367
609 1HG GLU 83 1HG GLU 83 8.744 10.603 -3.220
610 2HG GLU 83 2HG GLU 83 10.069 10.307 -2.095
611 HA PRO 84 HA PRO 84 6.454 5.735 -6.035
612 1HB PRO 84 1HB PRO 84 6.821 6.919 -8.433
613 2HB PRO 84 2HB PRO 84 5.533 7.417 -7.329
614 1HG PRO 84 1HG PRO 84 8.194 8.683 -7.834
615 2HG PRO 84 2HG PRO 84 6.613 9.451 -7.600
616 1HD PRO 84 1HD PRO 84 8.514 9.244 -5.637
617 2HD PRO 84 2HD PRO 84 6.778 9.357 -5.317
618 H TYR 85 H TYR 85 7.440 3.974 -6.752
619 HA TYR 85 HA TYR 85 10.248 4.209 -7.596
620 1HB TYR 85 1HB TYR 85 8.821 2.237 -5.864
621 2HB TYR 85 2HB TYR 85 10.238 1.719 -6.765
622 HD1 TYR 85 HD1 TYR 85 9.399 4.894 -4.940
623 HD2 TYR 85 HD2 TYR 85 12.051 1.573 -5.306
624 HE1 TYR 85 HE1 TYR 85 10.841 5.849 -3.197
625 HE2 TYR 85 HE2 TYR 85 13.492 2.528 -3.562
626 HH TYR 85 HH TYR 85 12.916 4.314 -1.471
627 HA PRO 86 HA PRO 86 8.136 2.540 -11.308
628 1HB PRO 86 1HB PRO 86 10.283 3.882 -12.755
629 2HB PRO 86 2HB PRO 86 8.542 4.152 -12.848
630 1HG PRO 86 1HG PRO 86 10.247 5.955 -11.761
631 2HG PRO 86 2HG PRO 86 8.571 5.766 -11.215
632 1HD PRO 86 1HD PRO 86 11.096 4.718 -9.986
633 2HD PRO 86 2HD PRO 86 9.677 5.445 -9.199
634 H ASP 87 H ASP 87 8.588 0.454 -11.619
635 HA ASP 87 HA ASP 87 10.890 -0.438 -12.928
636 1HB ASP 87 1HB ASP 87 11.953 -1.767 -11.120
637 2HB ASP 87 2HB ASP 87 12.072 -0.031 -10.848
No H/Q in entry = 637
Start of MODEL 8
1 H1 ILE 1 H1 ILE 1 -16.503 4.327 -0.220
2 H2 ILE 1 H2 ILE 1 -17.433 3.989 1.179
3 H3 ILE 1 H3 ILE 1 -17.276 5.605 0.625
4 HA ILE 1 HA ILE 1 -15.835 5.550 2.343
5 HB ILE 1 HB ILE 1 -15.994 3.167 2.776
6 1HG1 ILE 1 1HG1 ILE 1 -13.144 4.115 2.551
7 2HG1 ILE 1 2HG1 ILE 1 -14.237 4.464 3.884
8 1HG2 ILE 1 1HG2 ILE 1 -14.574 2.985 0.217
9 2HG2 ILE 1 2HG2 ILE 1 -14.033 1.868 1.469
10 3HG2 ILE 1 3HG2 ILE 1 -15.721 1.871 0.960
11 1HD1 ILE 1 1HD1 ILE 1 -13.892 1.616 3.294
12 2HD1 ILE 1 2HD1 ILE 1 -12.440 2.447 3.851
13 3HD1 ILE 1 3HD1 ILE 1 -13.902 2.469 4.838
14 H VAL 2 H VAL 2 -13.616 6.101 2.418
15 HA VAL 2 HA VAL 2 -12.483 6.491 -0.260
16 HB VAL 2 HB VAL 2 -12.052 8.156 2.226
17 1HG1 VAL 2 1HG1 VAL 2 -10.900 8.397 -0.547
18 2HG1 VAL 2 2HG1 VAL 2 -10.877 9.704 0.636
19 3HG1 VAL 2 3HG1 VAL 2 -10.028 8.195 0.972
20 1HG2 VAL 2 1HG2 VAL 2 -13.770 8.457 -0.192
21 2HG2 VAL 2 2HG2 VAL 2 -14.137 8.799 1.500
22 3HG2 VAL 2 3HG2 VAL 2 -13.107 9.897 0.580
23 H CYS 3 H CYS 3 -10.724 5.359 -0.708
24 HA CYS 3 HA CYS 3 -9.016 4.468 1.526
25 1HB CYS 3 1HB CYS 3 -9.439 3.066 -1.124
26 2HB CYS 3 2HB CYS 3 -8.479 2.474 0.225
27 H HIS 4 H HIS 4 -6.754 4.060 0.930
28 HA HIS 4 HA HIS 4 -5.749 6.281 -0.651
29 1HB HIS 4 1HB HIS 4 -4.225 4.275 1.017
30 2HB HIS 4 2HB HIS 4 -3.597 5.781 0.357
31 HD1 HIS 4 HD1 HIS 4 -5.276 7.928 1.232
32 HD2 HIS 4 HD2 HIS 4 -4.811 4.576 3.633
33 HE1 HIS 4 HE1 HIS 4 -5.907 8.661 3.547
34 HE2 HIS 4 HE2 HIS 4 -5.406 6.673 5.008
35 H THR 5 H THR 5 -4.453 6.098 -2.444
36 HA THR 5 HA THR 5 -4.067 3.387 -3.513
37 HB THR 5 HB THR 5 -5.936 5.031 -4.533
38 HG1 THR 5 HG1 THR 5 -4.270 3.178 -5.854
39 1HG2 THR 5 1HG2 THR 5 -4.343 6.757 -5.220
40 2HG2 THR 5 2HG2 THR 5 -3.500 5.567 -6.215
41 3HG2 THR 5 3HG2 THR 5 -5.163 6.022 -6.598
42 H THR 6 H THR 6 -2.345 3.126 -4.948
43 HA THR 6 HA THR 6 -0.306 5.248 -4.833
44 HB THR 6 HB THR 6 1.284 3.169 -5.024
45 HG1 THR 6 HG1 THR 6 0.051 1.442 -5.008
46 1HG2 THR 6 1HG2 THR 6 -0.015 4.204 -2.545
47 2HG2 THR 6 2HG2 THR 6 1.185 2.914 -2.470
48 3HG2 THR 6 3HG2 THR 6 1.617 4.482 -3.150
49 H ALA 7 H ALA 7 -2.315 3.566 -6.846
50 HA ALA 7 HA ALA 7 -0.798 2.739 -9.004
51 1HB ALA 7 1HB ALA 7 -3.155 2.288 -8.899
52 2HB ALA 7 2HB ALA 7 -2.817 3.192 -10.375
53 3HB ALA 7 3HB ALA 7 -3.532 4.009 -8.985
54 H THR 8 H THR 8 -1.567 5.959 -7.958
55 HA THR 8 HA THR 8 -0.726 7.208 -10.433
56 HB THR 8 HB THR 8 -1.648 9.113 -9.608
57 HG1 THR 8 HG1 THR 8 -0.997 8.699 -6.916
58 1HG2 THR 8 1HG2 THR 8 -3.160 7.107 -8.772
59 2HG2 THR 8 2HG2 THR 8 -2.715 7.769 -7.197
60 3HG2 THR 8 3HG2 THR 8 -3.527 8.789 -8.387
61 H SER 9 H SER 9 0.877 9.253 -9.861
62 HA SER 9 HA SER 9 3.384 8.001 -9.305
63 1HB SER 9 1HB SER 9 3.864 9.759 -10.676
64 2HB SER 9 2HB SER 9 2.472 10.691 -10.130
65 HG SER 9 HG SER 9 4.829 11.303 -9.558
66 HA PRO 10 HA PRO 10 3.142 10.193 -5.095
67 1HB PRO 10 1HB PRO 10 1.420 12.159 -4.610
68 2HB PRO 10 2HB PRO 10 2.843 12.472 -5.615
69 1HG PRO 10 1HG PRO 10 0.011 11.961 -6.450
70 2HG PRO 10 2HG PRO 10 1.158 13.165 -7.067
71 1HD PRO 10 1HD PRO 10 0.641 10.730 -8.271
72 2HD PRO 10 2HD PRO 10 2.125 11.676 -8.495
73 H ILE 11 H ILE 11 1.301 10.494 -3.180
74 HA ILE 11 HA ILE 11 -0.444 8.189 -3.591
75 HB ILE 11 HB ILE 11 -0.184 9.753 -1.037
76 1HG1 ILE 11 1HG1 ILE 11 1.472 7.433 -2.031
77 2HG1 ILE 11 2HG1 ILE 11 2.051 9.044 -1.624
78 1HG2 ILE 11 1HG2 ILE 11 -1.108 6.960 -1.670
79 2HG2 ILE 11 2HG2 ILE 11 -0.899 7.600 -0.040
80 3HG2 ILE 11 3HG2 ILE 11 -2.099 8.311 -1.119
81 1HD1 ILE 11 1HD1 ILE 11 1.437 8.641 0.722
82 2HD1 ILE 11 2HD1 ILE 11 0.944 7.004 0.287
83 3HD1 ILE 11 3HD1 ILE 11 2.630 7.491 0.120
84 H SER 12 H SER 12 -2.625 8.209 -3.215
85 HA SER 12 HA SER 12 -4.036 10.688 -2.783
86 1HB SER 12 1HB SER 12 -5.356 9.959 -5.052
87 2HB SER 12 2HB SER 12 -4.117 11.209 -4.981
88 HG SER 12 HG SER 12 -4.074 8.937 -6.343
89 H ALA 13 H ALA 13 -6.201 10.402 -2.252
90 HA ALA 13 HA ALA 13 -7.166 7.632 -2.138
91 1HB ALA 13 1HB ALA 13 -6.311 9.151 0.088
92 2HB ALA 13 2HB ALA 13 -8.066 9.013 0.189
93 3HB ALA 13 3HB ALA 13 -7.072 7.560 0.079
94 H VAL 14 H VAL 14 -9.300 7.369 -2.570
95 HA VAL 14 HA VAL 14 -11.080 9.673 -2.502
96 HB VAL 14 HB VAL 14 -9.922 9.435 -4.824
97 1HG1 VAL 14 1HG1 VAL 14 -10.426 6.993 -4.983
98 2HG1 VAL 14 2HG1 VAL 14 -12.129 7.418 -5.157
99 3HG1 VAL 14 3HG1 VAL 14 -10.959 7.940 -6.373
100 1HG2 VAL 14 1HG2 VAL 14 -12.232 10.585 -3.960
101 2HG2 VAL 14 2HG2 VAL 14 -11.543 10.785 -5.571
102 3HG2 VAL 14 3HG2 VAL 14 -12.799 9.578 -5.292
103 H THR 15 H THR 15 -13.285 8.915 -3.487
104 HA THR 15 HA THR 15 -14.153 6.709 -1.873
105 HB THR 15 HB THR 15 -16.112 7.768 -3.752
106 HG1 THR 15 HG1 THR 15 -14.682 9.566 -2.099
107 1HG2 THR 15 1HG2 THR 15 -16.407 6.622 -1.438
108 2HG2 THR 15 2HG2 THR 15 -16.168 8.255 -0.818
109 3HG2 THR 15 3HG2 THR 15 -17.494 7.920 -1.932
110 H CYS 16 H CYS 16 -13.655 4.728 -2.625
111 HA CYS 16 HA CYS 16 -13.346 4.033 -5.326
112 1HB CYS 16 1HB CYS 16 -14.234 1.934 -3.396
113 2HB CYS 16 2HB CYS 16 -12.987 1.867 -4.630
114 HA PRO 17 HA PRO 17 -17.551 3.884 -6.727
115 1HB PRO 17 1HB PRO 17 -17.191 2.124 -8.799
116 2HB PRO 17 2HB PRO 17 -16.822 3.847 -8.891
117 1HG PRO 17 1HG PRO 17 -14.986 1.537 -8.414
118 2HG PRO 17 2HG PRO 17 -14.735 2.983 -9.410
119 1HD PRO 17 1HD PRO 17 -13.637 2.733 -6.967
120 2HD PRO 17 2HD PRO 17 -14.199 4.300 -7.582
121 HA PRO 18 HA PRO 18 -19.821 0.370 -5.311
122 1HB PRO 18 1HB PRO 18 -20.280 -0.490 -8.139
123 2HB PRO 18 2HB PRO 18 -21.438 -0.325 -6.813
124 1HG PRO 18 1HG PRO 18 -21.295 1.524 -8.721
125 2HG PRO 18 2HG PRO 18 -21.558 1.982 -7.028
126 1HD PRO 18 1HD PRO 18 -19.112 2.233 -8.700
127 2HD PRO 18 2HD PRO 18 -19.680 3.257 -7.368
128 H GLY 19 H GLY 19 -17.401 -0.132 -7.779
129 1HA GLY 19 1HA GLY 19 -15.837 -1.776 -8.078
130 2HA GLY 19 2HA GLY 19 -17.147 -2.898 -7.748
131 H GLU 20 H GLU 20 -15.355 -0.542 -5.718
132 HA GLU 20 HA GLU 20 -14.783 -2.787 -3.884
133 1HB GLU 20 1HB GLU 20 -13.062 -0.344 -4.053
134 2HB GLU 20 2HB GLU 20 -12.659 -1.938 -3.436
135 1HG GLU 20 1HG GLU 20 -11.652 -2.305 -5.375
136 2HG GLU 20 2HG GLU 20 -13.262 -2.403 -6.088
137 H ASN 21 H ASN 21 -15.115 -2.529 -1.781
138 HA ASN 21 HA ASN 21 -16.263 0.018 -0.875
139 1HB ASN 21 1HB ASN 21 -17.330 -2.617 -0.785
140 2HB ASN 21 2HB ASN 21 -17.082 -2.044 0.853
141 2HD2 ASN 21 2HD2 ASN 21 -19.524 -2.452 0.451
142 1HD2 ASN 21 1HD2 ASN 21 -20.421 -1.032 0.075
143 H LEU 22 H LEU 22 -13.838 -2.336 -0.446
144 HA LEU 22 HA LEU 22 -13.142 -1.260 2.194
145 1HB LEU 22 1HB LEU 22 -12.298 -3.839 0.881
146 2HB LEU 22 2HB LEU 22 -11.851 -3.313 2.483
147 HG LEU 22 HG LEU 22 -14.745 -3.602 1.827
148 1HD1 LEU 22 1HD1 LEU 22 -13.409 -5.660 1.076
149 2HD1 LEU 22 2HD1 LEU 22 -13.139 -5.937 2.797
150 3HD1 LEU 22 3HD1 LEU 22 -14.782 -5.906 2.156
151 1HD2 LEU 22 1HD2 LEU 22 -13.070 -3.950 4.307
152 2HD2 LEU 22 2HD2 LEU 22 -14.204 -2.646 3.955
153 3HD2 LEU 22 3HD2 LEU 22 -14.799 -4.284 4.220
154 H CYS 23 H CYS 23 -10.591 -1.718 2.484
155 HA CYS 23 HA CYS 23 -9.219 -0.537 0.158
156 1HB CYS 23 1HB CYS 23 -8.366 0.090 2.966
157 2HB CYS 23 2HB CYS 23 -8.064 0.996 1.491
158 H TYR 24 H TYR 24 -6.777 -0.877 0.290
159 HA TYR 24 HA TYR 24 -5.989 -3.167 1.883
160 1HB TYR 24 1HB TYR 24 -5.460 -4.640 0.146
161 2HB TYR 24 2HB TYR 24 -7.043 -4.012 -0.284
162 HD1 TYR 24 HD1 TYR 24 -3.400 -3.328 -0.956
163 HD2 TYR 24 HD2 TYR 24 -7.396 -3.270 -2.435
164 HE1 TYR 24 HE1 TYR 24 -2.566 -2.685 -3.170
165 HE2 TYR 24 HE2 TYR 24 -6.565 -2.620 -4.655
166 HH TYR 24 HH TYR 24 -4.218 -2.957 -5.914
167 H ARG 25 H ARG 25 -3.786 -3.592 1.949
168 HA ARG 25 HA ARG 25 -1.966 -1.664 0.723
169 1HB ARG 25 1HB ARG 25 -2.575 -0.827 3.009
170 2HB ARG 25 2HB ARG 25 -1.919 -2.314 3.678
171 1HG ARG 25 1HG ARG 25 0.274 -1.728 2.655
172 2HG ARG 25 2HG ARG 25 -0.419 -0.174 2.190
173 1HD ARG 25 1HD ARG 25 0.924 -0.240 4.347
174 2HD ARG 25 2HD ARG 25 -0.670 0.507 4.422
175 HE ARG 25 HE ARG 25 0.158 -1.994 5.655
176 1HH1 ARG 25 1HH1 ARG 25 -2.474 0.154 4.838
177 2HH1 ARG 25 2HH1 ARG 25 -3.546 -0.512 6.023
178 1HH2 ARG 25 1HH2 ARG 25 -1.256 -2.867 7.210
179 2HH2 ARG 25 2HH2 ARG 25 -2.857 -2.224 7.367
180 H LYS 26 H LYS 26 -0.628 -2.943 -0.393
181 HA LYS 26 HA LYS 26 -0.077 -5.647 0.537
182 1HB LYS 26 1HB LYS 26 -0.640 -5.072 -1.851
183 2HB LYS 26 2HB LYS 26 0.934 -4.313 -1.967
184 1HG LYS 26 1HG LYS 26 2.057 -6.317 -1.890
185 2HG LYS 26 2HG LYS 26 0.738 -7.142 -1.054
186 1HD LYS 26 1HD LYS 26 -0.417 -6.376 -3.433
187 2HD LYS 26 2HD LYS 26 1.225 -6.805 -3.912
188 1HE LYS 26 1HE LYS 26 0.875 -8.943 -2.565
189 2HE LYS 26 2HE LYS 26 -0.835 -8.514 -2.547
190 1HZ LYS 26 1HZ LYS 26 0.566 -8.540 -5.120
191 2HZ LYS 26 2HZ LYS 26 0.159 -10.024 -4.419
192 3HZ LYS 26 3HZ LYS 26 -1.051 -8.896 -4.770
193 H MET 27 H MET 27 1.992 -6.490 0.921
194 HA MET 27 HA MET 27 4.236 -4.656 0.996
195 1HB MET 27 1HB MET 27 3.060 -5.913 3.455
196 2HB MET 27 2HB MET 27 4.713 -5.331 3.396
197 1HG MET 27 1HG MET 27 3.854 -3.412 4.133
198 2HG MET 27 2HG MET 27 3.353 -3.175 2.460
199 1HE MET 27 1HE MET 27 2.335 -4.401 6.000
200 2HE MET 27 2HE MET 27 0.625 -4.789 5.812
201 3HE MET 27 3HE MET 27 1.849 -5.802 5.047
202 H TRP 28 H TRP 28 6.194 -5.585 0.780
203 HA TRP 28 HA TRP 28 6.813 -8.257 1.499
204 1HB TRP 28 1HB TRP 28 7.062 -9.309 -0.699
205 2HB TRP 28 2HB TRP 28 5.404 -8.851 -0.411
206 HD1 TRP 28 HD1 TRP 28 8.242 -6.770 -1.914
207 HE1 TRP 28 HE1 TRP 28 7.487 -5.878 -4.202
208 HE3 TRP 28 HE3 TRP 28 3.696 -9.026 -2.144
209 HZ2 TRP 28 HZ2 TRP 28 5.243 -6.115 -5.887
210 HZ3 TRP 28 HZ3 TRP 28 2.297 -8.657 -4.135
211 HH2 TRP 28 HH2 TRP 28 3.054 -7.232 -5.967
212 H CYS 29 H CYS 29 9.064 -8.397 1.719
213 HA CYS 29 HA CYS 29 10.501 -6.070 1.265
214 1HB CYS 29 1HB CYS 29 11.588 -8.820 1.752
215 2HB CYS 29 2HB CYS 29 12.570 -7.394 1.644
216 H ASP 30 H ASP 30 10.877 -5.218 -0.635
217 HA ASP 30 HA ASP 30 11.377 -6.793 -2.986
218 1HB ASP 30 1HB ASP 30 12.083 -4.548 -3.975
219 2HB ASP 30 2HB ASP 30 10.417 -4.636 -3.424
220 H ALA 31 H ALA 31 13.430 -7.125 -3.918
221 HA ALA 31 HA ALA 31 15.460 -7.982 -2.442
222 1HB ALA 31 1HB ALA 31 15.830 -8.393 -4.646
223 2HB ALA 31 2HB ALA 31 16.990 -7.087 -4.405
224 3HB ALA 31 3HB ALA 31 15.423 -6.749 -5.138
225 H PHE 32 H PHE 32 14.978 -6.215 -0.735
226 HA PHE 32 HA PHE 32 17.374 -4.860 -0.257
227 1HB PHE 32 1HB PHE 32 15.381 -3.416 -1.724
228 2HB PHE 32 2HB PHE 32 15.604 -2.693 -0.149
229 HD1 PHE 32 HD1 PHE 32 16.535 -2.269 -3.340
230 HD2 PHE 32 HD2 PHE 32 18.345 -2.844 0.467
231 HE1 PHE 32 HE1 PHE 32 18.576 -1.156 -4.147
232 HE2 PHE 32 HE2 PHE 32 20.389 -1.731 -0.331
233 HZ PHE 32 HZ PHE 32 20.506 -0.885 -2.642
234 H CYS 33 H CYS 33 15.133 -6.655 0.959
235 HA CYS 33 HA CYS 33 13.673 -5.554 2.933
236 1HB CYS 33 1HB CYS 33 14.133 -8.038 2.367
237 2HB CYS 33 2HB CYS 33 15.377 -7.922 3.605
238 H SER 34 H SER 34 17.144 -5.585 2.819
239 HA SER 34 HA SER 34 17.520 -4.845 5.571
240 1HB SER 34 1HB SER 34 19.445 -4.559 3.248
241 2HB SER 34 2HB SER 34 19.853 -4.518 4.963
242 HG SER 34 HG SER 34 19.823 -6.615 3.434
243 H SER 35 H SER 35 17.769 -3.134 2.445
244 HA SER 35 HA SER 35 17.709 -0.565 3.848
245 1HB SER 35 1HB SER 35 19.108 -1.424 1.601
246 2HB SER 35 2HB SER 35 17.830 -0.409 0.936
247 HG SER 35 HG SER 35 20.033 0.283 2.401
248 H ARG 36 H ARG 36 16.277 -1.422 0.692
249 HA ARG 36 HA ARG 36 13.962 0.153 1.221
250 1HB ARG 36 1HB ARG 36 14.035 -1.941 -0.929
251 2HB ARG 36 2HB ARG 36 13.229 -0.400 -0.926
252 1HG ARG 36 1HG ARG 36 16.197 -0.445 -0.842
253 2HG ARG 36 2HG ARG 36 15.365 -0.766 -2.363
254 1HD ARG 36 1HD ARG 36 14.360 1.349 -2.390
255 2HD ARG 36 2HD ARG 36 14.699 1.628 -0.683
256 HE ARG 36 HE ARG 36 16.788 2.377 -1.253
257 1HH1 ARG 36 1HH1 ARG 36 15.389 0.722 -3.989
258 2HH1 ARG 36 2HH1 ARG 36 16.642 1.208 -5.082
259 1HH2 ARG 36 1HH2 ARG 36 18.434 3.020 -2.689
260 2HH2 ARG 36 2HH2 ARG 36 18.371 2.511 -4.344
261 H GLY 37 H GLY 37 13.829 -3.331 0.232
262 1HA GLY 37 1HA GLY 37 12.626 -3.978 2.763
263 2HA GLY 37 2HA GLY 37 12.906 -5.066 1.418
264 H LYS 38 H LYS 38 10.622 -4.628 3.225
265 HA LYS 38 HA LYS 38 8.622 -5.442 1.701
266 1HB LYS 38 1HB LYS 38 7.569 -3.616 3.667
267 2HB LYS 38 2HB LYS 38 7.325 -5.332 3.478
268 1HG LYS 38 1HG LYS 38 9.941 -4.525 4.571
269 2HG LYS 38 2HG LYS 38 8.540 -4.208 5.586
270 1HD LYS 38 1HD LYS 38 8.838 -6.880 4.293
271 2HD LYS 38 2HD LYS 38 9.775 -6.502 5.740
272 1HE LYS 38 1HE LYS 38 7.995 -6.757 7.056
273 2HE LYS 38 2HE LYS 38 7.005 -5.719 6.031
274 1HZ LYS 38 1HZ LYS 38 6.785 -7.705 4.525
275 2HZ LYS 38 2HZ LYS 38 7.456 -8.634 5.769
276 3HZ LYS 38 3HZ LYS 38 5.992 -7.823 6.013
277 H VAL 39 H VAL 39 7.898 -4.730 -0.130
278 HA VAL 39 HA VAL 39 7.793 -2.004 -0.905
279 HB VAL 39 HB VAL 39 6.460 -4.479 -2.030
280 1HG1 VAL 39 1HG1 VAL 39 6.449 -1.678 -3.149
281 2HG1 VAL 39 2HG1 VAL 39 5.911 -3.121 -4.009
282 3HG1 VAL 39 3HG1 VAL 39 5.053 -2.586 -2.566
283 1HG2 VAL 39 1HG2 VAL 39 8.852 -2.858 -2.854
284 2HG2 VAL 39 2HG2 VAL 39 8.794 -4.557 -2.384
285 3HG2 VAL 39 3HG2 VAL 39 8.076 -4.038 -3.910
286 H VAL 40 H VAL 40 5.845 -0.778 -1.250
287 HA VAL 40 HA VAL 40 3.600 -1.610 0.454
288 HB VAL 40 HB VAL 40 4.516 1.248 0.188
289 1HG1 VAL 40 1HG1 VAL 40 2.352 -0.166 1.606
290 2HG1 VAL 40 2HG1 VAL 40 3.187 1.093 2.517
291 3HG1 VAL 40 3HG1 VAL 40 2.414 1.482 0.979
292 1HG2 VAL 40 1HG2 VAL 40 6.292 -0.028 1.260
293 2HG2 VAL 40 2HG2 VAL 40 5.486 1.020 2.427
294 3HG2 VAL 40 3HG2 VAL 40 5.132 -0.707 2.401
295 H GLU 41 H GLU 41 1.883 -1.906 -0.729
296 HA GLU 41 HA GLU 41 1.434 -0.214 -3.094
297 1HB GLU 41 1HB GLU 41 1.614 -2.869 -3.163
298 2HB GLU 41 2HB GLU 41 -0.077 -2.755 -2.695
299 1HG GLU 41 1HG GLU 41 -0.678 -2.302 -4.772
300 2HG GLU 41 2HG GLU 41 0.449 -0.948 -4.851
301 H LEU 42 H LEU 42 -0.816 0.376 -3.519
302 HA LEU 42 HA LEU 42 -2.575 0.327 -1.185
303 1HB LEU 42 1HB LEU 42 -1.028 2.572 -2.014
304 2HB LEU 42 2HB LEU 42 -2.713 2.933 -2.314
305 HG LEU 42 HG LEU 42 -3.269 2.614 -0.009
306 1HD1 LEU 42 1HD1 LEU 42 -0.496 1.511 0.167
307 2HD1 LEU 42 2HD1 LEU 42 -1.290 2.179 1.592
308 3HD1 LEU 42 3HD1 LEU 42 -2.011 0.814 0.739
309 1HD2 LEU 42 1HD2 LEU 42 -2.220 4.773 -0.753
310 2HD2 LEU 42 2HD2 LEU 42 -2.103 4.433 0.974
311 3HD2 LEU 42 3HD2 LEU 42 -0.704 4.184 -0.070
312 H GLY 43 H GLY 43 -4.732 0.325 -1.659
313 1HA GLY 43 1HA GLY 43 -5.503 -0.339 -4.315
314 2HA GLY 43 2HA GLY 43 -5.947 1.320 -3.953
315 H CYS 44 H CYS 44 -8.118 0.413 -4.386
316 HA CYS 44 HA CYS 44 -9.395 -0.236 -1.874
317 1HB CYS 44 1HB CYS 44 -10.641 0.077 -4.616
318 2HB CYS 44 2HB CYS 44 -11.487 0.065 -3.073
319 H ALA 45 H ALA 45 -11.178 -1.960 -1.944
320 HA ALA 45 HA ALA 45 -10.821 -4.163 -3.734
321 1HB ALA 45 1HB ALA 45 -8.886 -4.636 -2.433
322 2HB ALA 45 2HB ALA 45 -9.766 -4.398 -0.924
323 3HB ALA 45 3HB ALA 45 -10.133 -5.785 -1.950
324 H ALA 46 H ALA 46 -12.439 -5.724 -3.546
325 HA ALA 46 HA ALA 46 -14.781 -4.833 -2.083
326 1HB ALA 46 1HB ALA 46 -15.884 -6.747 -3.294
327 2HB ALA 46 2HB ALA 46 -15.194 -5.495 -4.326
328 3HB ALA 46 3HB ALA 46 -14.342 -7.023 -4.104
329 H THR 47 H THR 47 -12.462 -7.456 -2.054
330 HA THR 47 HA THR 47 -13.575 -8.362 0.509
331 HB THR 47 HB THR 47 -12.477 -10.645 -0.550
332 HG1 THR 47 HG1 THR 47 -12.397 -9.532 -2.606
333 1HG2 THR 47 1HG2 THR 47 -15.296 -9.672 -0.437
334 2HG2 THR 47 2HG2 THR 47 -14.903 -11.246 -1.129
335 3HG2 THR 47 3HG2 THR 47 -14.494 -10.894 0.550
336 H CYS 48 H CYS 48 -11.745 -10.228 1.222
337 HA CYS 48 HA CYS 48 -9.190 -8.774 1.153
338 1HB CYS 48 1HB CYS 48 -10.458 -8.682 3.341
339 2HB CYS 48 2HB CYS 48 -10.154 -10.405 3.468
340 HA PRO 49 HA PRO 49 -8.403 -13.064 -0.349
341 1HB PRO 49 1HB PRO 49 -7.046 -12.420 -2.573
342 2HB PRO 49 2HB PRO 49 -8.811 -12.423 -2.522
343 1HG PRO 49 1HG PRO 49 -6.912 -10.123 -2.372
344 2HG PRO 49 2HG PRO 49 -8.463 -10.242 -3.220
345 1HD PRO 49 1HD PRO 49 -8.109 -9.017 -0.776
346 2HD PRO 49 2HD PRO 49 -9.653 -9.667 -1.359
347 H SER 50 H SER 50 -6.382 -14.194 -0.640
348 HA SER 50 HA SER 50 -3.861 -12.946 -0.304
349 1HB SER 50 1HB SER 50 -4.013 -14.534 2.079
350 2HB SER 50 2HB SER 50 -3.639 -12.818 1.923
351 HG SER 50 HG SER 50 -5.823 -13.935 2.929
352 H LYS 51 H LYS 51 -2.147 -14.399 -0.578
353 HA LYS 51 HA LYS 51 -2.443 -17.203 -0.390
354 1HB LYS 51 1HB LYS 51 -3.531 -16.121 -2.706
355 2HB LYS 51 2HB LYS 51 -1.985 -16.792 -3.191
356 1HG LYS 51 1HG LYS 51 -2.973 -18.767 -3.324
357 2HG LYS 51 2HG LYS 51 -3.115 -18.739 -1.565
358 1HD LYS 51 1HD LYS 51 -5.240 -17.235 -2.200
359 2HD LYS 51 2HD LYS 51 -5.156 -18.239 -3.649
360 1HE LYS 51 1HE LYS 51 -5.126 -20.247 -2.192
361 2HE LYS 51 2HE LYS 51 -5.351 -19.194 -0.795
362 1HZ LYS 51 1HZ LYS 51 -7.366 -18.395 -2.318
363 2HZ LYS 51 2HZ LYS 51 -7.258 -20.001 -2.837
364 3HZ LYS 51 3HZ LYS 51 -7.504 -19.655 -1.199
365 H LYS 52 H LYS 52 -0.562 -15.402 0.540
366 HA LYS 52 HA LYS 52 1.838 -16.626 -0.403
367 1HB LYS 52 1HB LYS 52 1.122 -13.899 -1.302
368 2HB LYS 52 2HB LYS 52 2.769 -14.115 -0.728
369 1HG LYS 52 1HG LYS 52 1.421 -15.564 -2.993
370 2HG LYS 52 2HG LYS 52 2.743 -14.404 -3.094
371 1HD LYS 52 1HD LYS 52 2.832 -17.173 -1.899
372 2HD LYS 52 2HD LYS 52 3.641 -16.614 -3.362
373 1HE LYS 52 1HE LYS 52 4.182 -15.507 -0.612
374 2HE LYS 52 2HE LYS 52 5.120 -16.803 -1.352
375 1HZ LYS 52 1HZ LYS 52 5.691 -15.295 -3.161
376 2HZ LYS 52 2HZ LYS 52 4.807 -14.052 -2.429
377 3HZ LYS 52 3HZ LYS 52 6.188 -14.670 -1.670
378 HA PRO 53 HA PRO 53 2.436 -15.875 3.978
379 1HB PRO 53 1HB PRO 53 5.195 -16.758 3.341
380 2HB PRO 53 2HB PRO 53 4.064 -17.379 4.547
381 1HG PRO 53 1HG PRO 53 4.583 -18.751 2.318
382 2HG PRO 53 2HG PRO 53 2.952 -18.711 3.015
383 1HD PRO 53 1HD PRO 53 4.045 -17.231 0.657
384 2HD PRO 53 2HD PRO 53 2.447 -17.971 0.884
385 H TYR 54 H TYR 54 5.163 -15.091 1.803
386 HA TYR 54 HA TYR 54 5.978 -12.899 3.469
387 1HB TYR 54 1HB TYR 54 6.992 -13.474 0.731
388 2HB TYR 54 2HB TYR 54 7.823 -12.649 2.034
389 HD1 TYR 54 HD1 TYR 54 7.520 -14.412 4.297
390 HD2 TYR 54 HD2 TYR 54 8.184 -15.394 0.211
391 HE1 TYR 54 HE1 TYR 54 8.560 -16.532 4.982
392 HE2 TYR 54 HE2 TYR 54 9.225 -17.517 0.884
393 HH TYR 54 HH TYR 54 8.920 -19.061 3.214
394 H GLU 55 H GLU 55 4.015 -13.295 0.636
395 HA GLU 55 HA GLU 55 3.883 -10.365 0.345
396 1HB GLU 55 1HB GLU 55 3.274 -12.549 -1.653
397 2HB GLU 55 2HB GLU 55 2.944 -10.846 -1.929
398 1HG GLU 55 1HG GLU 55 5.268 -10.311 -1.855
399 2HG GLU 55 2HG GLU 55 5.679 -11.945 -1.336
400 H GLU 56 H GLU 56 2.310 -9.868 1.821
401 HA GLU 56 HA GLU 56 -0.355 -10.986 1.271
402 1HB GLU 56 1HB GLU 56 1.133 -10.817 3.803
403 2HB GLU 56 2HB GLU 56 -0.527 -10.250 3.889
404 1HG GLU 56 1HG GLU 56 -0.972 -12.525 2.605
405 2HG GLU 56 2HG GLU 56 0.529 -12.974 3.415
406 H VAL 57 H VAL 57 -2.138 -9.579 1.833
407 HA VAL 57 HA VAL 57 -1.409 -6.726 1.769
408 HB VAL 57 HB VAL 57 -3.878 -6.724 0.647
409 1HG1 VAL 57 1HG1 VAL 57 -1.203 -6.945 -0.710
410 2HG1 VAL 57 2HG1 VAL 57 -2.689 -6.474 -1.534
411 3HG1 VAL 57 3HG1 VAL 57 -2.050 -5.474 -0.230
412 1HG2 VAL 57 1HG2 VAL 57 -3.908 -9.206 0.594
413 2HG2 VAL 57 2HG2 VAL 57 -4.064 -8.464 -0.999
414 3HG2 VAL 57 3HG2 VAL 57 -2.523 -9.160 -0.498
415 H THR 58 H THR 58 -2.322 -5.469 3.292
416 HA THR 58 HA THR 58 -4.143 -6.730 5.177
417 HB THR 58 HB THR 58 -3.827 -4.387 6.303
418 HG1 THR 58 HG1 THR 58 -1.461 -4.490 4.762
419 1HG2 THR 58 1HG2 THR 58 -2.806 -6.663 6.962
420 2HG2 THR 58 2HG2 THR 58 -1.332 -6.018 6.241
421 3HG2 THR 58 3HG2 THR 58 -2.091 -5.179 7.593
422 H CYS 59 H CYS 59 -6.239 -6.594 4.850
423 HA CYS 59 HA CYS 59 -7.319 -4.290 3.398
424 1HB CYS 59 1HB CYS 59 -9.164 -6.510 3.835
425 2HB CYS 59 2HB CYS 59 -8.718 -5.690 2.350
426 H CYS 60 H CYS 60 -8.890 -3.019 4.281
427 HA CYS 60 HA CYS 60 -9.954 -3.756 6.914
428 1HB CYS 60 1HB CYS 60 -9.708 -1.151 7.353
429 2HB CYS 60 2HB CYS 60 -8.400 -2.273 7.706
430 H SER 61 H SER 61 -11.670 -1.918 7.532
431 HA SER 61 HA SER 61 -13.276 -1.359 5.128
432 1HB SER 61 1HB SER 61 -15.307 -1.999 6.347
433 2HB SER 61 2HB SER 61 -14.177 -3.350 6.261
434 HG SER 61 HG SER 61 -14.244 -3.388 8.348
435 H THR 62 H THR 62 -11.659 0.566 6.222
436 HA THR 62 HA THR 62 -13.650 2.462 7.190
437 HB THR 62 HB THR 62 -12.787 1.992 9.275
438 HG1 THR 62 HG1 THR 62 -11.843 3.813 9.817
439 1HG2 THR 62 1HG2 THR 62 -10.574 0.898 7.901
440 2HG2 THR 62 2HG2 THR 62 -9.967 2.064 9.076
441 3HG2 THR 62 3HG2 THR 62 -11.007 0.741 9.603
442 H ASP 63 H ASP 63 -13.112 4.673 6.807
443 HA ASP 63 HA ASP 63 -11.832 5.134 4.358
444 1HB ASP 63 1HB ASP 63 -12.298 7.255 6.393
445 2HB ASP 63 2HB ASP 63 -12.322 7.411 4.648
446 H LYS 64 H LYS 64 -9.850 5.899 3.779
447 HA LYS 64 HA LYS 64 -7.576 6.089 3.929
448 1HB LYS 64 1HB LYS 64 -8.258 7.682 6.407
449 2HB LYS 64 2HB LYS 64 -6.809 7.839 5.427
450 1HG LYS 64 1HG LYS 64 -7.983 8.825 3.651
451 2HG LYS 64 2HG LYS 64 -9.546 8.328 4.303
452 1HD LYS 64 1HD LYS 64 -9.443 9.920 6.038
453 2HD LYS 64 2HD LYS 64 -7.721 10.209 5.777
454 1HE LYS 64 1HE LYS 64 -9.239 12.015 4.929
455 2HE LYS 64 2HE LYS 64 -8.141 11.339 3.726
456 1HZ LYS 64 1HZ LYS 64 -10.927 10.389 4.039
457 2HZ LYS 64 2HZ LYS 64 -10.518 11.670 3.012
458 3HZ LYS 64 3HZ LYS 64 -9.876 10.129 2.739
459 H CYS 65 H CYS 65 -8.545 3.721 5.074
460 HA CYS 65 HA CYS 65 -7.152 3.326 7.580
461 1HB CYS 65 1HB CYS 65 -8.305 1.258 7.706
462 2HB CYS 65 2HB CYS 65 -9.452 2.445 7.111
463 H ASN 66 H ASN 66 -6.452 2.882 4.251
464 HA ASN 66 HA ASN 66 -4.384 0.921 4.923
465 1HB ASN 66 1HB ASN 66 -4.494 0.180 2.650
466 2HB ASN 66 2HB ASN 66 -6.118 0.202 3.312
467 2HD2 ASN 66 2HD2 ASN 66 -4.441 0.803 0.652
468 1HD2 ASN 66 1HD2 ASN 66 -5.395 2.054 -0.062
469 HA PRO 67 HA PRO 67 -2.134 4.730 3.378
470 1HB PRO 67 1HB PRO 67 -1.330 5.919 5.606
471 2HB PRO 67 2HB PRO 67 -2.997 6.118 5.049
472 1HG PRO 67 1HG PRO 67 -1.918 4.337 7.199
473 2HG PRO 67 2HG PRO 67 -3.393 5.320 7.197
474 1HD PRO 67 1HD PRO 67 -3.287 2.600 6.637
475 2HD PRO 67 2HD PRO 67 -4.599 3.693 6.163
476 H HIS 68 H HIS 68 0.200 5.202 3.585
477 HA HIS 68 HA HIS 68 1.773 2.889 3.687
478 1HB HIS 68 1HB HIS 68 2.356 5.024 2.498
479 2HB HIS 68 2HB HIS 68 2.765 5.715 4.058
480 HD1 HIS 68 HD1 HIS 68 4.972 4.989 5.141
481 HD2 HIS 68 HD2 HIS 68 4.188 3.132 1.508
482 HE1 HIS 68 HE1 HIS 68 7.124 3.866 4.483
483 HE2 HIS 68 HE2 HIS 68 6.592 2.657 2.337
484 HA PRO 69 HA PRO 69 2.223 2.107 8.023
485 1HB PRO 69 1HB PRO 69 4.936 1.153 7.271
486 2HB PRO 69 2HB PRO 69 3.654 0.324 8.160
487 1HG PRO 69 1HG PRO 69 4.182 -0.311 5.629
488 2HG PRO 69 2HG PRO 69 2.514 -0.265 6.229
489 1HD PRO 69 1HD PRO 69 3.974 1.710 4.528
490 2HD PRO 69 2HD PRO 69 2.278 1.190 4.454
491 H LYS 70 H LYS 70 5.102 3.469 6.401
492 HA LYS 70 HA LYS 70 5.841 4.786 8.903
493 1HB LYS 70 1HB LYS 70 7.280 3.924 6.485
494 2HB LYS 70 2HB LYS 70 7.813 5.461 7.152
495 1HG LYS 70 1HG LYS 70 7.525 3.020 8.866
496 2HG LYS 70 2HG LYS 70 8.993 3.346 7.943
497 1HD LYS 70 1HD LYS 70 7.785 5.340 9.847
498 2HD LYS 70 2HD LYS 70 8.979 4.143 10.349
499 1HE LYS 70 1HE LYS 70 9.375 6.194 8.172
500 2HE LYS 70 2HE LYS 70 9.989 6.329 9.819
501 1HZ LYS 70 1HZ LYS 70 10.816 3.862 8.849
502 2HZ LYS 70 2HZ LYS 70 11.124 4.981 7.618
503 3HZ LYS 70 3HZ LYS 70 11.773 5.221 9.162
504 H GLN 71 H GLN 71 3.605 5.672 7.008
505 HA GLN 71 HA GLN 71 4.594 8.253 6.130
506 1HB GLN 71 1HB GLN 71 3.124 7.555 4.537
507 2HB GLN 71 2HB GLN 71 2.174 6.610 5.672
508 1HG GLN 71 1HG GLN 71 0.726 8.262 6.025
509 2HG GLN 71 2HG GLN 71 1.977 9.501 6.050
510 2HE2 GLN 71 2HE2 GLN 71 0.184 7.387 3.850
511 1HE2 GLN 71 1HE2 GLN 71 0.176 8.487 2.517
512 H ARG 72 H ARG 72 4.332 10.114 7.188
513 HA ARG 72 HA ARG 72 3.677 10.226 9.881
514 1HB ARG 72 1HB ARG 72 5.023 11.930 8.775
515 2HB ARG 72 2HB ARG 72 3.632 12.443 7.829
516 1HG ARG 72 1HG ARG 72 2.883 12.557 10.551
517 2HG ARG 72 2HG ARG 72 4.469 13.318 10.403
518 1HD ARG 72 1HD ARG 72 3.456 14.567 8.401
519 2HD ARG 72 2HD ARG 72 1.897 14.045 9.038
520 HE ARG 72 HE ARG 72 2.080 15.660 10.631
521 1HH1 ARG 72 1HH1 ARG 72 5.277 14.957 9.422
522 2HH1 ARG 72 2HH1 ARG 72 6.037 16.210 10.343
523 1HH2 ARG 72 1HH2 ARG 72 3.078 17.308 11.845
524 2HH2 ARG 72 2HH2 ARG 72 4.789 17.544 11.721
525 HA PRO 73 HA PRO 73 -0.809 9.918 9.349
526 1HB PRO 73 1HB PRO 73 -1.372 9.618 11.985
527 2HB PRO 73 2HB PRO 73 -0.800 8.290 10.970
528 1HG PRO 73 1HG PRO 73 0.737 10.019 12.871
529 2HG PRO 73 2HG PRO 73 0.824 8.263 12.636
530 1HD PRO 73 1HD PRO 73 2.637 9.963 11.567
531 2HD PRO 73 2HD PRO 73 2.157 8.454 10.763
532 H GLY 74 H GLY 74 -2.574 11.269 9.827
533 1HA GLY 74 1HA GLY 74 -3.147 13.593 9.752
534 2HA GLY 74 2HA GLY 74 -1.782 13.927 10.808
535 H1 TRP 75 H1 TRP 75 5.350 0.596 -10.504
536 H2 TRP 75 H2 TRP 75 4.346 1.860 -11.086
537 H3 TRP 75 H3 TRP 75 5.933 1.673 -11.706
538 HA TRP 75 HA TRP 75 6.875 2.219 -9.624
539 1HB TRP 75 1HB TRP 75 6.104 4.577 -9.536
540 2HB TRP 75 2HB TRP 75 6.385 4.022 -11.183
541 HD1 TRP 75 HD1 TRP 75 3.463 4.746 -8.767
542 HE1 TRP 75 HE1 TRP 75 1.388 5.315 -10.178
543 HE3 TRP 75 HE3 TRP 75 5.366 3.828 -13.422
544 HZ2 TRP 75 HZ2 TRP 75 0.651 5.366 -12.903
545 HZ3 TRP 75 HZ3 TRP 75 3.910 4.160 -15.379
546 HH2 TRP 75 HH2 TRP 75 1.601 4.913 -15.123
547 H ARG 76 H ARG 76 6.743 2.122 -7.467
548 HA ARG 76 HA ARG 76 4.207 2.557 -6.116
549 1HB ARG 76 1HB ARG 76 5.057 0.267 -4.825
550 2HB ARG 76 2HB ARG 76 3.717 0.374 -5.956
551 1HG ARG 76 1HG ARG 76 4.898 -0.593 -7.663
552 2HG ARG 76 2HG ARG 76 6.458 -0.068 -7.027
553 1HD ARG 76 1HD ARG 76 5.076 -1.856 -5.209
554 2HD ARG 76 2HD ARG 76 5.335 -2.591 -6.788
555 HE ARG 76 HE ARG 76 7.380 -1.766 -4.882
556 1HH1 ARG 76 1HH1 ARG 76 6.629 -2.974 -8.074
557 2HH1 ARG 76 2HH1 ARG 76 8.215 -3.614 -8.338
558 1HH2 ARG 76 1HH2 ARG 76 9.464 -2.613 -5.233
559 2HH2 ARG 76 2HH2 ARG 76 9.823 -3.408 -6.729
560 H TYR 77 H TYR 77 4.821 1.782 -3.575
561 HA TYR 77 HA TYR 77 7.287 3.321 -3.039
562 1HB TYR 77 1HB TYR 77 4.845 3.099 -1.273
563 2HB TYR 77 2HB TYR 77 6.281 4.056 -0.944
564 HD1 TYR 77 HD1 TYR 77 3.802 3.673 -3.730
565 HD2 TYR 77 HD2 TYR 77 6.084 6.309 -1.294
566 HE1 TYR 77 HE1 TYR 77 2.790 5.599 -4.875
567 HE2 TYR 77 HE2 TYR 77 5.078 8.242 -2.431
568 HH TYR 77 HH TYR 77 3.026 8.762 -3.706
569 H TYR 78 H TYR 78 8.391 2.761 -1.025
570 HA TYR 78 HA TYR 78 8.158 -0.096 -0.411
571 1HB TYR 78 1HB TYR 78 10.604 1.672 -0.224
572 2HB TYR 78 2HB TYR 78 10.545 -0.048 0.095
573 HD1 TYR 78 HD1 TYR 78 12.467 1.141 -1.808
574 HD2 TYR 78 HD2 TYR 78 8.508 -0.287 -2.428
575 HE1 TYR 78 HE1 TYR 78 13.010 0.672 -4.158
576 HE2 TYR 78 HE2 TYR 78 9.040 -0.753 -4.782
577 HH TYR 78 HH TYR 78 11.619 -1.251 -6.022
578 H GLU 79 H GLU 79 8.816 -0.652 1.837
579 HA GLU 79 HA GLU 79 7.344 0.866 3.689
580 1HB GLU 79 1HB GLU 79 8.885 -1.589 3.710
581 2HB GLU 79 2HB GLU 79 9.126 -0.677 5.193
582 1HG GLU 79 1HG GLU 79 6.505 -0.489 5.107
583 2HG GLU 79 2HG GLU 79 6.665 -1.940 4.121
584 H SER 80 H SER 80 10.798 0.688 3.016
585 HA SER 80 HA SER 80 11.393 2.644 5.076
586 1HB SER 80 1HB SER 80 12.836 0.583 3.789
587 2HB SER 80 2HB SER 80 13.669 2.103 3.491
588 HG SER 80 HG SER 80 13.593 2.463 5.771
589 H SER 81 H SER 81 9.822 3.325 2.589
590 HA SER 81 HA SER 81 11.244 5.769 2.009
591 1HB SER 81 1HB SER 81 11.439 3.573 0.244
592 2HB SER 81 2HB SER 81 10.452 4.806 -0.530
593 HG SER 81 HG SER 81 12.118 6.279 -0.235
594 H LEU 82 H LEU 82 9.836 7.385 1.979
595 HA LEU 82 HA LEU 82 6.997 6.805 1.784
596 1HB LEU 82 1HB LEU 82 8.672 8.944 2.881
597 2HB LEU 82 2HB LEU 82 7.229 9.530 2.081
598 HG LEU 82 HG LEU 82 7.265 8.956 4.662
599 1HD1 LEU 82 1HD1 LEU 82 5.338 9.490 2.803
600 2HD1 LEU 82 2HD1 LEU 82 4.784 7.961 3.486
601 3HD1 LEU 82 3HD1 LEU 82 5.070 9.346 4.540
602 1HD2 LEU 82 1HD2 LEU 82 7.918 6.544 4.053
603 2HD2 LEU 82 2HD2 LEU 82 6.648 6.789 5.250
604 3HD2 LEU 82 3HD2 LEU 82 6.225 6.356 3.595
605 H GLU 83 H GLU 83 9.531 8.136 -0.156
606 HA GLU 83 HA GLU 83 7.889 9.625 -1.942
607 1HB GLU 83 1HB GLU 83 10.599 8.475 -2.574
608 2HB GLU 83 2HB GLU 83 9.853 9.917 -3.237
609 1HG GLU 83 1HG GLU 83 10.917 9.535 -0.456
610 2HG GLU 83 2HG GLU 83 11.561 10.582 -1.719
611 HA PRO 84 HA PRO 84 6.756 6.378 -4.744
612 1HB PRO 84 1HB PRO 84 6.778 7.850 -7.117
613 2HB PRO 84 2HB PRO 84 5.467 7.819 -5.938
614 1HG PRO 84 1HG PRO 84 7.147 10.014 -6.590
615 2HG PRO 84 2HG PRO 84 5.924 9.938 -5.313
616 1HD PRO 84 1HD PRO 84 8.867 9.626 -5.133
617 2HD PRO 84 2HD PRO 84 7.712 10.181 -3.906
618 H TYR 85 H TYR 85 7.809 4.725 -5.640
619 HA TYR 85 HA TYR 85 10.404 5.261 -6.908
620 1HB TYR 85 1HB TYR 85 9.344 2.995 -5.277
621 2HB TYR 85 2HB TYR 85 10.642 2.693 -6.426
622 HD1 TYR 85 HD1 TYR 85 12.582 2.391 -5.167
623 HD2 TYR 85 HD2 TYR 85 9.987 5.628 -4.200
624 HE1 TYR 85 HE1 TYR 85 14.216 3.204 -3.522
625 HE2 TYR 85 HE2 TYR 85 11.618 6.445 -2.553
626 HH TYR 85 HH TYR 85 14.066 6.272 -2.139
627 HA PRO 86 HA PRO 86 8.189 3.803 -10.568
628 1HB PRO 86 1HB PRO 86 9.728 5.005 -12.388
629 2HB PRO 86 2HB PRO 86 8.594 5.933 -11.397
630 1HG PRO 86 1HG PRO 86 11.553 5.614 -11.097
631 2HG PRO 86 2HG PRO 86 10.558 7.069 -10.905
632 1HD PRO 86 1HD PRO 86 11.459 5.493 -8.821
633 2HD PRO 86 2HD PRO 86 10.052 6.571 -8.736
634 H ASP 87 H ASP 87 9.314 1.737 -9.564
635 HA ASP 87 HA ASP 87 10.405 -0.207 -10.001
636 1HB ASP 87 1HB ASP 87 9.759 0.876 -12.527
637 2HB ASP 87 2HB ASP 87 11.366 0.175 -12.638
No H/Q in entry = 637
Start of MODEL 9
1 H1 ILE 1 H1 ILE 1 -16.356 2.841 -0.437
2 H2 ILE 1 H2 ILE 1 -17.693 3.077 0.608
3 H3 ILE 1 H3 ILE 1 -17.262 4.296 -0.521
4 HA ILE 1 HA ILE 1 -16.557 4.956 1.589
5 HB ILE 1 HB ILE 1 -16.283 2.288 2.107
6 1HG1 ILE 1 1HG1 ILE 1 -15.123 4.590 3.677
7 2HG1 ILE 1 2HG1 ILE 1 -16.796 4.045 3.724
8 1HG2 ILE 1 1HG2 ILE 1 -14.008 2.453 0.939
9 2HG2 ILE 1 2HG2 ILE 1 -13.486 3.305 2.393
10 3HG2 ILE 1 3HG2 ILE 1 -14.087 1.652 2.507
11 1HD1 ILE 1 1HD1 ILE 1 -15.480 1.759 4.343
12 2HD1 ILE 1 2HD1 ILE 1 -14.426 2.977 5.062
13 3HD1 ILE 1 3HD1 ILE 1 -16.127 2.902 5.520
14 H VAL 2 H VAL 2 -14.005 5.230 2.224
15 HA VAL 2 HA VAL 2 -12.667 5.775 -0.337
16 HB VAL 2 HB VAL 2 -12.270 7.329 2.221
17 1HG1 VAL 2 1HG1 VAL 2 -10.657 7.169 0.028
18 2HG1 VAL 2 2HG1 VAL 2 -11.662 8.564 -0.365
19 3HG1 VAL 2 3HG1 VAL 2 -10.729 8.542 1.131
20 1HG2 VAL 2 1HG2 VAL 2 -14.595 7.503 1.266
21 2HG2 VAL 2 2HG2 VAL 2 -13.710 9.024 1.387
22 3HG2 VAL 2 3HG2 VAL 2 -13.866 8.216 -0.173
23 H CYS 3 H CYS 3 -10.518 5.269 -0.540
24 HA CYS 3 HA CYS 3 -9.131 4.155 1.779
25 1HB CYS 3 1HB CYS 3 -9.393 2.691 -0.852
26 2HB CYS 3 2HB CYS 3 -8.451 2.155 0.532
27 H HIS 4 H HIS 4 -6.825 3.776 1.343
28 HA HIS 4 HA HIS 4 -5.759 5.978 -0.234
29 1HB HIS 4 1HB HIS 4 -4.283 4.083 1.598
30 2HB HIS 4 2HB HIS 4 -3.694 5.616 0.966
31 HD1 HIS 4 HD1 HIS 4 -5.536 7.680 1.699
32 HD2 HIS 4 HD2 HIS 4 -5.072 4.367 4.161
33 HE1 HIS 4 HE1 HIS 4 -6.359 8.401 3.961
34 HE2 HIS 4 HE2 HIS 4 -5.911 6.431 5.465
35 H THR 5 H THR 5 -4.539 5.755 -2.035
36 HA THR 5 HA THR 5 -3.858 3.019 -2.869
37 HB THR 5 HB THR 5 -5.844 4.371 -4.054
38 HG1 THR 5 HG1 THR 5 -3.983 2.820 -5.511
39 1HG2 THR 5 1HG2 THR 5 -3.409 5.111 -5.660
40 2HG2 THR 5 2HG2 THR 5 -5.084 5.263 -6.197
41 3HG2 THR 5 3HG2 THR 5 -4.504 6.228 -4.838
42 H THR 6 H THR 6 -2.078 2.806 -4.248
43 HA THR 6 HA THR 6 -0.223 5.097 -4.200
44 HB THR 6 HB THR 6 1.518 3.127 -4.276
45 HG1 THR 6 HG1 THR 6 0.221 1.379 -4.275
46 1HG2 THR 6 1HG2 THR 6 0.097 4.074 -1.815
47 2HG2 THR 6 2HG2 THR 6 1.520 3.034 -1.764
48 3HG2 THR 6 3HG2 THR 6 1.627 4.642 -2.479
49 H ALA 7 H ALA 7 -1.938 2.959 -6.159
50 HA ALA 7 HA ALA 7 -0.318 2.252 -8.241
51 1HB ALA 7 1HB ALA 7 -2.564 1.542 -8.293
52 2HB ALA 7 2HB ALA 7 -2.364 2.585 -9.701
53 3HB ALA 7 3HB ALA 7 -3.171 3.197 -8.258
54 H THR 8 H THR 8 -1.457 5.439 -7.430
55 HA THR 8 HA THR 8 -0.631 6.626 -9.932
56 HB THR 8 HB THR 8 -1.747 8.477 -9.239
57 HG1 THR 8 HG1 THR 8 -1.008 8.207 -6.535
58 1HG2 THR 8 1HG2 THR 8 -3.074 6.379 -8.273
59 2HG2 THR 8 2HG2 THR 8 -2.750 7.229 -6.759
60 3HG2 THR 8 3HG2 THR 8 -3.621 8.042 -8.062
61 H SER 9 H SER 9 0.754 8.872 -9.354
62 HA SER 9 HA SER 9 3.348 7.854 -8.757
63 1HB SER 9 1HB SER 9 2.349 10.164 -9.990
64 2HB SER 9 2HB SER 9 3.250 10.734 -8.588
65 HG SER 9 HG SER 9 5.067 9.791 -9.362
66 HA PRO 10 HA PRO 10 2.844 9.930 -4.553
67 1HB PRO 10 1HB PRO 10 0.949 11.910 -4.273
68 2HB PRO 10 2HB PRO 10 2.609 12.190 -4.791
69 1HG PRO 10 1HG PRO 10 0.220 12.524 -6.324
70 2HG PRO 10 2HG PRO 10 1.891 12.748 -6.861
71 1HD PRO 10 1HD PRO 10 0.088 10.423 -7.212
72 2HD PRO 10 2HD PRO 10 1.442 10.961 -8.218
73 H ILE 11 H ILE 11 1.494 9.637 -2.594
74 HA ILE 11 HA ILE 11 -0.603 7.729 -3.090
75 HB ILE 11 HB ILE 11 -0.819 7.746 -0.570
76 1HG1 ILE 11 1HG1 ILE 11 0.460 10.098 -0.662
77 2HG1 ILE 11 2HG1 ILE 11 0.467 9.059 0.756
78 1HG2 ILE 11 1HG2 ILE 11 1.535 6.871 -2.131
79 2HG2 ILE 11 2HG2 ILE 11 1.620 6.731 -0.375
80 3HG2 ILE 11 3HG2 ILE 11 0.331 5.922 -1.263
81 1HD1 ILE 11 1HD1 ILE 11 2.604 8.672 -1.267
82 2HD1 ILE 11 2HD1 ILE 11 2.682 10.091 -0.220
83 3HD1 ILE 11 3HD1 ILE 11 2.651 8.474 0.485
84 H SER 12 H SER 12 -2.719 7.972 -2.883
85 HA SER 12 HA SER 12 -3.898 10.297 -1.640
86 1HB SER 12 1HB SER 12 -5.265 10.421 -3.999
87 2HB SER 12 2HB SER 12 -3.927 11.483 -3.568
88 HG SER 12 HG SER 12 -4.000 9.330 -5.335
89 H ALA 13 H ALA 13 -6.125 10.056 -1.228
90 HA ALA 13 HA ALA 13 -7.141 7.331 -1.702
91 1HB ALA 13 1HB ALA 13 -6.910 8.895 0.743
92 2HB ALA 13 2HB ALA 13 -8.533 8.253 0.487
93 3HB ALA 13 3HB ALA 13 -7.149 7.161 0.526
94 H VAL 14 H VAL 14 -9.321 7.064 -2.205
95 HA VAL 14 HA VAL 14 -10.981 9.443 -2.513
96 HB VAL 14 HB VAL 14 -9.593 8.842 -4.683
97 1HG1 VAL 14 1HG1 VAL 14 -10.655 6.466 -4.523
98 2HG1 VAL 14 2HG1 VAL 14 -12.041 7.245 -5.286
99 3HG1 VAL 14 3HG1 VAL 14 -10.472 7.243 -6.098
100 1HG2 VAL 14 1HG2 VAL 14 -11.791 10.364 -4.136
101 2HG2 VAL 14 2HG2 VAL 14 -10.943 10.323 -5.683
102 3HG2 VAL 14 3HG2 VAL 14 -12.373 9.320 -5.433
103 H THR 15 H THR 15 -13.091 8.630 -3.743
104 HA THR 15 HA THR 15 -14.172 6.505 -2.076
105 HB THR 15 HB THR 15 -16.055 7.709 -3.914
106 HG1 THR 15 HG1 THR 15 -14.703 9.514 -2.202
107 1HG2 THR 15 1HG2 THR 15 -16.612 6.644 -1.745
108 2HG2 THR 15 2HG2 THR 15 -15.863 8.020 -0.935
109 3HG2 THR 15 3HG2 THR 15 -17.284 8.262 -1.950
110 H CYS 16 H CYS 16 -13.755 4.541 -2.915
111 HA CYS 16 HA CYS 16 -13.239 3.777 -5.467
112 1HB CYS 16 1HB CYS 16 -14.903 2.091 -3.609
113 2HB CYS 16 2HB CYS 16 -13.793 1.553 -4.857
114 HA PRO 17 HA PRO 17 -16.839 4.363 -7.959
115 1HB PRO 17 1HB PRO 17 -16.112 1.848 -9.268
116 2HB PRO 17 2HB PRO 17 -16.292 3.452 -9.963
117 1HG PRO 17 1HG PRO 17 -13.881 2.290 -9.611
118 2HG PRO 17 2HG PRO 17 -14.126 4.041 -9.509
119 1HD PRO 17 1HD PRO 17 -13.685 2.063 -7.338
120 2HD PRO 17 2HD PRO 17 -13.240 3.777 -7.421
121 HA PRO 18 HA PRO 18 -20.020 1.614 -6.592
122 1HB PRO 18 1HB PRO 18 -21.378 0.806 -8.805
123 2HB PRO 18 2HB PRO 18 -21.495 2.440 -8.145
124 1HG PRO 18 1HG PRO 18 -19.872 1.437 -10.447
125 2HG PRO 18 2HG PRO 18 -20.805 2.938 -10.304
126 1HD PRO 18 1HD PRO 18 -18.115 2.846 -10.004
127 2HD PRO 18 2HD PRO 18 -19.135 4.011 -9.139
128 H GLY 19 H GLY 19 -17.863 0.193 -6.322
129 1HA GLY 19 1HA GLY 19 -17.220 -1.983 -7.812
130 2HA GLY 19 2HA GLY 19 -18.685 -2.489 -6.987
131 H GLU 20 H GLU 20 -15.990 -0.476 -5.792
132 HA GLU 20 HA GLU 20 -15.341 -2.625 -3.886
133 1HB GLU 20 1HB GLU 20 -13.685 -0.214 -4.534
134 2HB GLU 20 2HB GLU 20 -13.185 -1.645 -3.655
135 1HG GLU 20 1HG GLU 20 -13.489 -1.211 -6.563
136 2HG GLU 20 2HG GLU 20 -12.259 -2.094 -5.668
137 H ASN 21 H ASN 21 -15.197 -2.259 -1.745
138 HA ASN 21 HA ASN 21 -16.086 0.335 -0.718
139 1HB ASN 21 1HB ASN 21 -17.540 -2.108 -0.656
140 2HB ASN 21 2HB ASN 21 -17.138 -1.634 0.983
141 2HD2 ASN 21 2HD2 ASN 21 -19.635 -1.653 0.669
142 1HD2 ASN 21 1HD2 ASN 21 -20.314 -0.099 0.378
143 H LEU 22 H LEU 22 -14.014 -2.369 -0.472
144 HA LEU 22 HA LEU 22 -13.187 -1.628 2.237
145 1HB LEU 22 1HB LEU 22 -12.519 -4.051 0.578
146 2HB LEU 22 2HB LEU 22 -12.006 -3.773 2.225
147 HG LEU 22 HG LEU 22 -14.924 -3.786 1.602
148 1HD1 LEU 22 1HD1 LEU 22 -13.553 -5.850 0.678
149 2HD1 LEU 22 2HD1 LEU 22 -13.633 -6.343 2.369
150 3HD1 LEU 22 3HD1 LEU 22 -15.118 -6.046 1.466
151 1HD2 LEU 22 1HD2 LEU 22 -14.139 -3.118 3.827
152 2HD2 LEU 22 2HD2 LEU 22 -15.080 -4.608 3.882
153 3HD2 LEU 22 3HD2 LEU 22 -13.321 -4.671 3.998
154 H CYS 23 H CYS 23 -10.795 -1.897 2.659
155 HA CYS 23 HA CYS 23 -9.237 -0.648 0.486
156 1HB CYS 23 1HB CYS 23 -8.644 -0.360 3.428
157 2HB CYS 23 2HB CYS 23 -8.027 0.614 2.100
158 H TYR 24 H TYR 24 -6.829 -1.073 0.694
159 HA TYR 24 HA TYR 24 -6.142 -3.494 2.114
160 1HB TYR 24 1HB TYR 24 -5.611 -4.872 0.327
161 2HB TYR 24 2HB TYR 24 -7.115 -4.129 -0.185
162 HD1 TYR 24 HD1 TYR 24 -3.408 -3.440 -0.500
163 HD2 TYR 24 HD2 TYR 24 -7.240 -3.462 -2.368
164 HE1 TYR 24 HE1 TYR 24 -2.374 -2.776 -2.618
165 HE2 TYR 24 HE2 TYR 24 -6.206 -2.788 -4.492
166 HH TYR 24 HH TYR 24 -4.046 -1.544 -5.177
167 H ARG 25 H ARG 25 -4.046 -3.691 2.597
168 HA ARG 25 HA ARG 25 -2.149 -1.753 1.466
169 1HB ARG 25 1HB ARG 25 -3.187 -1.422 3.952
170 2HB ARG 25 2HB ARG 25 -1.810 -2.448 4.324
171 1HG ARG 25 1HG ARG 25 -0.625 -0.636 2.729
172 2HG ARG 25 2HG ARG 25 -1.903 0.354 3.435
173 1HD ARG 25 1HD ARG 25 -0.077 -1.361 5.097
174 2HD ARG 25 2HD ARG 25 0.321 0.298 4.663
175 HE ARG 25 HE ARG 25 -1.467 1.056 6.000
176 1HH1 ARG 25 1HH1 ARG 25 -1.066 -2.416 6.163
177 2HH1 ARG 25 2HH1 ARG 25 -1.986 -2.572 7.619
178 1HH2 ARG 25 1HH2 ARG 25 -2.674 0.838 7.914
179 2HH2 ARG 25 2HH2 ARG 25 -2.897 -0.732 8.612
180 H LYS 26 H LYS 26 -0.681 -2.973 0.432
181 HA LYS 26 HA LYS 26 -0.118 -5.661 1.404
182 1HB LYS 26 1HB LYS 26 -0.472 -5.198 -1.021
183 2HB LYS 26 2HB LYS 26 1.018 -4.281 -1.020
184 1HG LYS 26 1HG LYS 26 2.282 -6.253 -0.444
185 2HG LYS 26 2HG LYS 26 0.796 -7.193 -0.308
186 1HD LYS 26 1HD LYS 26 0.674 -6.040 -2.840
187 2HD LYS 26 2HD LYS 26 2.358 -6.535 -2.654
188 1HE LYS 26 1HE LYS 26 1.547 -8.508 -3.407
189 2HE LYS 26 2HE LYS 26 1.151 -8.727 -1.703
190 1HZ LYS 26 1HZ LYS 26 -0.773 -7.480 -3.562
191 2HZ LYS 26 2HZ LYS 26 -0.661 -9.162 -3.427
192 3HZ LYS 26 3HZ LYS 26 -1.070 -8.231 -2.075
193 H MET 27 H MET 27 1.787 -6.371 2.192
194 HA MET 27 HA MET 27 4.036 -4.533 2.354
195 1HB MET 27 1HB MET 27 2.614 -5.685 4.739
196 2HB MET 27 2HB MET 27 4.270 -5.106 4.822
197 1HG MET 27 1HG MET 27 3.613 -2.997 4.993
198 2HG MET 27 2HG MET 27 2.552 -3.145 3.595
199 1HE MET 27 1HE MET 27 2.024 -1.260 5.973
200 2HE MET 27 2HE MET 27 0.895 -1.811 7.210
201 3HE MET 27 3HE MET 27 2.587 -2.302 7.280
202 H TRP 28 H TRP 28 6.000 -5.481 2.408
203 HA TRP 28 HA TRP 28 6.448 -8.156 3.230
204 1HB TRP 28 1HB TRP 28 7.236 -8.912 0.859
205 2HB TRP 28 2HB TRP 28 5.552 -9.070 1.308
206 HD1 TRP 28 HD1 TRP 28 4.050 -6.769 0.438
207 HE1 TRP 28 HE1 TRP 28 4.089 -5.750 -1.923
208 HE3 TRP 28 HE3 TRP 28 8.529 -8.623 -1.149
209 HZ2 TRP 28 HZ2 TRP 28 5.798 -5.747 -4.170
210 HZ3 TRP 28 HZ3 TRP 28 9.294 -8.074 -3.422
211 HH2 TRP 28 HH2 TRP 28 7.955 -6.667 -4.901
212 H CYS 29 H CYS 29 8.406 -7.392 0.493
213 HA CYS 29 HA CYS 29 10.224 -5.851 2.132
214 1HB CYS 29 1HB CYS 29 10.832 -8.511 1.010
215 2HB CYS 29 2HB CYS 29 12.076 -7.305 0.953
216 H ASP 30 H ASP 30 11.049 -4.192 1.119
217 HA ASP 30 HA ASP 30 10.571 -3.752 -1.670
218 1HB ASP 30 1HB ASP 30 12.674 -2.073 -0.856
219 2HB ASP 30 2HB ASP 30 11.025 -1.626 -1.136
220 H ALA 31 H ALA 31 11.873 -4.148 -3.281
221 HA ALA 31 HA ALA 31 13.492 -6.235 -3.490
222 1HB ALA 31 1HB ALA 31 14.149 -5.490 -5.558
223 2HB ALA 31 2HB ALA 31 12.748 -4.460 -5.261
224 3HB ALA 31 3HB ALA 31 14.376 -3.829 -5.010
225 H PHE 32 H PHE 32 14.346 -5.921 -1.240
226 HA PHE 32 HA PHE 32 17.127 -5.748 -1.386
227 1HB PHE 32 1HB PHE 32 15.908 -3.284 -1.108
228 2HB PHE 32 2HB PHE 32 16.400 -3.689 0.523
229 HD1 PHE 32 HD1 PHE 32 18.894 -4.933 0.412
230 HD2 PHE 32 HD2 PHE 32 17.394 -1.924 -2.195
231 HE1 PHE 32 HE1 PHE 32 21.198 -4.273 -0.148
232 HE2 PHE 32 HE2 PHE 32 19.693 -1.255 -2.755
233 HZ PHE 32 HZ PHE 32 21.599 -2.432 -1.733
234 H CYS 33 H CYS 33 14.168 -5.856 0.550
235 HA CYS 33 HA CYS 33 13.811 -6.584 2.707
236 1HB CYS 33 1HB CYS 33 13.996 -8.562 0.929
237 2HB CYS 33 2HB CYS 33 15.318 -9.047 1.984
238 H SER 34 H SER 34 16.089 -4.986 2.579
239 HA SER 34 HA SER 34 17.396 -5.646 5.017
240 1HB SER 34 1HB SER 34 18.952 -5.898 2.432
241 2HB SER 34 2HB SER 34 19.723 -5.665 4.001
242 HG SER 34 HG SER 34 18.861 -7.929 2.912
243 H SER 35 H SER 35 18.547 -3.925 2.109
244 HA SER 35 HA SER 35 19.102 -1.543 3.570
245 1HB SER 35 1HB SER 35 20.187 -2.339 1.369
246 2HB SER 35 2HB SER 35 18.772 -1.650 0.576
247 HG SER 35 HG SER 35 20.715 -0.329 2.151
248 H ARG 36 H ARG 36 16.716 -2.120 0.941
249 HA ARG 36 HA ARG 36 15.198 0.175 1.671
250 1HB ARG 36 1HB ARG 36 14.187 -2.142 0.010
251 2HB ARG 36 2HB ARG 36 13.593 -0.521 0.023
252 1HG ARG 36 1HG ARG 36 15.597 -1.648 -1.650
253 2HG ARG 36 2HG ARG 36 14.783 -0.101 -1.760
254 1HD ARG 36 1HD ARG 36 17.302 -0.725 -0.227
255 2HD ARG 36 2HD ARG 36 17.150 0.264 -1.670
256 HE ARG 36 HE ARG 36 16.648 1.069 1.035
257 1HH1 ARG 36 1HH1 ARG 36 15.908 1.702 -2.314
258 2HH1 ARG 36 2HH1 ARG 36 15.467 3.353 -2.032
259 1HH2 ARG 36 1HH2 ARG 36 16.063 3.238 1.407
260 2HH2 ARG 36 2HH2 ARG 36 15.550 4.224 0.079
261 H GLY 37 H GLY 37 13.971 -3.272 1.609
262 1HA GLY 37 1HA GLY 37 12.944 -2.570 4.325
263 2HA GLY 37 2HA GLY 37 13.714 -4.107 4.010
264 H LYS 38 H LYS 38 10.823 -2.833 4.643
265 HA LYS 38 HA LYS 38 9.476 -5.034 3.345
266 1HB LYS 38 1HB LYS 38 7.762 -3.378 4.959
267 2HB LYS 38 2HB LYS 38 8.101 -5.094 5.069
268 1HG LYS 38 1HG LYS 38 10.355 -4.232 6.135
269 2HG LYS 38 2HG LYS 38 9.364 -2.817 6.495
270 1HD LYS 38 1HD LYS 38 9.263 -4.320 8.366
271 2HD LYS 38 2HD LYS 38 7.696 -4.331 7.554
272 1HE LYS 38 1HE LYS 38 7.860 -6.504 7.054
273 2HE LYS 38 2HE LYS 38 9.525 -6.334 6.501
274 1HZ LYS 38 1HZ LYS 38 10.026 -6.187 9.020
275 2HZ LYS 38 2HZ LYS 38 8.520 -6.936 9.199
276 3HZ LYS 38 3HZ LYS 38 9.746 -7.700 8.318
277 H VAL 39 H VAL 39 8.069 -4.885 1.722
278 HA VAL 39 HA VAL 39 7.865 -2.459 0.253
279 HB VAL 39 HB VAL 39 6.530 -5.142 -0.027
280 1HG1 VAL 39 1HG1 VAL 39 5.954 -2.627 -1.570
281 2HG1 VAL 39 2HG1 VAL 39 5.677 -4.229 -2.250
282 3HG1 VAL 39 3HG1 VAL 39 4.813 -3.728 -0.796
283 1HG2 VAL 39 1HG2 VAL 39 8.946 -4.021 -0.917
284 2HG2 VAL 39 2HG2 VAL 39 8.268 -5.594 -1.322
285 3HG2 VAL 39 3HG2 VAL 39 7.917 -4.195 -2.334
286 H VAL 40 H VAL 40 5.998 -1.230 -0.210
287 HA VAL 40 HA VAL 40 3.743 -1.545 1.631
288 HB VAL 40 HB VAL 40 5.144 1.084 1.124
289 1HG1 VAL 40 1HG1 VAL 40 2.583 0.346 2.445
290 2HG1 VAL 40 2HG1 VAL 40 3.538 1.665 3.125
291 3HG1 VAL 40 3HG1 VAL 40 2.980 1.752 1.454
292 1HG2 VAL 40 1HG2 VAL 40 5.032 -0.663 3.574
293 2HG2 VAL 40 2HG2 VAL 40 6.459 -0.247 2.626
294 3HG2 VAL 40 3HG2 VAL 40 5.626 0.997 3.560
295 H GLU 41 H GLU 41 2.081 -1.895 0.331
296 HA GLU 41 HA GLU 41 1.802 -0.237 -2.088
297 1HB GLU 41 1HB GLU 41 1.974 -2.939 -2.076
298 2HB GLU 41 2HB GLU 41 0.234 -2.738 -1.910
299 1HG GLU 41 1HG GLU 41 0.123 -2.494 -4.103
300 2HG GLU 41 2HG GLU 41 0.982 -0.965 -3.924
301 H LEU 42 H LEU 42 -0.445 0.268 -2.681
302 HA LEU 42 HA LEU 42 -2.337 0.208 -0.460
303 1HB LEU 42 1HB LEU 42 -0.799 2.487 -1.234
304 2HB LEU 42 2HB LEU 42 -2.482 2.801 -1.600
305 HG LEU 42 HG LEU 42 -3.110 2.415 0.693
306 1HD1 LEU 42 1HD1 LEU 42 -0.271 1.514 0.947
307 2HD1 LEU 42 2HD1 LEU 42 -1.144 2.131 2.349
308 3HD1 LEU 42 3HD1 LEU 42 -1.749 0.718 1.485
309 1HD2 LEU 42 1HD2 LEU 42 -2.215 4.647 -0.020
310 2HD2 LEU 42 2HD2 LEU 42 -2.097 4.315 1.708
311 3HD2 LEU 42 3HD2 LEU 42 -0.668 4.175 0.683
312 H GLY 43 H GLY 43 -4.482 0.369 -1.039
313 1HA GLY 43 1HA GLY 43 -5.166 -0.516 -3.639
314 2HA GLY 43 2HA GLY 43 -5.499 1.201 -3.492
315 H CYS 44 H CYS 44 -7.658 -0.036 -4.015
316 HA CYS 44 HA CYS 44 -8.966 -0.729 -1.478
317 1HB CYS 44 1HB CYS 44 -10.259 1.083 -1.576
318 2HB CYS 44 2HB CYS 44 -9.362 1.630 -2.982
319 H ALA 45 H ALA 45 -10.694 -2.206 -1.622
320 HA ALA 45 HA ALA 45 -11.336 -3.322 -4.239
321 1HB ALA 45 1HB ALA 45 -9.356 -4.574 -3.454
322 2HB ALA 45 2HB ALA 45 -10.788 -5.590 -3.623
323 3HB ALA 45 3HB ALA 45 -10.263 -5.063 -2.023
324 H ALA 46 H ALA 46 -12.828 -5.414 -3.693
325 HA ALA 46 HA ALA 46 -14.938 -4.347 -1.946
326 1HB ALA 46 1HB ALA 46 -16.487 -5.721 -3.263
327 2HB ALA 46 2HB ALA 46 -15.587 -4.590 -4.273
328 3HB ALA 46 3HB ALA 46 -15.135 -6.294 -4.240
329 H THR 47 H THR 47 -12.828 -7.046 -2.465
330 HA THR 47 HA THR 47 -13.930 -8.323 -0.061
331 HB THR 47 HB THR 47 -14.745 -9.600 -1.968
332 HG1 THR 47 HG1 THR 47 -13.890 -11.598 -1.371
333 1HG2 THR 47 1HG2 THR 47 -12.301 -9.003 -3.163
334 2HG2 THR 47 2HG2 THR 47 -12.281 -10.744 -2.882
335 3HG2 THR 47 3HG2 THR 47 -13.594 -10.014 -3.806
336 H CYS 48 H CYS 48 -12.222 -10.319 0.372
337 HA CYS 48 HA CYS 48 -9.685 -8.920 0.745
338 1HB CYS 48 1HB CYS 48 -11.220 -10.815 2.301
339 2HB CYS 48 2HB CYS 48 -9.550 -11.331 2.135
340 HA PRO 49 HA PRO 49 -8.236 -11.521 -2.674
341 1HB PRO 49 1HB PRO 49 -5.710 -10.468 -2.707
342 2HB PRO 49 2HB PRO 49 -7.090 -9.752 -3.542
343 1HG PRO 49 1HG PRO 49 -5.884 -9.024 -0.903
344 2HG PRO 49 2HG PRO 49 -6.486 -7.964 -2.191
345 1HD PRO 49 1HD PRO 49 -7.925 -8.467 0.025
346 2HD PRO 49 2HD PRO 49 -8.694 -8.239 -1.559
347 H SER 50 H SER 50 -6.665 -13.188 -2.900
348 HA SER 50 HA SER 50 -6.124 -14.581 -0.480
349 1HB SER 50 1HB SER 50 -4.748 -16.067 -2.131
350 2HB SER 50 2HB SER 50 -6.504 -16.011 -2.281
351 HG SER 50 HG SER 50 -6.005 -15.529 -4.280
352 H LYS 51 H LYS 51 -3.848 -15.537 -0.129
353 HA LYS 51 HA LYS 51 -1.993 -13.285 -0.004
354 1HB LYS 51 1HB LYS 51 -1.276 -15.801 1.312
355 2HB LYS 51 2HB LYS 51 -1.119 -14.157 1.886
356 1HG LYS 51 1HG LYS 51 -2.873 -14.458 3.191
357 2HG LYS 51 2HG LYS 51 -3.883 -14.734 1.774
358 1HD LYS 51 1HD LYS 51 -4.066 -16.609 3.299
359 2HD LYS 51 2HD LYS 51 -3.251 -17.116 1.818
360 1HE LYS 51 1HE LYS 51 -1.103 -16.453 3.227
361 2HE LYS 51 2HE LYS 51 -2.183 -16.811 4.573
362 1HZ LYS 51 1HZ LYS 51 -2.640 -18.957 3.205
363 2HZ LYS 51 2HZ LYS 51 -1.143 -18.611 2.498
364 3HZ LYS 51 3HZ LYS 51 -1.254 -18.850 4.169
365 H LYS 52 H LYS 52 0.378 -13.875 -0.189
366 HA LYS 52 HA LYS 52 0.873 -15.956 -2.185
367 1HB LYS 52 1HB LYS 52 1.697 -13.064 -2.499
368 2HB LYS 52 2HB LYS 52 2.246 -14.379 -3.527
369 1HG LYS 52 1HG LYS 52 -0.627 -14.348 -3.375
370 2HG LYS 52 2HG LYS 52 -0.008 -12.774 -3.878
371 1HD LYS 52 1HD LYS 52 1.081 -15.251 -5.142
372 2HD LYS 52 2HD LYS 52 -0.495 -14.640 -5.651
373 1HE LYS 52 1HE LYS 52 2.094 -13.092 -5.659
374 2HE LYS 52 2HE LYS 52 1.297 -13.780 -7.073
375 1HZ LYS 52 1HZ LYS 52 -0.675 -12.314 -6.064
376 2HZ LYS 52 2HZ LYS 52 0.648 -11.389 -5.558
377 3HZ LYS 52 3HZ LYS 52 0.428 -11.723 -7.201
378 HA PRO 53 HA PRO 53 4.477 -16.599 0.292
379 1HB PRO 53 1HB PRO 53 6.049 -17.949 -1.431
380 2HB PRO 53 2HB PRO 53 4.582 -18.658 -0.746
381 1HG PRO 53 1HG PRO 53 5.005 -17.412 -3.434
382 2HG PRO 53 2HG PRO 53 4.125 -18.893 -3.014
383 1HD PRO 53 1HD PRO 53 2.898 -16.503 -3.487
384 2HD PRO 53 2HD PRO 53 2.234 -17.742 -2.403
385 H TYR 54 H TYR 54 4.526 -14.017 -0.332
386 HA TYR 54 HA TYR 54 7.168 -13.265 -0.340
387 1HB TYR 54 1HB TYR 54 6.381 -13.985 -2.939
388 2HB TYR 54 2HB TYR 54 6.530 -12.236 -2.916
389 HD1 TYR 54 HD1 TYR 54 8.262 -15.185 -3.503
390 HD2 TYR 54 HD2 TYR 54 8.740 -11.395 -1.630
391 HE1 TYR 54 HE1 TYR 54 10.703 -15.398 -3.708
392 HE2 TYR 54 HE2 TYR 54 11.183 -11.598 -1.830
393 HH TYR 54 HH TYR 54 12.827 -12.791 -3.186
394 H GLU 55 H GLU 55 3.917 -12.428 -1.341
395 HA GLU 55 HA GLU 55 4.262 -9.817 -0.046
396 1HB GLU 55 1HB GLU 55 2.578 -10.021 -2.514
397 2HB GLU 55 2HB GLU 55 3.332 -8.604 -1.798
398 1HG GLU 55 1HG GLU 55 5.476 -9.241 -2.603
399 2HG GLU 55 2HG GLU 55 4.884 -10.824 -3.101
400 H GLU 56 H GLU 56 2.821 -9.574 1.512
401 HA GLU 56 HA GLU 56 0.267 -11.027 1.318
402 1HB GLU 56 1HB GLU 56 2.104 -10.442 3.577
403 2HB GLU 56 2HB GLU 56 0.383 -10.416 3.924
404 1HG GLU 56 1HG GLU 56 0.197 -12.639 3.797
405 2HG GLU 56 2HG GLU 56 1.251 -12.746 2.387
406 H VAL 57 H VAL 57 -1.635 -9.950 2.142
407 HA VAL 57 HA VAL 57 -1.409 -7.028 2.295
408 HB VAL 57 HB VAL 57 -3.819 -7.318 1.066
409 1HG1 VAL 57 1HG1 VAL 57 -2.011 -5.688 0.595
410 2HG1 VAL 57 2HG1 VAL 57 -1.208 -6.922 -0.375
411 3HG1 VAL 57 3HG1 VAL 57 -2.794 -6.318 -0.854
412 1HG2 VAL 57 1HG2 VAL 57 -3.115 -9.767 0.690
413 2HG2 VAL 57 2HG2 VAL 57 -3.780 -8.859 -0.668
414 3HG2 VAL 57 3HG2 VAL 57 -2.038 -9.106 -0.540
415 H THR 58 H THR 58 -3.241 -5.970 3.255
416 HA THR 58 HA THR 58 -4.899 -7.696 4.957
417 HB THR 58 HB THR 58 -4.592 -5.437 6.474
418 HG1 THR 58 HG1 THR 58 -2.853 -4.861 4.954
419 1HG2 THR 58 1HG2 THR 58 -4.347 -7.921 7.085
420 2HG2 THR 58 2HG2 THR 58 -2.629 -7.664 6.781
421 3HG2 THR 58 3HG2 THR 58 -3.455 -6.721 8.022
422 H CYS 59 H CYS 59 -6.999 -7.287 4.672
423 HA CYS 59 HA CYS 59 -7.748 -4.739 3.420
424 1HB CYS 59 1HB CYS 59 -9.933 -6.569 3.387
425 2HB CYS 59 2HB CYS 59 -9.009 -5.946 2.035
426 H CYS 60 H CYS 60 -9.521 -3.536 4.230
427 HA CYS 60 HA CYS 60 -10.728 -4.426 6.731
428 1HB CYS 60 1HB CYS 60 -10.174 -2.410 7.923
429 2HB CYS 60 2HB CYS 60 -8.679 -3.107 7.308
430 H SER 61 H SER 61 -12.089 -2.227 7.450
431 HA SER 61 HA SER 61 -13.441 -1.104 5.140
432 1HB SER 61 1HB SER 61 -15.559 -1.998 5.538
433 2HB SER 61 2HB SER 61 -14.513 -3.379 5.868
434 HG SER 61 HG SER 61 -15.968 -3.183 7.547
435 H THR 62 H THR 62 -11.778 -0.083 7.277
436 HA THR 62 HA THR 62 -13.721 1.484 8.842
437 HB THR 62 HB THR 62 -10.825 1.666 9.450
438 HG1 THR 62 HG1 THR 62 -10.652 -0.424 9.498
439 1HG2 THR 62 1HG2 THR 62 -13.188 2.315 10.766
440 2HG2 THR 62 2HG2 THR 62 -12.550 0.910 11.619
441 3HG2 THR 62 3HG2 THR 62 -11.551 2.350 11.421
442 H ASP 63 H ASP 63 -12.562 1.879 5.970
443 HA ASP 63 HA ASP 63 -12.068 3.644 4.622
444 1HB ASP 63 1HB ASP 63 -13.973 4.610 6.110
445 2HB ASP 63 2HB ASP 63 -12.681 5.540 6.855
446 H LYS 64 H LYS 64 -10.411 5.011 4.107
447 HA LYS 64 HA LYS 64 -8.095 5.362 4.134
448 1HB LYS 64 1HB LYS 64 -9.078 7.029 6.457
449 2HB LYS 64 2HB LYS 64 -7.623 7.327 5.520
450 1HG LYS 64 1HG LYS 64 -8.751 8.438 3.968
451 2HG LYS 64 2HG LYS 64 -9.939 7.143 3.810
452 1HD LYS 64 1HD LYS 64 -11.082 9.138 4.497
453 2HD LYS 64 2HD LYS 64 -11.062 8.013 5.857
454 1HE LYS 64 1HE LYS 64 -8.769 9.833 5.767
455 2HE LYS 64 2HE LYS 64 -10.322 10.641 5.970
456 1HZ LYS 64 1HZ LYS 64 -10.023 8.327 7.645
457 2HZ LYS 64 2HZ LYS 64 -8.861 9.515 7.955
458 3HZ LYS 64 3HZ LYS 64 -10.507 9.896 8.048
459 H CYS 65 H CYS 65 -8.657 2.976 5.629
460 HA CYS 65 HA CYS 65 -7.033 3.153 8.026
461 1HB CYS 65 1HB CYS 65 -8.394 1.564 8.774
462 2HB CYS 65 2HB CYS 65 -9.221 1.580 7.229
463 H ASN 66 H ASN 66 -6.428 2.575 4.778
464 HA ASN 66 HA ASN 66 -4.181 0.809 5.396
465 1HB ASN 66 1HB ASN 66 -4.236 0.172 3.063
466 2HB ASN 66 2HB ASN 66 -5.811 -0.064 3.802
467 2HD2 ASN 66 2HD2 ASN 66 -4.387 0.867 1.101
468 1HD2 ASN 66 1HD2 ASN 66 -5.535 2.007 0.496
469 HA PRO 67 HA PRO 67 -2.244 4.802 3.889
470 1HB PRO 67 1HB PRO 67 -1.599 6.091 6.105
471 2HB PRO 67 2HB PRO 67 -3.275 6.107 5.536
472 1HG PRO 67 1HG PRO 67 -2.030 4.471 7.712
473 2HG PRO 67 2HG PRO 67 -3.599 5.295 7.692
474 1HD PRO 67 1HD PRO 67 -3.197 2.593 7.150
475 2HD PRO 67 2HD PRO 67 -4.620 3.537 6.680
476 H HIS 68 H HIS 68 -0.045 5.099 3.643
477 HA HIS 68 HA HIS 68 1.719 3.014 4.163
478 1HB HIS 68 1HB HIS 68 2.062 4.836 2.483
479 2HB HIS 68 2HB HIS 68 2.484 5.918 3.805
480 HD1 HIS 68 HD1 HIS 68 4.623 5.006 5.290
481 HD2 HIS 68 HD2 HIS 68 4.180 3.528 1.433
482 HE1 HIS 68 HE1 HIS 68 6.872 4.071 4.667
483 HE2 HIS 68 HE2 HIS 68 6.606 3.273 2.292
484 HA PRO 69 HA PRO 69 2.371 3.762 8.550
485 1HB PRO 69 1HB PRO 69 3.945 1.624 9.026
486 2HB PRO 69 2HB PRO 69 2.199 1.477 8.795
487 1HG PRO 69 1HG PRO 69 4.415 0.988 6.842
488 2HG PRO 69 2HG PRO 69 2.958 0.024 7.145
489 1HD PRO 69 1HD PRO 69 3.179 1.763 5.065
490 2HD PRO 69 2HD PRO 69 1.634 1.392 5.854
491 H LYS 70 H LYS 70 3.699 5.636 7.410
492 HA LYS 70 HA LYS 70 6.109 5.897 8.779
493 1HB LYS 70 1HB LYS 70 6.618 4.174 6.819
494 2HB LYS 70 2HB LYS 70 6.789 5.653 5.886
495 1HG LYS 70 1HG LYS 70 8.941 4.981 6.686
496 2HG LYS 70 2HG LYS 70 8.454 6.453 7.528
497 1HD LYS 70 1HD LYS 70 7.509 4.233 9.028
498 2HD LYS 70 2HD LYS 70 9.202 3.935 8.627
499 1HE LYS 70 1HE LYS 70 9.885 5.976 9.637
500 2HE LYS 70 2HE LYS 70 8.218 6.528 9.798
501 1HZ LYS 70 1HZ LYS 70 8.127 4.254 11.177
502 2HZ LYS 70 2HZ LYS 70 9.733 4.700 11.466
503 3HZ LYS 70 3HZ LYS 70 8.474 5.754 11.877
504 H GLN 71 H GLN 71 4.177 6.813 6.000
505 HA GLN 71 HA GLN 71 5.269 9.234 5.294
506 1HB GLN 71 1HB GLN 71 3.018 9.881 4.538
507 2HB GLN 71 2HB GLN 71 3.413 8.229 4.083
508 1HG GLN 71 1HG GLN 71 1.795 7.343 5.364
509 2HG GLN 71 2HG GLN 71 2.013 8.529 6.649
510 2HE2 GLN 71 2HE2 GLN 71 -0.313 7.424 4.951
511 1HE2 GLN 71 1HE2 GLN 71 -1.192 8.847 4.521
512 H ARG 72 H ARG 72 4.018 11.406 5.669
513 HA ARG 72 HA ARG 72 4.209 11.938 8.523
514 1HB ARG 72 1HB ARG 72 3.642 14.013 6.426
515 2HB ARG 72 2HB ARG 72 4.456 14.203 7.972
516 1HG ARG 72 1HG ARG 72 6.345 14.167 6.798
517 2HG ARG 72 2HG ARG 72 6.082 12.428 6.658
518 1HD ARG 72 1HD ARG 72 6.542 13.597 4.493
519 2HD ARG 72 2HD ARG 72 5.038 12.677 4.533
520 HE ARG 72 HE ARG 72 4.739 15.462 5.206
521 1HH1 ARG 72 1HH1 ARG 72 4.798 13.119 2.619
522 2HH1 ARG 72 2HH1 ARG 72 3.861 14.100 1.543
523 1HH2 ARG 72 1HH2 ARG 72 3.508 16.752 3.791
524 2HH2 ARG 72 2HH2 ARG 72 3.130 16.163 2.207
525 HA PRO 73 HA PRO 73 -0.134 12.242 9.228
526 1HB PRO 73 1HB PRO 73 -0.265 14.153 11.134
527 2HB PRO 73 2HB PRO 73 0.392 12.543 11.450
528 1HG PRO 73 1HG PRO 73 1.840 15.101 10.883
529 2HG PRO 73 2HG PRO 73 2.200 13.857 12.095
530 1HD PRO 73 1HD PRO 73 3.518 14.035 9.726
531 2HD PRO 73 2HD PRO 73 3.251 12.495 10.566
532 H GLY 74 H GLY 74 -1.485 13.064 7.753
533 1HA GLY 74 1HA GLY 74 -1.105 15.722 6.681
534 2HA GLY 74 2HA GLY 74 -2.540 15.551 7.680
535 H1 TRP 75 H1 TRP 75 4.530 1.493 -10.547
536 H2 TRP 75 H2 TRP 75 6.041 1.248 -11.324
537 H3 TRP 75 H3 TRP 75 5.383 0.020 -10.326
538 HA TRP 75 HA TRP 75 7.116 1.128 -9.190
539 1HB TRP 75 1HB TRP 75 6.807 3.570 -8.677
540 2HB TRP 75 2HB TRP 75 7.108 3.222 -10.375
541 HD1 TRP 75 HD1 TRP 75 4.169 4.122 -8.030
542 HE1 TRP 75 HE1 TRP 75 2.383 5.343 -9.427
543 HE3 TRP 75 HE3 TRP 75 6.292 3.651 -12.656
544 HZ2 TRP 75 HZ2 TRP 75 1.932 6.013 -12.131
545 HZ3 TRP 75 HZ3 TRP 75 5.119 4.608 -14.595
546 HH2 TRP 75 HH2 TRP 75 2.984 5.764 -14.337
547 H ARG 76 H ARG 76 7.015 1.443 -6.898
548 HA ARG 76 HA ARG 76 4.368 1.697 -5.703
549 1HB ARG 76 1HB ARG 76 5.125 -0.422 -4.231
550 2HB ARG 76 2HB ARG 76 4.089 -0.548 -5.643
551 1HG ARG 76 1HG ARG 76 5.751 -2.247 -5.769
552 2HG ARG 76 2HG ARG 76 6.113 -1.039 -7.004
553 1HD ARG 76 1HD ARG 76 8.130 -0.752 -6.147
554 2HD ARG 76 2HD ARG 76 7.430 -0.313 -4.589
555 HE ARG 76 HE ARG 76 8.005 -2.375 -3.811
556 1HH1 ARG 76 1HH1 ARG 76 7.940 -2.490 -7.300
557 2HH1 ARG 76 2HH1 ARG 76 8.599 -4.089 -7.387
558 1HH2 ARG 76 1HH2 ARG 76 8.885 -4.484 -3.930
559 2HH2 ARG 76 2HH2 ARG 76 9.134 -5.219 -5.477
560 H TYR 77 H TYR 77 4.790 1.153 -3.116
561 HA TYR 77 HA TYR 77 7.050 2.930 -2.466
562 1HB TYR 77 1HB TYR 77 4.462 2.451 -0.977
563 2HB TYR 77 2HB TYR 77 5.782 3.444 -0.382
564 HD1 TYR 77 HD1 TYR 77 5.273 5.671 -0.469
565 HD2 TYR 77 HD2 TYR 77 4.008 3.184 -3.680
566 HE1 TYR 77 HE1 TYR 77 4.352 7.636 -1.621
567 HE2 TYR 77 HE2 TYR 77 3.087 5.144 -4.842
568 HH TYR 77 HH TYR 77 3.834 8.269 -4.052
569 H TYR 78 H TYR 78 7.965 2.597 -0.316
570 HA TYR 78 HA TYR 78 7.924 -0.143 0.659
571 1HB TYR 78 1HB TYR 78 10.543 1.264 0.358
572 2HB TYR 78 2HB TYR 78 10.194 -0.450 0.324
573 HD1 TYR 78 HD1 TYR 78 9.878 2.653 -1.628
574 HD2 TYR 78 HD2 TYR 78 9.787 -1.587 -1.730
575 HE1 TYR 78 HE1 TYR 78 9.816 2.709 -4.064
576 HE2 TYR 78 HE2 TYR 78 9.781 -1.545 -4.166
577 HH TYR 78 HH TYR 78 10.375 -0.072 -5.985
578 H GLU 79 H GLU 79 8.503 -0.329 2.845
579 HA GLU 79 HA GLU 79 7.620 1.635 4.544
580 1HB GLU 79 1HB GLU 79 8.112 -0.837 5.020
581 2HB GLU 79 2HB GLU 79 9.753 -0.316 5.377
582 1HG GLU 79 1HG GLU 79 8.907 1.171 7.116
583 2HG GLU 79 2HG GLU 79 7.261 0.653 6.758
584 H SER 80 H SER 80 10.889 1.163 3.336
585 HA SER 80 HA SER 80 11.969 3.204 5.073
586 1HB SER 80 1HB SER 80 14.049 2.474 4.414
587 2HB SER 80 2HB SER 80 13.104 1.013 4.155
588 HG SER 80 HG SER 80 14.585 1.981 2.399
589 H SER 81 H SER 81 10.569 3.091 1.933
590 HA SER 81 HA SER 81 11.562 5.816 1.430
591 1HB SER 81 1HB SER 81 10.958 4.898 -1.068
592 2HB SER 81 2HB SER 81 12.572 4.900 -0.362
593 HG SER 81 HG SER 81 12.244 2.766 0.286
594 H LEU 82 H LEU 82 9.958 7.209 1.697
595 HA LEU 82 HA LEU 82 7.204 6.488 1.491
596 1HB LEU 82 1HB LEU 82 8.761 8.649 2.509
597 2HB LEU 82 2HB LEU 82 7.559 9.315 1.424
598 HG LEU 82 HG LEU 82 7.070 9.047 3.973
599 1HD1 LEU 82 1HD1 LEU 82 5.526 9.362 1.702
600 2HD1 LEU 82 2HD1 LEU 82 4.719 8.069 2.588
601 3HD1 LEU 82 3HD1 LEU 82 5.008 9.624 3.367
602 1HD2 LEU 82 1HD2 LEU 82 7.609 6.541 3.797
603 2HD2 LEU 82 2HD2 LEU 82 6.180 7.029 4.707
604 3HD2 LEU 82 3HD2 LEU 82 6.007 6.396 3.071
605 H GLU 83 H GLU 83 9.554 7.971 -0.622
606 HA GLU 83 HA GLU 83 7.718 9.064 -2.486
607 1HB GLU 83 1HB GLU 83 10.536 8.195 -3.099
608 2HB GLU 83 2HB GLU 83 9.608 9.476 -3.858
609 1HG GLU 83 1HG GLU 83 10.795 10.820 -2.531
610 2HG GLU 83 2HG GLU 83 9.638 10.330 -1.294
611 HA PRO 84 HA PRO 84 6.993 5.463 -4.993
612 1HB PRO 84 1HB PRO 84 6.612 6.772 -7.426
613 2HB PRO 84 2HB PRO 84 5.414 6.665 -6.135
614 1HG PRO 84 1HG PRO 84 6.734 9.004 -7.066
615 2HG PRO 84 2HG PRO 84 5.652 8.866 -5.671
616 1HD PRO 84 1HD PRO 84 8.628 8.862 -5.771
617 2HD PRO 84 2HD PRO 84 7.546 9.442 -4.493
618 H TYR 85 H TYR 85 8.138 3.969 -6.083
619 HA TYR 85 HA TYR 85 10.634 4.841 -7.375
620 1HB TYR 85 1HB TYR 85 9.848 2.488 -5.750
621 2HB TYR 85 2HB TYR 85 11.184 2.331 -6.861
622 HD1 TYR 85 HD1 TYR 85 12.362 1.758 -4.561
623 HD2 TYR 85 HD2 TYR 85 10.930 5.656 -5.577
624 HE1 TYR 85 HE1 TYR 85 13.833 2.747 -2.874
625 HE2 TYR 85 HE2 TYR 85 12.412 6.636 -3.886
626 HH TYR 85 HH TYR 85 14.613 5.952 -2.737
627 HA PRO 86 HA PRO 86 8.831 3.181 -11.142
628 1HB PRO 86 1HB PRO 86 10.971 3.583 -12.743
629 2HB PRO 86 2HB PRO 86 9.909 4.901 -12.234
630 1HG PRO 86 1HG PRO 86 12.570 4.079 -11.132
631 2HG PRO 86 2HG PRO 86 11.959 5.707 -11.483
632 1HD PRO 86 1HD PRO 86 11.986 4.661 -8.981
633 2HD PRO 86 2HD PRO 86 10.750 5.813 -9.526
634 H ASP 87 H ASP 87 8.615 1.000 -10.937
635 HA ASP 87 HA ASP 87 11.061 -0.629 -11.154
636 1HB ASP 87 1HB ASP 87 9.861 -2.413 -10.003
637 2HB ASP 87 2HB ASP 87 9.832 -0.943 -9.035
No H/Q in entry = 637
Start of MODEL 10
1 H1 ILE 1 H1 ILE 1 -16.277 3.823 0.262
2 H2 ILE 1 H2 ILE 1 -17.278 3.686 1.650
3 H3 ILE 1 H3 ILE 1 -17.342 5.101 0.685
4 HA ILE 1 HA ILE 1 -16.096 5.791 2.399
5 HB ILE 1 HB ILE 1 -15.887 3.195 3.075
6 1HG1 ILE 1 1HG1 ILE 1 -13.852 5.016 4.265
7 2HG1 ILE 1 2HG1 ILE 1 -15.542 5.502 4.337
8 1HG2 ILE 1 1HG2 ILE 1 -13.956 3.045 1.375
9 2HG2 ILE 1 2HG2 ILE 1 -13.013 3.870 2.616
10 3HG2 ILE 1 3HG2 ILE 1 -13.752 2.308 2.964
11 1HD1 ILE 1 1HD1 ILE 1 -14.904 2.746 5.189
12 2HD1 ILE 1 2HD1 ILE 1 -14.370 4.062 6.234
13 3HD1 ILE 1 3HD1 ILE 1 -16.079 3.894 5.831
14 H VAL 2 H VAL 2 -13.481 5.971 2.630
15 HA VAL 2 HA VAL 2 -12.494 6.306 -0.118
16 HB VAL 2 HB VAL 2 -11.870 8.086 2.245
17 1HG1 VAL 2 1HG1 VAL 2 -10.355 7.660 -0.007
18 2HG1 VAL 2 2HG1 VAL 2 -11.303 9.084 -0.435
19 3HG1 VAL 2 3HG1 VAL 2 -10.300 9.096 1.015
20 1HG2 VAL 2 1HG2 VAL 2 -13.855 8.300 0.025
21 2HG2 VAL 2 2HG2 VAL 2 -14.038 8.681 1.738
22 3HG2 VAL 2 3HG2 VAL 2 -13.122 9.761 0.687
23 H CYS 3 H CYS 3 -10.523 5.507 -0.585
24 HA CYS 3 HA CYS 3 -8.867 4.532 1.649
25 1HB CYS 3 1HB CYS 3 -9.318 3.133 -0.998
26 2HB CYS 3 2HB CYS 3 -8.267 2.569 0.294
27 H HIS 4 H HIS 4 -6.593 4.117 0.999
28 HA HIS 4 HA HIS 4 -5.641 6.357 -0.610
29 1HB HIS 4 1HB HIS 4 -4.055 4.474 1.140
30 2HB HIS 4 2HB HIS 4 -3.495 5.992 0.447
31 HD1 HIS 4 HD1 HIS 4 -5.243 8.091 1.269
32 HD2 HIS 4 HD2 HIS 4 -4.702 4.797 3.737
33 HE1 HIS 4 HE1 HIS 4 -5.915 8.848 3.566
34 HE2 HIS 4 HE2 HIS 4 -5.356 6.904 5.066
35 H THR 5 H THR 5 -4.504 6.147 -2.466
36 HA THR 5 HA THR 5 -3.947 3.410 -3.392
37 HB THR 5 HB THR 5 -5.839 4.975 -4.495
38 HG1 THR 5 HG1 THR 5 -5.437 2.832 -5.066
39 1HG2 THR 5 1HG2 THR 5 -3.372 5.513 -6.134
40 2HG2 THR 5 2HG2 THR 5 -5.036 5.861 -6.617
41 3HG2 THR 5 3HG2 THR 5 -4.319 6.713 -5.248
42 H THR 6 H THR 6 -2.184 3.148 -4.795
43 HA THR 6 HA THR 6 -0.239 5.359 -4.804
44 HB THR 6 HB THR 6 1.503 3.475 -4.584
45 HG1 THR 6 HG1 THR 6 0.088 1.729 -4.756
46 1HG2 THR 6 1HG2 THR 6 -0.064 4.774 -2.484
47 2HG2 THR 6 2HG2 THR 6 0.813 3.329 -1.980
48 3HG2 THR 6 3HG2 THR 6 1.682 4.678 -2.711
49 H ALA 7 H ALA 7 -2.081 3.475 -6.715
50 HA ALA 7 HA ALA 7 -0.310 2.431 -8.635
51 1HB ALA 7 1HB ALA 7 -2.476 1.578 -8.705
52 2HB ALA 7 2HB ALA 7 -2.380 2.594 -10.144
53 3HB ALA 7 3HB ALA 7 -3.210 3.181 -8.703
54 H THR 8 H THR 8 -1.356 5.656 -8.033
55 HA THR 8 HA THR 8 -0.665 6.601 -10.697
56 HB THR 8 HB THR 8 -1.830 8.484 -10.183
57 HG1 THR 8 HG1 THR 8 -1.051 8.428 -7.469
58 1HG2 THR 8 1HG2 THR 8 -3.112 6.440 -9.088
59 2HG2 THR 8 2HG2 THR 8 -2.810 7.376 -7.621
60 3HG2 THR 8 3HG2 THR 8 -3.699 8.099 -8.965
61 H SER 9 H SER 9 0.566 9.003 -10.279
62 HA SER 9 HA SER 9 3.237 8.197 -9.703
63 1HB SER 9 1HB SER 9 2.046 10.371 -11.019
64 2HB SER 9 2HB SER 9 2.953 11.069 -9.678
65 HG SER 9 HG SER 9 3.854 9.956 -11.982
66 HA PRO 10 HA PRO 10 2.686 10.457 -5.601
67 1HB PRO 10 1HB PRO 10 0.577 12.256 -5.398
68 2HB PRO 10 2HB PRO 10 2.231 12.667 -5.839
69 1HG PRO 10 1HG PRO 10 -0.058 12.855 -7.491
70 2HG PRO 10 2HG PRO 10 1.630 13.041 -7.994
71 1HD PRO 10 1HD PRO 10 -0.156 10.664 -8.186
72 2HD PRO 10 2HD PRO 10 1.137 11.192 -9.275
73 H ILE 11 H ILE 11 1.622 9.851 -3.662
74 HA ILE 11 HA ILE 11 -0.532 7.984 -4.056
75 HB ILE 11 HB ILE 11 -0.296 7.442 -1.724
76 1HG1 ILE 11 1HG1 ILE 11 1.680 9.722 -1.595
77 2HG1 ILE 11 2HG1 ILE 11 0.096 9.683 -0.822
78 1HG2 ILE 11 1HG2 ILE 11 1.340 6.647 -3.511
79 2HG2 ILE 11 2HG2 ILE 11 2.488 7.765 -2.772
80 3HG2 ILE 11 3HG2 ILE 11 1.810 6.442 -1.823
81 1HD1 ILE 11 1HD1 ILE 11 1.575 7.371 -0.066
82 2HD1 ILE 11 2HD1 ILE 11 2.548 8.815 0.217
83 3HD1 ILE 11 3HD1 ILE 11 0.947 8.674 0.944
84 H SER 12 H SER 12 -2.617 8.321 -3.763
85 HA SER 12 HA SER 12 -3.502 10.586 -2.125
86 1HB SER 12 1HB SER 12 -5.268 11.007 -3.966
87 2HB SER 12 2HB SER 12 -3.628 11.592 -4.247
88 HG SER 12 HG SER 12 -4.824 10.270 -5.948
89 H ALA 13 H ALA 13 -6.134 10.471 -2.284
90 HA ALA 13 HA ALA 13 -7.002 7.695 -2.069
91 1HB ALA 13 1HB ALA 13 -6.452 9.378 0.207
92 2HB ALA 13 2HB ALA 13 -8.149 8.900 0.175
93 3HB ALA 13 3HB ALA 13 -6.886 7.670 0.153
94 H VAL 14 H VAL 14 -9.148 7.389 -2.527
95 HA VAL 14 HA VAL 14 -10.839 9.768 -2.831
96 HB VAL 14 HB VAL 14 -9.730 8.814 -5.047
97 1HG1 VAL 14 1HG1 VAL 14 -10.797 6.536 -4.497
98 2HG1 VAL 14 2HG1 VAL 14 -12.298 7.272 -5.064
99 3HG1 VAL 14 3HG1 VAL 14 -10.913 7.137 -6.152
100 1HG2 VAL 14 1HG2 VAL 14 -11.735 10.543 -4.471
101 2HG2 VAL 14 2HG2 VAL 14 -11.151 10.199 -6.100
102 3HG2 VAL 14 3HG2 VAL 14 -12.575 9.363 -5.478
103 H THR 15 H THR 15 -13.094 8.900 -3.649
104 HA THR 15 HA THR 15 -13.976 6.994 -1.630
105 HB THR 15 HB THR 15 -16.066 8.167 -3.261
106 HG1 THR 15 HG1 THR 15 -15.658 10.254 -3.006
107 1HG2 THR 15 1HG2 THR 15 -15.801 7.365 -0.668
108 2HG2 THR 15 2HG2 THR 15 -15.798 9.122 -0.530
109 3HG2 THR 15 3HG2 THR 15 -17.144 8.303 -1.321
110 H CYS 16 H CYS 16 -13.777 4.942 -2.360
111 HA CYS 16 HA CYS 16 -14.019 4.174 -5.070
112 1HB CYS 16 1HB CYS 16 -14.526 2.192 -2.894
113 2HB CYS 16 2HB CYS 16 -13.613 2.011 -4.381
114 HA PRO 17 HA PRO 17 -18.428 4.121 -5.538
115 1HB PRO 17 1HB PRO 17 -18.569 2.282 -7.565
116 2HB PRO 17 2HB PRO 17 -18.162 3.983 -7.806
117 1HG PRO 17 1HG PRO 17 -16.355 1.608 -7.614
118 2HG PRO 17 2HG PRO 17 -16.265 2.999 -8.711
119 1HD PRO 17 1HD PRO 17 -14.689 2.797 -6.540
120 2HD PRO 17 2HD PRO 17 -15.309 4.363 -7.103
121 HA PRO 18 HA PRO 18 -20.445 0.760 -3.497
122 1HB PRO 18 1HB PRO 18 -21.711 -0.561 -5.680
123 2HB PRO 18 2HB PRO 18 -22.431 0.594 -4.560
124 1HG PRO 18 1HG PRO 18 -21.352 1.026 -7.286
125 2HG PRO 18 2HG PRO 18 -22.635 1.898 -6.430
126 1HD PRO 18 1HD PRO 18 -20.219 2.988 -6.810
127 2HD PRO 18 2HD PRO 18 -21.127 3.263 -5.309
128 H GLY 19 H GLY 19 -18.621 0.047 -6.399
129 1HA GLY 19 1HA GLY 19 -17.161 -1.648 -6.894
130 2HA GLY 19 2HA GLY 19 -18.416 -2.712 -6.279
131 H GLU 20 H GLU 20 -16.188 -0.350 -4.758
132 HA GLU 20 HA GLU 20 -15.402 -2.503 -2.894
133 1HB GLU 20 1HB GLU 20 -13.558 -0.245 -3.561
134 2HB GLU 20 2HB GLU 20 -13.176 -1.847 -2.952
135 1HG GLU 20 1HG GLU 20 -12.643 -2.424 -5.018
136 2HG GLU 20 2HG GLU 20 -14.351 -2.292 -5.434
137 H ASN 21 H ASN 21 -15.326 -2.055 -0.795
138 HA ASN 21 HA ASN 21 -15.979 0.676 0.064
139 1HB ASN 21 1HB ASN 21 -17.463 -1.719 0.458
140 2HB ASN 21 2HB ASN 21 -16.916 -1.121 2.012
141 2HD2 ASN 21 2HD2 ASN 21 -19.422 -1.104 1.923
142 1HD2 ASN 21 1HD2 ASN 21 -20.102 0.434 1.555
143 H LEU 22 H LEU 22 -13.968 -2.066 0.377
144 HA LEU 22 HA LEU 22 -12.832 -1.101 2.894
145 1HB LEU 22 1HB LEU 22 -12.293 -3.679 1.431
146 2HB LEU 22 2HB LEU 22 -11.777 -3.262 3.047
147 HG LEU 22 HG LEU 22 -14.697 -3.254 2.511
148 1HD1 LEU 22 1HD1 LEU 22 -12.962 -5.598 2.194
149 2HD1 LEU 22 2HD1 LEU 22 -14.317 -5.823 3.300
150 3HD1 LEU 22 3HD1 LEU 22 -14.612 -5.318 1.636
151 1HD2 LEU 22 1HD2 LEU 22 -12.860 -3.437 4.775
152 2HD2 LEU 22 2HD2 LEU 22 -14.525 -2.860 4.706
153 3HD2 LEU 22 3HD2 LEU 22 -14.195 -4.586 4.849
154 H CYS 23 H CYS 23 -10.375 -1.541 3.008
155 HA CYS 23 HA CYS 23 -9.066 -0.633 0.527
156 1HB CYS 23 1HB CYS 23 -8.077 0.226 3.225
157 2HB CYS 23 2HB CYS 23 -7.813 0.984 1.661
158 H TYR 24 H TYR 24 -6.795 -1.287 0.336
159 HA TYR 24 HA TYR 24 -6.068 -3.436 2.196
160 1HB TYR 24 1HB TYR 24 -5.431 -4.934 0.501
161 2HB TYR 24 2HB TYR 24 -7.014 -4.336 0.040
162 HD1 TYR 24 HD1 TYR 24 -3.410 -3.329 -0.584
163 HD2 TYR 24 HD2 TYR 24 -7.312 -3.967 -2.184
164 HE1 TYR 24 HE1 TYR 24 -2.579 -2.791 -2.822
165 HE2 TYR 24 HE2 TYR 24 -6.476 -3.419 -4.428
166 HH TYR 24 HH TYR 24 -3.195 -3.252 -5.181
167 H ARG 25 H ARG 25 -3.975 -3.776 2.632
168 HA ARG 25 HA ARG 25 -2.016 -1.865 1.558
169 1HB ARG 25 1HB ARG 25 -2.725 -2.570 4.369
170 2HB ARG 25 2HB ARG 25 -1.039 -2.264 4.005
171 1HG ARG 25 1HG ARG 25 -2.449 -0.165 2.815
172 2HG ARG 25 2HG ARG 25 -3.207 -0.414 4.383
173 1HD ARG 25 1HD ARG 25 -1.108 1.178 4.069
174 2HD ARG 25 2HD ARG 25 -1.365 0.244 5.539
175 HE ARG 25 HE ARG 25 0.637 -0.725 5.096
176 1HH1 ARG 25 1HH1 ARG 25 -0.827 0.085 2.034
177 2HH1 ARG 25 2HH1 ARG 25 0.451 -0.604 1.099
178 1HH2 ARG 25 1HH2 ARG 25 2.335 -1.596 3.865
179 2HH2 ARG 25 2HH2 ARG 25 2.253 -1.550 2.137
180 H LYS 26 H LYS 26 -0.877 -3.229 0.223
181 HA LYS 26 HA LYS 26 -0.221 -5.914 1.136
182 1HB LYS 26 1HB LYS 26 -0.928 -5.402 -1.230
183 2HB LYS 26 2HB LYS 26 0.616 -4.602 -1.440
184 1HG LYS 26 1HG LYS 26 1.579 -6.881 -0.605
185 2HG LYS 26 2HG LYS 26 0.014 -7.496 -1.140
186 1HD LYS 26 1HD LYS 26 0.887 -5.823 -3.201
187 2HD LYS 26 2HD LYS 26 2.319 -6.725 -2.700
188 1HE LYS 26 1HE LYS 26 1.562 -8.365 -4.011
189 2HE LYS 26 2HE LYS 26 0.356 -8.653 -2.758
190 1HZ LYS 26 1HZ LYS 26 -0.965 -6.851 -4.017
191 2HZ LYS 26 2HZ LYS 26 0.065 -7.211 -5.309
192 3HZ LYS 26 3HZ LYS 26 -0.915 -8.420 -4.649
193 H MET 27 H MET 27 1.825 -6.706 1.473
194 HA MET 27 HA MET 27 4.077 -4.880 1.309
195 1HB MET 27 1HB MET 27 2.992 -5.957 3.875
196 2HB MET 27 2HB MET 27 4.708 -5.626 3.713
197 1HG MET 27 1HG MET 27 4.397 -3.354 3.541
198 2HG MET 27 2HG MET 27 2.735 -3.516 2.980
199 1HE MET 27 1HE MET 27 4.800 -5.040 5.600
200 2HE MET 27 2HE MET 27 4.526 -4.042 7.028
201 3HE MET 27 3HE MET 27 3.532 -5.471 6.747
202 H TRP 28 H TRP 28 5.981 -5.812 0.979
203 HA TRP 28 HA TRP 28 6.670 -8.476 1.678
204 1HB TRP 28 1HB TRP 28 6.787 -9.509 -0.542
205 2HB TRP 28 2HB TRP 28 5.129 -9.092 -0.139
206 HD1 TRP 28 HD1 TRP 28 5.420 -5.985 -0.972
207 HE1 TRP 28 HE1 TRP 28 5.426 -5.393 -3.480
208 HE3 TRP 28 HE3 TRP 28 6.768 -10.527 -2.858
209 HZ2 TRP 28 HZ2 TRP 28 5.948 -6.682 -5.927
210 HZ3 TRP 28 HZ3 TRP 28 7.003 -10.771 -5.297
211 HH2 TRP 28 HH2 TRP 28 6.600 -8.887 -6.800
212 H CYS 29 H CYS 29 8.802 -8.320 2.019
213 HA CYS 29 HA CYS 29 10.247 -6.104 1.361
214 1HB CYS 29 1HB CYS 29 11.305 -8.817 2.082
215 2HB CYS 29 2HB CYS 29 12.319 -7.423 1.857
216 H ASP 30 H ASP 30 11.134 -5.316 -0.333
217 HA ASP 30 HA ASP 30 11.632 -6.986 -2.669
218 1HB ASP 30 1HB ASP 30 12.237 -4.857 -3.791
219 2HB ASP 30 2HB ASP 30 10.623 -4.776 -3.102
220 H ALA 31 H ALA 31 13.797 -7.201 -3.459
221 HA ALA 31 HA ALA 31 15.703 -8.018 -1.808
222 1HB ALA 31 1HB ALA 31 16.091 -8.305 -4.094
223 2HB ALA 31 2HB ALA 31 17.413 -7.274 -3.545
224 3HB ALA 31 3HB ALA 31 16.047 -6.571 -4.411
225 H PHE 32 H PHE 32 14.999 -6.273 -0.123
226 HA PHE 32 HA PHE 32 17.314 -4.899 0.610
227 1HB PHE 32 1HB PHE 32 15.502 -3.447 -1.056
228 2HB PHE 32 2HB PHE 32 15.509 -2.746 0.546
229 HD1 PHE 32 HD1 PHE 32 16.945 -2.469 -2.543
230 HD2 PHE 32 HD2 PHE 32 18.044 -2.666 1.562
231 HE1 PHE 32 HE1 PHE 32 19.058 -1.317 -3.057
232 HE2 PHE 32 HE2 PHE 32 20.157 -1.512 1.057
233 HZ PHE 32 HZ PHE 32 20.666 -0.835 -1.256
234 H CYS 33 H CYS 33 14.966 -6.713 1.577
235 HA CYS 33 HA CYS 33 13.279 -5.724 3.381
236 1HB CYS 33 1HB CYS 33 14.081 -8.171 2.917
237 2HB CYS 33 2HB CYS 33 15.043 -7.913 4.368
238 H SER 34 H SER 34 16.758 -5.598 3.741
239 HA SER 34 HA SER 34 16.721 -4.762 6.480
240 1HB SER 34 1HB SER 34 18.674 -5.710 4.838
241 2HB SER 34 2HB SER 34 19.039 -3.985 4.817
242 HG SER 34 HG SER 34 20.119 -4.907 6.536
243 H SER 35 H SER 35 17.462 -3.027 3.432
244 HA SER 35 HA SER 35 17.020 -0.476 4.773
245 1HB SER 35 1HB SER 35 18.743 -1.266 2.737
246 2HB SER 35 2HB SER 35 17.518 -0.310 1.904
247 HG SER 35 HG SER 35 17.913 1.268 3.675
248 H ARG 36 H ARG 36 16.046 -1.420 1.463
249 HA ARG 36 HA ARG 36 13.615 0.059 1.684
250 1HB ARG 36 1HB ARG 36 13.969 -2.051 -0.411
251 2HB ARG 36 2HB ARG 36 13.188 -0.498 -0.529
252 1HG ARG 36 1HG ARG 36 16.094 -0.439 -0.048
253 2HG ARG 36 2HG ARG 36 15.559 -1.029 -1.621
254 1HD ARG 36 1HD ARG 36 15.075 1.027 -2.304
255 2HD ARG 36 2HD ARG 36 14.099 1.337 -0.868
256 HE ARG 36 HE ARG 36 16.531 1.666 0.125
257 1HH1 ARG 36 1HH1 ARG 36 15.190 2.830 -2.885
258 2HH1 ARG 36 2HH1 ARG 36 16.197 4.236 -2.930
259 1HH2 ARG 36 1HH2 ARG 36 17.853 3.515 0.060
260 2HH2 ARG 36 2HH2 ARG 36 17.709 4.625 -1.261
261 H GLY 37 H GLY 37 13.740 -3.424 0.709
262 1HA GLY 37 1HA GLY 37 12.393 -4.166 3.116
263 2HA GLY 37 2HA GLY 37 12.755 -5.201 1.749
264 H LYS 38 H LYS 38 10.369 -4.727 3.507
265 HA LYS 38 HA LYS 38 8.441 -5.586 1.897
266 1HB LYS 38 1HB LYS 38 7.299 -3.729 3.779
267 2HB LYS 38 2HB LYS 38 7.101 -5.459 3.635
268 1HG LYS 38 1HG LYS 38 9.216 -5.769 4.855
269 2HG LYS 38 2HG LYS 38 9.332 -4.021 5.052
270 1HD LYS 38 1HD LYS 38 8.074 -4.161 6.879
271 2HD LYS 38 2HD LYS 38 6.748 -4.798 5.905
272 1HE LYS 38 1HE LYS 38 8.955 -6.427 7.163
273 2HE LYS 38 2HE LYS 38 7.306 -6.287 7.772
274 1HZ LYS 38 1HZ LYS 38 7.684 -7.173 5.006
275 2HZ LYS 38 2HZ LYS 38 8.032 -8.273 6.244
276 3HZ LYS 38 3HZ LYS 38 6.485 -7.598 6.120
277 H VAL 39 H VAL 39 7.885 -4.898 0.005
278 HA VAL 39 HA VAL 39 7.781 -2.157 -0.749
279 HB VAL 39 HB VAL 39 6.440 -4.508 -2.077
280 1HG1 VAL 39 1HG1 VAL 39 5.784 -2.088 -2.661
281 2HG1 VAL 39 2HG1 VAL 39 7.349 -2.036 -3.472
282 3HG1 VAL 39 3HG1 VAL 39 6.140 -3.222 -3.962
283 1HG2 VAL 39 1HG2 VAL 39 8.835 -4.896 -1.828
284 2HG2 VAL 39 2HG2 VAL 39 8.391 -4.651 -3.518
285 3HG2 VAL 39 3HG2 VAL 39 9.162 -3.350 -2.610
286 H VAL 40 H VAL 40 6.067 -0.786 -0.700
287 HA VAL 40 HA VAL 40 3.698 -1.729 0.745
288 HB VAL 40 HB VAL 40 4.595 1.111 0.232
289 1HG1 VAL 40 1HG1 VAL 40 2.134 0.124 1.074
290 2HG1 VAL 40 2HG1 VAL 40 2.935 0.670 2.546
291 3HG1 VAL 40 3HG1 VAL 40 2.710 1.783 1.198
292 1HG2 VAL 40 1HG2 VAL 40 6.219 -0.142 1.585
293 2HG2 VAL 40 2HG2 VAL 40 5.406 1.113 2.521
294 3HG2 VAL 40 3HG2 VAL 40 4.931 -0.574 2.709
295 H GLU 41 H GLU 41 1.813 -1.940 -0.232
296 HA GLU 41 HA GLU 41 1.365 -0.572 -2.803
297 1HB GLU 41 1HB GLU 41 1.548 -3.266 -2.521
298 2HB GLU 41 2HB GLU 41 -0.179 -3.032 -2.281
299 1HG GLU 41 1HG GLU 41 -0.320 -3.142 -4.497
300 2HG GLU 41 2HG GLU 41 0.304 -1.493 -4.481
301 H LEU 42 H LEU 42 -0.646 0.319 -3.147
302 HA LEU 42 HA LEU 42 -2.492 0.360 -0.858
303 1HB LEU 42 1HB LEU 42 -0.979 2.504 -2.041
304 2HB LEU 42 2HB LEU 42 -2.689 2.818 -2.225
305 HG LEU 42 HG LEU 42 -2.990 2.606 0.194
306 1HD1 LEU 42 1HD1 LEU 42 -0.842 1.098 0.306
307 2HD1 LEU 42 2HD1 LEU 42 -0.044 2.641 0.600
308 3HD1 LEU 42 3HD1 LEU 42 -1.324 2.091 1.680
309 1HD2 LEU 42 1HD2 LEU 42 -2.471 4.783 -0.890
310 2HD2 LEU 42 2HD2 LEU 42 -1.983 4.689 0.802
311 3HD2 LEU 42 3HD2 LEU 42 -0.776 4.531 -0.474
312 H GLY 43 H GLY 43 -4.576 -0.062 -1.358
313 1HA GLY 43 1HA GLY 43 -5.417 -0.953 -3.834
314 2HA GLY 43 2HA GLY 43 -5.731 0.768 -3.841
315 H CYS 44 H CYS 44 -7.938 0.045 -4.149
316 HA CYS 44 HA CYS 44 -9.279 -0.274 -1.566
317 1HB CYS 44 1HB CYS 44 -9.774 1.588 -3.346
318 2HB CYS 44 2HB CYS 44 -10.706 0.321 -4.137
319 H ALA 45 H ALA 45 -10.866 -1.868 -1.231
320 HA ALA 45 HA ALA 45 -11.323 -3.840 -3.321
321 1HB ALA 45 1HB ALA 45 -9.564 -5.041 -2.544
322 2HB ALA 45 2HB ALA 45 -9.649 -4.331 -0.931
323 3HB ALA 45 3HB ALA 45 -10.780 -5.603 -1.396
324 H ALA 46 H ALA 46 -13.007 -5.379 -2.782
325 HA ALA 46 HA ALA 46 -14.919 -4.245 -0.856
326 1HB ALA 46 1HB ALA 46 -15.878 -6.234 -2.803
327 2HB ALA 46 2HB ALA 46 -16.597 -4.710 -2.284
328 3HB ALA 46 3HB ALA 46 -15.305 -4.712 -3.484
329 H THR 47 H THR 47 -12.647 -6.365 -0.576
330 HA THR 47 HA THR 47 -13.949 -7.937 1.391
331 HB THR 47 HB THR 47 -14.797 -9.111 -0.602
332 HG1 THR 47 HG1 THR 47 -14.637 -10.764 0.652
333 1HG2 THR 47 1HG2 THR 47 -11.946 -9.126 -1.359
334 2HG2 THR 47 2HG2 THR 47 -12.867 -10.597 -1.676
335 3HG2 THR 47 3HG2 THR 47 -13.393 -9.061 -2.365
336 H CYS 48 H CYS 48 -12.259 -10.114 1.545
337 HA CYS 48 HA CYS 48 -9.633 -8.831 1.871
338 1HB CYS 48 1HB CYS 48 -11.276 -10.340 3.703
339 2HB CYS 48 2HB CYS 48 -9.692 -11.079 3.533
340 HA PRO 49 HA PRO 49 -8.246 -11.948 -1.021
341 1HB PRO 49 1HB PRO 49 -5.538 -11.248 -0.320
342 2HB PRO 49 2HB PRO 49 -6.391 -10.973 -1.832
343 1HG PRO 49 1HG PRO 49 -5.675 -8.970 -0.129
344 2HG PRO 49 2HG PRO 49 -7.069 -8.879 -1.219
345 1HD PRO 49 1HD PRO 49 -6.985 -9.438 1.714
346 2HD PRO 49 2HD PRO 49 -8.171 -8.512 0.771
347 H SER 50 H SER 50 -5.957 -13.386 -0.841
348 HA SER 50 HA SER 50 -6.326 -14.890 1.666
349 1HB SER 50 1HB SER 50 -5.584 -15.837 -1.106
350 2HB SER 50 2HB SER 50 -5.433 -16.851 0.329
351 HG SER 50 HG SER 50 -7.616 -16.814 0.590
352 H LYS 51 H LYS 51 -4.308 -16.320 2.120
353 HA LYS 51 HA LYS 51 -2.087 -14.511 2.427
354 1HB LYS 51 1HB LYS 51 -3.087 -16.747 3.808
355 2HB LYS 51 2HB LYS 51 -1.457 -17.140 3.294
356 1HG LYS 51 1HG LYS 51 -1.920 -14.502 4.563
357 2HG LYS 51 2HG LYS 51 -1.936 -15.938 5.587
358 1HD LYS 51 1HD LYS 51 0.282 -16.555 4.559
359 2HD LYS 51 2HD LYS 51 0.297 -14.950 3.824
360 1HE LYS 51 1HE LYS 51 0.133 -13.945 6.061
361 2HE LYS 51 2HE LYS 51 0.164 -15.556 6.777
362 1HZ LYS 51 1HZ LYS 51 2.339 -14.595 5.019
363 2HZ LYS 51 2HZ LYS 51 2.339 -14.283 6.683
364 3HZ LYS 51 3HZ LYS 51 2.367 -15.878 6.121
365 H LYS 52 H LYS 52 -0.696 -14.238 0.804
366 HA LYS 52 HA LYS 52 -0.025 -16.560 -0.870
367 1HB LYS 52 1HB LYS 52 0.739 -13.768 -1.622
368 2HB LYS 52 2HB LYS 52 0.375 -15.141 -2.656
369 1HG LYS 52 1HG LYS 52 -2.017 -14.928 -1.947
370 2HG LYS 52 2HG LYS 52 -1.572 -13.422 -1.142
371 1HD LYS 52 1HD LYS 52 -0.521 -12.920 -3.537
372 2HD LYS 52 2HD LYS 52 -1.785 -14.046 -4.036
373 1HE LYS 52 1HE LYS 52 -3.358 -12.596 -2.618
374 2HE LYS 52 2HE LYS 52 -2.063 -11.400 -2.647
375 1HZ LYS 52 1HZ LYS 52 -2.211 -11.934 -5.219
376 2HZ LYS 52 2HZ LYS 52 -3.809 -12.302 -4.803
377 3HZ LYS 52 3HZ LYS 52 -3.185 -10.761 -4.488
378 HA PRO 53 HA PRO 53 4.029 -16.924 0.832
379 1HB PRO 53 1HB PRO 53 4.927 -17.220 -1.992
380 2HB PRO 53 2HB PRO 53 5.205 -18.279 -0.605
381 1HG PRO 53 1HG PRO 53 3.441 -18.941 -2.483
382 2HG PRO 53 2HG PRO 53 3.113 -19.265 -0.770
383 1HD PRO 53 1HD PRO 53 2.016 -17.126 -2.542
384 2HD PRO 53 2HD PRO 53 1.218 -18.040 -1.246
385 H TYR 54 H TYR 54 5.110 -15.212 1.555
386 HA TYR 54 HA TYR 54 6.202 -13.222 1.649
387 1HB TYR 54 1HB TYR 54 7.300 -14.709 -0.504
388 2HB TYR 54 2HB TYR 54 7.335 -13.002 -0.916
389 HD1 TYR 54 HD1 TYR 54 9.361 -12.007 -0.473
390 HD2 TYR 54 HD2 TYR 54 7.936 -15.010 2.182
391 HE1 TYR 54 HE1 TYR 54 11.360 -11.708 0.928
392 HE2 TYR 54 HE2 TYR 54 9.930 -14.720 3.591
393 HH TYR 54 HH TYR 54 12.220 -13.890 3.395
394 H GLU 55 H GLU 55 3.453 -13.239 0.593
395 HA GLU 55 HA GLU 55 3.429 -10.521 -0.369
396 1HB GLU 55 1HB GLU 55 3.650 -11.621 -2.487
397 2HB GLU 55 2HB GLU 55 2.426 -12.809 -2.064
398 1HG GLU 55 1HG GLU 55 0.746 -11.004 -2.018
399 2HG GLU 55 2HG GLU 55 1.988 -9.876 -2.558
400 H GLU 56 H GLU 56 2.335 -10.117 1.573
401 HA GLU 56 HA GLU 56 -0.355 -11.293 1.780
402 1HB GLU 56 1HB GLU 56 1.696 -10.651 3.757
403 2HB GLU 56 2HB GLU 56 0.110 -10.022 4.178
404 1HG GLU 56 1HG GLU 56 0.245 -12.831 3.267
405 2HG GLU 56 2HG GLU 56 0.918 -12.458 4.854
406 H VAL 57 H VAL 57 -2.066 -9.887 2.570
407 HA VAL 57 HA VAL 57 -1.643 -7.029 2.119
408 HB VAL 57 HB VAL 57 -4.168 -7.513 1.037
409 1HG1 VAL 57 1HG1 VAL 57 -2.170 -5.898 0.490
410 2HG1 VAL 57 2HG1 VAL 57 -1.846 -7.099 -0.760
411 3HG1 VAL 57 3HG1 VAL 57 -3.403 -6.273 -0.712
412 1HG2 VAL 57 1HG2 VAL 57 -3.583 -9.866 0.720
413 2HG2 VAL 57 2HG2 VAL 57 -3.761 -9.032 -0.825
414 3HG2 VAL 57 3HG2 VAL 57 -2.153 -9.387 -0.194
415 H THR 58 H THR 58 -2.531 -5.883 3.701
416 HA THR 58 HA THR 58 -4.433 -7.172 5.490
417 HB THR 58 HB THR 58 -3.808 -5.617 7.097
418 HG1 THR 58 HG1 THR 58 -3.075 -3.597 6.670
419 1HG2 THR 58 1HG2 THR 58 -1.396 -5.933 5.345
420 2HG2 THR 58 2HG2 THR 58 -1.355 -5.252 6.971
421 3HG2 THR 58 3HG2 THR 58 -1.861 -6.924 6.728
422 H CYS 59 H CYS 59 -6.546 -6.824 5.252
423 HA CYS 59 HA CYS 59 -7.393 -4.485 3.704
424 1HB CYS 59 1HB CYS 59 -9.606 -6.206 4.231
425 2HB CYS 59 2HB CYS 59 -8.832 -5.860 2.696
426 H CYS 60 H CYS 60 -8.808 -2.974 4.538
427 HA CYS 60 HA CYS 60 -9.753 -3.409 7.291
428 1HB CYS 60 1HB CYS 60 -9.356 -0.877 7.592
429 2HB CYS 60 2HB CYS 60 -7.967 -1.952 7.682
430 H SER 61 H SER 61 -11.664 -2.263 7.872
431 HA SER 61 HA SER 61 -13.289 -1.524 5.534
432 1HB SER 61 1HB SER 61 -15.229 -2.253 6.737
433 2HB SER 61 2HB SER 61 -14.009 -3.515 6.906
434 HG SER 61 HG SER 61 -14.695 -1.528 8.813
435 H THR 62 H THR 62 -11.582 0.403 6.634
436 HA THR 62 HA THR 62 -13.574 2.309 7.645
437 HB THR 62 HB THR 62 -10.799 2.578 8.672
438 HG1 THR 62 HG1 THR 62 -12.633 0.758 9.831
439 1HG2 THR 62 1HG2 THR 62 -13.499 3.390 9.467
440 2HG2 THR 62 2HG2 THR 62 -12.447 2.879 10.786
441 3HG2 THR 62 3HG2 THR 62 -11.946 4.188 9.716
442 H ASP 63 H ASP 63 -12.537 4.620 7.574
443 HA ASP 63 HA ASP 63 -11.665 4.999 4.841
444 1HB ASP 63 1HB ASP 63 -13.368 6.446 6.154
445 2HB ASP 63 2HB ASP 63 -11.947 7.204 6.863
446 H LYS 64 H LYS 64 -9.805 6.232 4.251
447 HA LYS 64 HA LYS 64 -7.485 6.215 4.239
448 1HB LYS 64 1HB LYS 64 -6.647 8.030 5.588
449 2HB LYS 64 2HB LYS 64 -8.258 8.447 5.032
450 1HG LYS 64 1HG LYS 64 -8.479 7.142 7.551
451 2HG LYS 64 2HG LYS 64 -7.257 8.407 7.671
452 1HD LYS 64 1HD LYS 64 -9.243 9.653 6.257
453 2HD LYS 64 2HD LYS 64 -10.160 8.618 7.352
454 1HE LYS 64 1HE LYS 64 -9.703 9.928 9.095
455 2HE LYS 64 2HE LYS 64 -7.979 9.928 8.724
456 1HZ LYS 64 1HZ LYS 64 -9.656 11.565 7.004
457 2HZ LYS 64 2HZ LYS 64 -9.500 12.098 8.603
458 3HZ LYS 64 3HZ LYS 64 -8.123 11.883 7.644
459 H CYS 65 H CYS 65 -8.338 3.869 5.453
460 HA CYS 65 HA CYS 65 -6.833 3.505 7.902
461 1HB CYS 65 1HB CYS 65 -7.858 1.278 7.915
462 2HB CYS 65 2HB CYS 65 -9.064 2.540 7.731
463 H ASN 66 H ASN 66 -6.242 3.133 4.560
464 HA ASN 66 HA ASN 66 -4.135 1.176 5.112
465 1HB ASN 66 1HB ASN 66 -4.291 0.548 2.782
466 2HB ASN 66 2HB ASN 66 -5.868 0.432 3.543
467 2HD2 ASN 66 2HD2 ASN 66 -4.326 1.362 0.855
468 1HD2 ASN 66 1HD2 ASN 66 -5.426 2.554 0.260
469 HA PRO 67 HA PRO 67 -2.000 5.054 3.565
470 1HB PRO 67 1HB PRO 67 -1.249 6.310 5.773
471 2HB PRO 67 2HB PRO 67 -2.924 6.434 5.213
472 1HG PRO 67 1HG PRO 67 -1.776 4.740 7.396
473 2HG PRO 67 2HG PRO 67 -3.294 5.655 7.371
474 1HD PRO 67 1HD PRO 67 -3.048 2.927 6.853
475 2HD PRO 67 2HD PRO 67 -4.420 3.946 6.385
476 H HIS 68 H HIS 68 0.306 5.568 3.712
477 HA HIS 68 HA HIS 68 1.942 3.294 3.943
478 1HB HIS 68 1HB HIS 68 2.310 5.630 2.728
479 2HB HIS 68 2HB HIS 68 3.159 6.007 4.220
480 HD1 HIS 68 HD1 HIS 68 5.452 4.990 4.546
481 HD2 HIS 68 HD2 HIS 68 3.494 3.535 1.188
482 HE1 HIS 68 HE1 HIS 68 7.178 3.671 3.282
483 HE2 HIS 68 HE2 HIS 68 5.985 2.852 1.220
484 HA PRO 69 HA PRO 69 2.421 2.932 8.361
485 1HB PRO 69 1HB PRO 69 5.080 1.842 7.571
486 2HB PRO 69 2HB PRO 69 3.857 1.157 8.647
487 1HG PRO 69 1HG PRO 69 4.191 0.197 6.186
488 2HG PRO 69 2HG PRO 69 2.571 0.354 6.892
489 1HD PRO 69 1HD PRO 69 3.916 2.043 4.832
490 2HD PRO 69 2HD PRO 69 2.205 1.594 4.985
491 H LYS 70 H LYS 70 4.714 4.484 6.243
492 HA LYS 70 HA LYS 70 5.925 5.878 8.528
493 1HB LYS 70 1HB LYS 70 6.877 5.448 5.700
494 2HB LYS 70 2HB LYS 70 7.645 6.586 6.795
495 1HG LYS 70 1HG LYS 70 7.319 3.651 7.371
496 2HG LYS 70 2HG LYS 70 8.758 4.364 6.642
497 1HD LYS 70 1HD LYS 70 9.371 5.440 8.585
498 2HD LYS 70 2HD LYS 70 7.722 5.474 9.211
499 1HE LYS 70 1HE LYS 70 9.357 3.881 10.339
500 2HE LYS 70 2HE LYS 70 7.799 3.218 9.848
501 1HZ LYS 70 1HZ LYS 70 10.137 3.033 8.059
502 2HZ LYS 70 2HZ LYS 70 9.921 1.909 9.306
503 3HZ LYS 70 3HZ LYS 70 8.749 2.067 8.097
504 H GLN 71 H GLN 71 3.286 6.493 7.352
505 HA GLN 71 HA GLN 71 3.533 8.872 5.797
506 1HB GLN 71 1HB GLN 71 1.332 7.356 7.071
507 2HB GLN 71 2HB GLN 71 1.040 9.069 6.809
508 1HG GLN 71 1HG GLN 71 2.179 7.712 4.493
509 2HG GLN 71 2HG GLN 71 0.610 7.080 4.989
510 2HE2 GLN 71 2HE2 GLN 71 -0.853 7.914 3.680
511 1HE2 GLN 71 1HE2 GLN 71 -0.997 9.582 3.250
512 H ARG 72 H ARG 72 2.681 10.997 6.519
513 HA ARG 72 HA ARG 72 4.126 11.988 8.688
514 1HB ARG 72 1HB ARG 72 1.814 13.085 7.109
515 2HB ARG 72 2HB ARG 72 2.511 13.986 8.449
516 1HG ARG 72 1HG ARG 72 3.852 14.857 6.893
517 2HG ARG 72 2HG ARG 72 4.735 13.335 7.028
518 1HD ARG 72 1HD ARG 72 4.412 13.390 4.768
519 2HD ARG 72 2HD ARG 72 2.943 12.546 5.257
520 HE ARG 72 HE ARG 72 2.207 15.152 5.283
521 1HH1 ARG 72 1HH1 ARG 72 3.724 13.112 2.893
522 2HH1 ARG 72 2HH1 ARG 72 3.049 13.970 1.549
523 1HH2 ARG 72 1HH2 ARG 72 1.317 16.282 3.517
524 2HH2 ARG 72 2HH2 ARG 72 1.682 15.770 1.904
525 HA PRO 73 HA PRO 73 1.440 10.687 12.019
526 1HB PRO 73 1HB PRO 73 2.821 11.791 14.053
527 2HB PRO 73 2HB PRO 73 3.391 10.349 13.204
528 1HG PRO 73 1HG PRO 73 4.226 13.204 12.860
529 2HG PRO 73 2HG PRO 73 5.231 11.744 12.925
530 1HD PRO 73 1HD PRO 73 4.530 12.970 10.595
531 2HD PRO 73 2HD PRO 73 4.839 11.227 10.721
532 H GLY 74 H GLY 74 0.858 12.053 14.247
533 1HA GLY 74 1HA GLY 74 -1.061 13.480 14.553
534 2HA GLY 74 2HA GLY 74 -0.494 14.455 13.205
535 H1 TRP 75 H1 TRP 75 4.993 -0.696 -10.680
536 H2 TRP 75 H2 TRP 75 6.111 0.075 -11.730
537 H3 TRP 75 H3 TRP 75 6.584 -0.349 -10.138
538 HA TRP 75 HA TRP 75 6.205 1.924 -10.135
539 1HB TRP 75 1HB TRP 75 4.841 1.769 -12.281
540 2HB TRP 75 2HB TRP 75 3.455 1.387 -11.264
541 HD1 TRP 75 HD1 TRP 75 2.910 3.380 -9.321
542 HE1 TRP 75 HE1 TRP 75 2.950 5.933 -9.654
543 HE3 TRP 75 HE3 TRP 75 5.846 3.610 -13.501
544 HZ2 TRP 75 HZ2 TRP 75 4.084 7.797 -11.445
545 HZ3 TRP 75 HZ3 TRP 75 6.364 5.816 -14.459
546 HH2 TRP 75 HH2 TRP 75 5.500 7.865 -13.451
547 H ARG 76 H ARG 76 6.372 1.151 -7.945
548 HA ARG 76 HA ARG 76 3.875 1.497 -6.501
549 1HB ARG 76 1HB ARG 76 4.023 -0.532 -5.239
550 2HB ARG 76 2HB ARG 76 4.085 -0.962 -6.942
551 1HG ARG 76 1HG ARG 76 6.577 -0.643 -5.307
552 2HG ARG 76 2HG ARG 76 5.668 -2.152 -5.349
553 1HD ARG 76 1HD ARG 76 6.201 -2.580 -7.531
554 2HD ARG 76 2HD ARG 76 6.399 -0.876 -7.932
555 HE ARG 76 HE ARG 76 8.432 -1.411 -6.191
556 1HH1 ARG 76 1HH1 ARG 76 7.378 -2.764 -9.232
557 2HH1 ARG 76 2HH1 ARG 76 8.972 -3.231 -9.720
558 1HH2 ARG 76 1HH2 ARG 76 10.530 -2.024 -6.832
559 2HH2 ARG 76 2HH2 ARG 76 10.762 -2.813 -8.357
560 H TYR 77 H TYR 77 4.650 0.997 -3.940
561 HA TYR 77 HA TYR 77 7.051 2.698 -3.659
562 1HB TYR 77 1HB TYR 77 4.631 2.583 -1.854
563 2HB TYR 77 2HB TYR 77 6.063 3.562 -1.576
564 HD1 TYR 77 HD1 TYR 77 3.695 2.981 -4.427
565 HD2 TYR 77 HD2 TYR 77 5.787 5.783 -2.011
566 HE1 TYR 77 HE1 TYR 77 2.692 4.825 -5.706
567 HE2 TYR 77 HE2 TYR 77 4.791 7.635 -3.280
568 HH TYR 77 HH TYR 77 2.905 8.095 -4.682
569 H TYR 78 H TYR 78 8.186 2.443 -1.573
570 HA TYR 78 HA TYR 78 8.169 -0.357 -0.709
571 1HB TYR 78 1HB TYR 78 10.407 1.663 -0.838
572 2HB TYR 78 2HB TYR 78 10.542 0.154 0.039
573 HD1 TYR 78 HD1 TYR 78 12.526 0.606 -1.924
574 HD2 TYR 78 HD2 TYR 78 8.582 -0.887 -2.501
575 HE1 TYR 78 HE1 TYR 78 13.264 -0.545 -3.965
576 HE2 TYR 78 HE2 TYR 78 9.312 -2.039 -4.544
577 HH TYR 78 HH TYR 78 12.317 -1.427 -6.029
578 H GLU 79 H GLU 79 9.072 -0.549 1.624
579 HA GLU 79 HA GLU 79 7.307 1.007 3.280
580 1HB GLU 79 1HB GLU 79 8.928 -1.418 3.561
581 2HB GLU 79 2HB GLU 79 8.903 -0.429 5.014
582 1HG GLU 79 1HG GLU 79 6.322 -0.396 4.564
583 2HG GLU 79 2HG GLU 79 6.684 -1.861 3.655
584 H SER 80 H SER 80 10.743 0.916 2.618
585 HA SER 80 HA SER 80 11.539 2.552 4.797
586 1HB SER 80 1HB SER 80 13.686 2.429 3.909
587 2HB SER 80 2HB SER 80 12.946 0.947 3.312
588 HG SER 80 HG SER 80 14.108 2.204 1.709
589 H SER 81 H SER 81 10.287 3.248 1.621
590 HA SER 81 HA SER 81 10.521 6.105 2.234
591 1HB SER 81 1HB SER 81 11.933 4.777 0.186
592 2HB SER 81 2HB SER 81 10.719 5.797 -0.575
593 HG SER 81 HG SER 81 11.680 7.544 0.180
594 H LEU 82 H LEU 82 8.997 7.469 1.232
595 HA LEU 82 HA LEU 82 6.486 6.094 0.614
596 1HB LEU 82 1HB LEU 82 7.222 8.655 1.889
597 2HB LEU 82 2HB LEU 82 5.729 8.620 0.966
598 HG LEU 82 HG LEU 82 5.235 6.477 2.359
599 1HD1 LEU 82 1HD1 LEU 82 7.473 7.757 3.846
600 2HD1 LEU 82 2HD1 LEU 82 6.167 6.971 4.736
601 3HD1 LEU 82 3HD1 LEU 82 7.126 6.047 3.579
602 1HD2 LEU 82 1HD2 LEU 82 4.907 9.328 2.975
603 2HD2 LEU 82 2HD2 LEU 82 3.701 8.059 2.768
604 3HD2 LEU 82 3HD2 LEU 82 4.578 8.203 4.293
605 H GLU 83 H GLU 83 8.889 6.998 -1.197
606 HA GLU 83 HA GLU 83 7.467 8.700 -3.080
607 1HB GLU 83 1HB GLU 83 10.272 7.916 -2.631
608 2HB GLU 83 2HB GLU 83 9.813 8.093 -4.318
609 1HG GLU 83 1HG GLU 83 10.635 10.185 -3.681
610 2HG GLU 83 2HG GLU 83 8.881 10.360 -3.682
611 HA PRO 84 HA PRO 84 6.339 5.425 -5.816
612 1HB PRO 84 1HB PRO 84 6.807 6.961 -8.210
613 2HB PRO 84 2HB PRO 84 5.276 6.664 -7.385
614 1HG PRO 84 1HG PRO 84 6.494 9.121 -7.541
615 2HG PRO 84 2HG PRO 84 5.353 8.651 -6.269
616 1HD PRO 84 1HD PRO 84 8.346 8.734 -6.197
617 2HD PRO 84 2HD PRO 84 7.176 9.199 -4.945
618 H TYR 85 H TYR 85 7.463 3.691 -6.329
619 HA TYR 85 HA TYR 85 10.119 4.006 -7.532
620 1HB TYR 85 1HB TYR 85 8.881 1.926 -5.768
621 2HB TYR 85 2HB TYR 85 10.256 1.507 -6.781
622 HD1 TYR 85 HD1 TYR 85 11.971 1.180 -5.210
623 HD2 TYR 85 HD2 TYR 85 9.612 4.720 -5.001
624 HE1 TYR 85 HE1 TYR 85 13.491 2.087 -3.507
625 HE2 TYR 85 HE2 TYR 85 11.131 5.635 -3.301
626 HH TYR 85 HH TYR 85 12.742 4.868 -1.664
627 HA PRO 86 HA PRO 86 8.298 2.362 -11.273
628 1HB PRO 86 1HB PRO 86 10.563 2.210 -12.738
629 2HB PRO 86 2HB PRO 86 9.760 3.747 -12.393
630 1HG PRO 86 1HG PRO 86 12.138 2.512 -11.057
631 2HG PRO 86 2HG PRO 86 11.882 4.195 -11.552
632 1HD PRO 86 1HD PRO 86 11.560 3.344 -8.993
633 2HD PRO 86 2HD PRO 86 10.626 4.683 -9.687
634 H ASP 87 H ASP 87 8.677 0.481 -12.743
635 HA ASP 87 HA ASP 87 9.170 -1.871 -11.184
636 1HB ASP 87 1HB ASP 87 7.760 -1.230 -13.549
637 2HB ASP 87 2HB ASP 87 8.892 -2.521 -13.923
No H/Q in entry = 637
Contact the webmaster for help, if required. Wednesday, June 26, 2024 12:30:04 AM GMT (wattos1)