NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
26376 |
2kj5   |
16312 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 H1 MET 1 -1.935 -14.587 15.262
2 H2 MET 1 H2 MET 1 -3.464 -13.881 15.113
3 H3 MET 1 H3 MET 1 -2.087 -13.012 14.648
4 HA MET 1 HA MET 1 -3.139 -15.470 13.374
5 HB2 MET 1 HB2 MET 1 -3.116 -12.569 12.547
6 HB3 MET 1 HB3 MET 1 -3.317 -13.870 11.382
7 HG2 MET 1 HG2 MET 1 -5.464 -12.980 11.990
8 HG3 MET 1 HG3 MET 1 -5.310 -14.627 12.593
9 HE1 MET 1 HE1 MET 1 -7.607 -12.739 13.612
10 HE2 MET 1 HE2 MET 1 -7.538 -13.011 15.354
11 HE3 MET 1 HE3 MET 1 -7.344 -14.366 14.239
12 H ALA 2 H ALA 2 -1.964 -16.242 11.610
13 HA ALA 2 HA ALA 2 -0.071 -16.980 10.611
14 HB1 ALA 2 HB1 ALA 2 1.743 -15.450 10.126
15 HB2 ALA 2 HB2 ALA 2 1.108 -14.292 11.295
16 HB3 ALA 2 HB3 ALA 2 0.190 -14.661 9.837
17 H GLU 3 H GLU 3 2.305 -17.476 11.067
18 HA GLU 3 HA GLU 3 2.521 -18.648 13.605
19 HB2 GLU 3 HB2 GLU 3 4.779 -18.003 11.700
20 HB3 GLU 3 HB3 GLU 3 4.820 -19.186 12.999
21 HG2 GLU 3 HG2 GLU 3 4.453 -20.539 11.200
22 HG3 GLU 3 HG3 GLU 3 2.796 -20.227 11.712
23 H LYS 4 H LYS 4 4.260 -15.828 12.285
24 HA LYS 4 HA LYS 4 4.062 -14.531 14.842
25 HB2 LYS 4 HB2 LYS 4 6.495 -14.024 15.021
26 HB3 LYS 4 HB3 LYS 4 6.088 -15.704 15.305
27 HG2 LYS 4 HG2 LYS 4 7.028 -14.808 12.608
28 HG3 LYS 4 HG3 LYS 4 8.176 -15.114 13.911
29 HD2 LYS 4 HD2 LYS 4 7.118 -17.386 14.158
30 HD3 LYS 4 HD3 LYS 4 6.232 -17.053 12.669
31 HE2 LYS 4 HE2 LYS 4 8.390 -16.715 11.507
32 HE3 LYS 4 HE3 LYS 4 9.230 -17.155 12.994
33 HZ1 LYS 4 HZ1 LYS 4 8.112 -19.328 12.898
34 HZ2 LYS 4 HZ2 LYS 4 9.092 -19.052 11.540
35 HZ3 LYS 4 HZ3 LYS 4 7.412 -18.892 11.415
36 H ASN 5 H ASN 5 5.512 -14.346 11.588
37 HA ASN 5 HA ASN 5 4.311 -11.716 11.280
38 HB2 ASN 5 HB2 ASN 5 6.462 -10.728 10.463
39 HB3 ASN 5 HB3 ASN 5 6.451 -11.092 12.182
40 HD21 ASN 5 HD21 ASN 5 8.702 -11.114 12.229
41 HD22 ASN 5 HD22 ASN 5 9.629 -12.412 11.549
42 H ALA 6 H ALA 6 4.275 -14.529 10.114
43 HA ALA 6 HA ALA 6 5.176 -14.017 7.377
44 HB1 ALA 6 HB1 ALA 6 4.271 -16.586 8.670
45 HB2 ALA 6 HB2 ALA 6 5.945 -16.077 8.445
46 HB3 ALA 6 HB3 ALA 6 4.931 -16.420 7.044
47 H TYR 7 H TYR 7 2.860 -12.625 8.196
48 HA TYR 7 HA TYR 7 0.685 -14.099 6.913
49 HB2 TYR 7 HB2 TYR 7 -0.752 -12.193 7.744
50 HB3 TYR 7 HB3 TYR 7 -0.031 -13.208 8.985
51 HD1 TYR 7 HD2 TYR 7 0.011 -9.884 7.418
52 HD2 TYR 7 HD1 TYR 7 1.616 -12.326 10.511
53 HE1 TYR 7 HE2 TYR 7 0.914 -7.886 8.524
54 HE2 TYR 7 HE1 TYR 7 2.517 -10.328 11.627
55 HH TYR 7 HH TYR 7 1.571 -7.200 10.821
56 H THR 8 H THR 8 -0.817 -12.648 5.580
57 HA THR 8 HA THR 8 0.838 -11.626 3.427
58 HB THR 8 HB THR 8 -1.376 -11.567 2.196
59 HG1 THR 8 HG1 THR 8 -3.122 -12.621 3.202
60 HG21 THR 8 HG21 THR 8 0.175 -13.446 1.968
61 HG22 THR 8 HG22 THR 8 -1.498 -14.003 1.938
62 HG23 THR 8 HG23 THR 8 -0.527 -14.207 3.396
63 H VAL 9 H VAL 9 0.087 -9.653 2.239
64 HA VAL 9 HA VAL 9 -0.053 -7.457 4.032
65 HB VAL 9 HB VAL 9 1.075 -7.312 1.842
66 HG11 VAL 9 HG11 VAL 9 -0.244 -6.981 -0.196
67 HG12 VAL 9 HG12 VAL 9 -1.707 -7.378 0.705
68 HG13 VAL 9 HG13 VAL 9 -0.449 -8.595 0.487
69 HG21 VAL 9 HG21 VAL 9 0.241 -5.080 1.203
70 HG22 VAL 9 HG22 VAL 9 0.462 -5.260 2.944
71 HG23 VAL 9 HG23 VAL 9 -1.157 -5.332 2.250
72 H ALA 10 H ALA 10 -2.460 -9.333 2.363
73 HA ALA 10 HA ALA 10 -4.638 -7.552 2.591
74 HB1 ALA 10 HB1 ALA 10 -4.704 -9.566 1.193
75 HB2 ALA 10 HB2 ALA 10 -6.054 -9.518 2.326
76 HB3 ALA 10 HB3 ALA 10 -4.675 -10.570 2.644
77 H GLN 11 H GLN 11 -3.257 -9.937 4.799
78 HA GLN 11 HA GLN 11 -5.213 -9.453 6.851
79 HB2 GLN 11 HB2 GLN 11 -3.765 -11.580 6.467
80 HB3 GLN 11 HB3 GLN 11 -2.506 -10.691 7.310
81 HG2 GLN 11 HG2 GLN 11 -5.227 -11.132 8.499
82 HG3 GLN 11 HG3 GLN 11 -3.919 -12.297 8.673
83 HE21 GLN 11 HE21 GLN 11 -5.372 -10.674 10.648
84 HE22 GLN 11 HE22 GLN 11 -4.151 -9.795 11.506
85 H LEU 12 H LEU 12 -1.947 -8.407 6.077
86 HA LEU 12 HA LEU 12 -1.359 -6.889 8.334
87 HB2 LEU 12 HB2 LEU 12 0.289 -7.363 6.617
88 HB3 LEU 12 HB3 LEU 12 -0.606 -6.410 5.450
89 HG LEU 12 HG LEU 12 -0.148 -4.379 6.791
90 HD11 LEU 12 HD11 LEU 12 1.550 -4.472 8.554
91 HD12 LEU 12 HD12 LEU 12 1.572 -6.231 8.433
92 HD13 LEU 12 HD13 LEU 12 0.113 -5.404 8.978
93 HD21 LEU 12 HD21 LEU 12 2.225 -4.211 6.217
94 HD22 LEU 12 HD22 LEU 12 1.291 -4.956 4.920
95 HD23 LEU 12 HD23 LEU 12 2.286 -5.957 5.976
96 H ALA 13 H ALA 13 -3.433 -6.173 5.609
97 HA ALA 13 HA ALA 13 -3.773 -3.429 5.929
98 HB1 ALA 13 HB1 ALA 13 -4.639 -4.707 4.021
99 HB2 ALA 13 HB2 ALA 13 -5.882 -3.695 4.757
100 HB3 ALA 13 HB3 ALA 13 -5.859 -5.431 5.068
101 H ASP 14 H ASP 14 -5.314 -6.117 7.627
102 HA ASP 14 HA ASP 14 -7.203 -4.582 9.082
103 HB2 ASP 14 HB2 ASP 14 -7.418 -7.013 8.872
104 HB3 ASP 14 HB3 ASP 14 -5.912 -7.242 9.751
105 H GLU 15 H GLU 15 -3.977 -5.775 9.838
106 HA GLU 15 HA GLU 15 -3.672 -4.662 12.391
107 HB2 GLU 15 HB2 GLU 15 -2.158 -6.354 11.565
108 HB3 GLU 15 HB3 GLU 15 -1.661 -5.324 10.231
109 HG2 GLU 15 HG2 GLU 15 0.106 -5.193 11.721
110 HG3 GLU 15 HG3 GLU 15 -0.810 -3.721 12.030
111 H TYR 16 H TYR 16 -2.701 -3.435 9.211
112 HA TYR 16 HA TYR 16 -1.470 -1.077 10.027
113 HB2 TYR 16 HB2 TYR 16 -1.237 -1.974 7.767
114 HB3 TYR 16 HB3 TYR 16 -2.940 -1.671 7.448
115 HD1 TYR 16 HD1 TYR 16 0.270 0.029 8.213
116 HD2 TYR 16 HD2 TYR 16 -3.641 0.395 6.590
117 HE1 TYR 16 HE1 TYR 16 0.839 2.262 7.358
118 HE2 TYR 16 HE2 TYR 16 -3.084 2.630 5.729
119 HH TYR 16 HH TYR 16 0.042 3.789 5.504
120 H PHE 17 H PHE 17 -4.857 -1.636 9.085
121 HA PHE 17 HA PHE 17 -5.675 1.051 9.309
122 HB2 PHE 17 HB2 PHE 17 -6.957 -0.764 8.152
123 HB3 PHE 17 HB3 PHE 17 -7.384 -1.409 9.734
124 HD1 PHE 17 HD1 PHE 17 -7.762 1.499 7.490
125 HD2 PHE 17 HD2 PHE 17 -9.150 -0.474 11.000
126 HE1 PHE 17 HE1 PHE 17 -9.703 3.010 7.569
127 HE2 PHE 17 HE2 PHE 17 -11.091 1.034 11.083
128 HZ PHE 17 HZ PHE 17 -11.371 2.778 9.366
129 H GLU 18 H GLU 18 -5.620 -1.606 11.635
130 HA GLU 18 HA GLU 18 -6.968 -0.140 13.683
131 HB2 GLU 18 HB2 GLU 18 -7.009 -2.601 13.533
132 HB3 GLU 18 HB3 GLU 18 -5.285 -2.646 13.863
133 HG2 GLU 18 HG2 GLU 18 -6.595 -3.204 15.834
134 HG3 GLU 18 HG3 GLU 18 -5.661 -1.728 16.073
135 H ARG 19 H ARG 19 -3.672 -0.299 12.633
136 HA ARG 19 HA ARG 19 -2.779 0.790 15.204
137 HB2 ARG 19 HB2 ARG 19 -1.218 -0.383 12.910
138 HB3 ARG 19 HB3 ARG 19 -0.465 0.403 14.290
139 HG2 ARG 19 HG2 ARG 19 -2.095 -2.121 14.268
140 HG3 ARG 19 HG3 ARG 19 -0.397 -1.921 14.712
141 HD2 ARG 19 HD2 ARG 19 -1.174 -0.439 16.587
142 HD3 ARG 19 HD3 ARG 19 -2.821 -0.931 16.205
143 HE ARG 19 HE ARG 19 -0.831 -2.444 17.611
144 HH11 ARG 19 HH11 ARG 19 -3.677 -2.737 15.596
145 HH12 ARG 19 HH12 ARG 19 -4.162 -4.253 16.282
146 HH21 ARG 19 HH21 ARG 19 -1.469 -4.406 18.534
147 HH22 ARG 19 HH22 ARG 19 -2.917 -5.193 17.995
148 H MET 20 H MET 20 -2.423 1.518 11.711
149 HA MET 20 HA MET 20 -1.056 3.984 12.372
150 HB2 MET 20 HB2 MET 20 -0.453 2.538 10.415
151 HB3 MET 20 HB3 MET 20 -1.967 3.011 9.662
152 HG2 MET 20 HG2 MET 20 -0.332 4.368 8.692
153 HG3 MET 20 HG3 MET 20 -1.166 5.397 9.851
154 HE1 MET 20 HE1 MET 20 -0.041 6.608 11.812
155 HE2 MET 20 HE2 MET 20 1.425 6.040 12.611
156 HE3 MET 20 HE3 MET 20 -0.031 5.044 12.628
157 H ILE 21 H ILE 21 -4.256 2.989 11.416
158 HA ILE 21 HA ILE 21 -5.125 5.698 10.899
159 HB ILE 21 HB ILE 21 -6.535 3.037 10.899
160 HG12 ILE 21 HG12 ILE 21 -7.088 3.791 8.553
161 HG13 ILE 21 HG13 ILE 21 -6.030 5.170 8.819
162 HG21 ILE 21 HG21 ILE 21 -7.899 5.704 10.581
163 HG22 ILE 21 HG22 ILE 21 -8.091 4.601 11.944
164 HG23 ILE 21 HG23 ILE 21 -8.635 4.119 10.336
165 HD11 ILE 21 HD11 ILE 21 -4.151 3.629 9.166
166 HD12 ILE 21 HD12 ILE 21 -4.890 3.453 7.574
167 HD13 ILE 21 HD13 ILE 21 -5.227 2.271 8.838
168 H ALA 22 H ALA 22 -4.756 3.647 13.598
169 HA ALA 22 HA ALA 22 -6.650 5.049 15.267
170 HB1 ALA 22 HB1 ALA 22 -5.748 3.706 17.091
171 HB2 ALA 22 HB2 ALA 22 -4.469 3.112 16.031
172 HB3 ALA 22 HB3 ALA 22 -6.152 2.699 15.702
173 H GLY 23 H GLY 23 -3.664 5.769 14.020
174 HA2 GLY 23 HA2 GLY 23 -2.728 7.254 16.355
175 HA3 GLY 23 HA3 GLY 23 -1.834 7.000 14.862
176 H ARG 24 H ARG 24 -2.992 8.043 12.884
177 HA ARG 24 HA ARG 24 -4.403 10.493 13.510
178 HB2 ARG 24 HB2 ARG 24 -1.824 10.834 13.681
179 HB3 ARG 24 HB3 ARG 24 -1.861 10.743 11.927
180 HG2 ARG 24 HG2 ARG 24 -3.510 12.683 13.525
181 HG3 ARG 24 HG3 ARG 24 -1.905 13.048 12.898
182 HD2 ARG 24 HD2 ARG 24 -2.668 12.765 10.634
183 HD3 ARG 24 HD3 ARG 24 -4.241 12.195 11.191
184 HE ARG 24 HE ARG 24 -3.952 14.691 12.302
185 HH11 ARG 24 HH11 ARG 24 -3.903 13.403 9.036
186 HH12 ARG 24 HH12 ARG 24 -4.575 14.841 8.330
187 HH21 ARG 24 HH21 ARG 24 -4.813 16.566 11.382
188 HH22 ARG 24 HH22 ARG 24 -5.081 16.656 9.667
189 H TRP 25 H TRP 25 -6.063 10.151 12.183
190 HA TRP 25 HA TRP 25 -5.474 9.510 9.376
191 HB2 TRP 25 HB2 TRP 25 -7.330 8.004 9.299
192 HB3 TRP 25 HB3 TRP 25 -6.393 7.580 10.724
193 HD1 TRP 25 HD1 TRP 25 -9.839 8.259 9.642
194 HE1 TRP 25 HE1 TRP 25 -11.416 8.533 11.655
195 HE3 TRP 25 HE3 TRP 25 -6.357 8.787 13.361
196 HZ2 TRP 25 HZ2 TRP 25 -11.223 8.938 14.431
197 HZ3 TRP 25 HZ3 TRP 25 -7.148 9.129 15.664
198 HH2 TRP 25 HH2 TRP 25 -9.528 9.204 16.185
199 H LYS 26 H LYS 26 -7.921 10.827 11.574
200 HA LYS 26 HA LYS 26 -9.313 12.570 11.523
201 HB2 LYS 26 HB2 LYS 26 -7.083 13.682 10.958
202 HB3 LYS 26 HB3 LYS 26 -7.693 13.788 9.314
203 HG2 LYS 26 HG2 LYS 26 -8.102 15.869 10.416
204 HG3 LYS 26 HG3 LYS 26 -9.647 15.055 10.169
205 HD2 LYS 26 HD2 LYS 26 -8.125 14.832 12.759
206 HD3 LYS 26 HD3 LYS 26 -9.234 16.163 12.445
207 HE2 LYS 26 HE2 LYS 26 -11.047 14.541 12.068
208 HE3 LYS 26 HE3 LYS 26 -9.928 13.229 12.423
209 HZ1 LYS 26 HZ1 LYS 26 -10.898 15.323 14.284
210 HZ2 LYS 26 HZ2 LYS 26 -9.616 14.279 14.654
211 HZ3 LYS 26 HZ3 LYS 26 -11.164 13.651 14.375
212 H HIS 27 H HIS 27 -8.913 10.819 8.607
213 HA HIS 27 HA HIS 27 -11.562 11.679 7.707
214 HB2 HIS 27 HB2 HIS 27 -9.135 11.420 5.912
215 HB3 HIS 27 HB3 HIS 27 -10.787 11.604 5.333
216 HD1 HIS 27 HD1 HIS 27 -7.996 13.551 5.429
217 HD2 HIS 27 HD2 HIS 27 -11.817 14.154 6.962
218 HE1 HIS 27 HE1 HIS 27 -8.225 16.036 5.726
219 HE2 HIS 27 HE2 HIS 27 -10.596 16.392 6.491
220 HA PRO 28 HA PRO 28 -11.165 7.182 8.343
221 HB2 PRO 28 HB2 PRO 28 -14.093 7.448 8.649
222 HB3 PRO 28 HB3 PRO 28 -12.907 6.734 9.746
223 HG2 PRO 28 HG2 PRO 28 -14.029 9.077 10.317
224 HG3 PRO 28 HG3 PRO 28 -12.316 8.791 10.655
225 HD2 PRO 28 HD2 PRO 28 -13.579 10.249 8.358
226 HD3 PRO 28 HD3 PRO 28 -12.190 10.724 9.363
227 H ASN 29 H ASN 29 -13.739 8.742 6.434
228 HA ASN 29 HA ASN 29 -14.483 6.417 5.026
229 HB2 ASN 29 HB2 ASN 29 -15.679 7.896 3.494
230 HB3 ASN 29 HB3 ASN 29 -15.945 8.390 5.160
231 HD21 ASN 29 HD21 ASN 29 -16.081 9.809 2.543
232 HD22 ASN 29 HD22 ASN 29 -15.106 11.230 2.764
233 H ILE 30 H ILE 30 -12.043 8.853 4.430
234 HA ILE 30 HA ILE 30 -11.427 8.026 1.778
235 HB ILE 30 HB ILE 30 -9.789 9.600 3.771
236 HG12 ILE 30 HG12 ILE 30 -11.472 10.448 1.402
237 HG13 ILE 30 HG13 ILE 30 -11.866 10.704 3.098
238 HG21 ILE 30 HG21 ILE 30 -8.420 10.287 1.844
239 HG22 ILE 30 HG22 ILE 30 -9.312 9.157 0.825
240 HG23 ILE 30 HG23 ILE 30 -8.316 8.553 2.149
241 HD11 ILE 30 HD11 ILE 30 -11.028 12.730 2.032
242 HD12 ILE 30 HD12 ILE 30 -9.517 11.903 1.651
243 HD13 ILE 30 HD13 ILE 30 -9.963 12.193 3.332
244 H VAL 31 H VAL 31 -9.797 7.479 4.904
245 HA VAL 31 HA VAL 31 -7.748 5.893 3.781
246 HB VAL 31 HB VAL 31 -7.209 5.233 6.106
247 HG11 VAL 31 HG11 VAL 31 -6.641 7.481 6.897
248 HG12 VAL 31 HG12 VAL 31 -7.740 8.172 5.702
249 HG13 VAL 31 HG13 VAL 31 -6.306 7.289 5.176
250 HG21 VAL 31 HG21 VAL 31 -9.616 6.891 6.843
251 HG22 VAL 31 HG22 VAL 31 -8.448 6.197 7.969
252 HG23 VAL 31 HG23 VAL 31 -9.481 5.140 7.005
253 H ARG 32 H ARG 32 -10.915 5.075 5.081
254 HA ARG 32 HA ARG 32 -10.374 2.294 5.353
255 HB2 ARG 32 HB2 ARG 32 -12.359 3.891 6.254
256 HB3 ARG 32 HB3 ARG 32 -13.172 3.145 4.886
257 HG2 ARG 32 HG2 ARG 32 -11.893 1.702 7.203
258 HG3 ARG 32 HG3 ARG 32 -13.622 1.901 6.911
259 HD2 ARG 32 HD2 ARG 32 -13.497 0.559 4.929
260 HD3 ARG 32 HD3 ARG 32 -11.739 0.492 5.029
261 HE ARG 32 HE ARG 32 -13.234 -0.620 7.274
262 HH11 ARG 32 HH11 ARG 32 -11.465 -1.153 4.317
263 HH12 ARG 32 HH12 ARG 32 -11.177 -2.842 4.615
264 HH21 ARG 32 HH21 ARG 32 -12.844 -2.843 7.715
265 HH22 ARG 32 HH22 ARG 32 -11.979 -3.809 6.554
266 H SER 33 H SER 33 -11.980 4.229 2.835
267 HA SER 33 HA SER 33 -12.681 2.015 1.218
268 HB2 SER 33 HB2 SER 33 -12.979 3.774 -0.568
269 HB3 SER 33 HB3 SER 33 -13.885 4.052 0.920
270 HG SER 33 HG SER 33 -12.696 5.756 1.354
271 H ARG 34 H ARG 34 -9.842 4.060 1.402
272 HA ARG 34 HA ARG 34 -8.500 3.340 -0.924
273 HB2 ARG 34 HB2 ARG 34 -7.798 4.463 1.667
274 HB3 ARG 34 HB3 ARG 34 -6.518 3.447 1.027
275 HG2 ARG 34 HG2 ARG 34 -6.159 5.741 0.396
276 HG3 ARG 34 HG3 ARG 34 -6.509 4.768 -1.032
277 HD2 ARG 34 HD2 ARG 34 -8.649 5.680 -1.267
278 HD3 ARG 34 HD3 ARG 34 -8.667 6.292 0.388
279 HE ARG 34 HE ARG 34 -6.579 7.601 -0.799
280 HH11 ARG 34 HH11 ARG 34 -9.982 7.221 -1.604
281 HH12 ARG 34 HH12 ARG 34 -10.132 8.829 -2.256
282 HH21 ARG 34 HH21 ARG 34 -6.779 9.706 -1.627
283 HH22 ARG 34 HH22 ARG 34 -8.308 10.235 -2.268
284 H ILE 35 H ILE 35 -8.660 1.704 2.194
285 HA ILE 35 HA ILE 35 -6.652 -0.175 1.864
286 HB ILE 35 HB ILE 35 -9.242 -0.494 3.390
287 HG12 ILE 35 HG12 ILE 35 -7.966 1.465 4.103
288 HG13 ILE 35 HG13 ILE 35 -7.916 0.214 5.339
289 HG21 ILE 35 HG21 ILE 35 -8.049 -2.169 4.717
290 HG22 ILE 35 HG22 ILE 35 -6.652 -2.015 3.651
291 HG23 ILE 35 HG23 ILE 35 -8.175 -2.644 3.023
292 HD11 ILE 35 HD11 ILE 35 -5.674 -0.416 4.608
293 HD12 ILE 35 HD12 ILE 35 -5.757 1.282 5.082
294 HD13 ILE 35 HD13 ILE 35 -5.726 0.842 3.374
295 H GLU 36 H GLU 36 -10.135 -0.610 1.199
296 HA GLU 36 HA GLU 36 -9.702 -3.287 0.277
297 HB2 GLU 36 HB2 GLU 36 -12.172 -1.556 0.136
298 HB3 GLU 36 HB3 GLU 36 -12.115 -3.272 -0.234
299 HG2 GLU 36 HG2 GLU 36 -11.591 -1.994 2.437
300 HG3 GLU 36 HG3 GLU 36 -13.013 -2.922 1.969
301 H LYS 37 H LYS 37 -9.720 -0.182 -1.236
302 HA LYS 37 HA LYS 37 -10.511 -1.248 -3.813
303 HB2 LYS 37 HB2 LYS 37 -11.362 0.916 -3.314
304 HB3 LYS 37 HB3 LYS 37 -9.757 1.521 -2.913
305 HG2 LYS 37 HG2 LYS 37 -9.061 1.330 -5.202
306 HG3 LYS 37 HG3 LYS 37 -10.592 0.577 -5.640
307 HD2 LYS 37 HD2 LYS 37 -11.785 2.596 -5.235
308 HD3 LYS 37 HD3 LYS 37 -10.360 3.356 -4.511
309 HE2 LYS 37 HE2 LYS 37 -9.235 3.452 -6.559
310 HE3 LYS 37 HE3 LYS 37 -10.337 2.313 -7.314
311 HZ1 LYS 37 HZ1 LYS 37 -10.792 4.530 -8.094
312 HZ2 LYS 37 HZ2 LYS 37 -10.972 5.105 -6.506
313 HZ3 LYS 37 HZ3 LYS 37 -12.094 4.005 -7.144
314 H ASP 38 H ASP 38 -7.627 0.548 -2.663
315 HA ASP 38 HA ASP 38 -6.229 -0.636 -4.966
316 HB2 ASP 38 HB2 ASP 38 -6.701 1.864 -4.999
317 HB3 ASP 38 HB3 ASP 38 -5.501 2.001 -3.715
318 H ILE 39 H ILE 39 -5.946 0.160 -1.545
319 HA ILE 39 HA ILE 39 -3.235 -0.261 -1.136
320 HB ILE 39 HB ILE 39 -5.559 -0.888 0.685
321 HG12 ILE 39 HG12 ILE 39 -5.283 1.476 0.118
322 HG13 ILE 39 HG13 ILE 39 -4.891 1.193 1.809
323 HG21 ILE 39 HG21 ILE 39 -3.690 -2.269 1.373
324 HG22 ILE 39 HG22 ILE 39 -3.939 -0.964 2.533
325 HG23 ILE 39 HG23 ILE 39 -2.622 -0.866 1.365
326 HD11 ILE 39 HD11 ILE 39 -2.514 1.250 1.266
327 HD12 ILE 39 HD12 ILE 39 -3.330 2.741 0.793
328 HD13 ILE 39 HD13 ILE 39 -2.909 1.541 -0.428
329 H LYS 40 H LYS 40 -5.833 -2.625 -1.369
330 HA LYS 40 HA LYS 40 -3.826 -4.761 -1.514
331 HB2 LYS 40 HB2 LYS 40 -5.852 -6.284 -1.382
332 HB3 LYS 40 HB3 LYS 40 -5.537 -5.318 0.053
333 HG2 LYS 40 HG2 LYS 40 -7.216 -3.658 -1.140
334 HG3 LYS 40 HG3 LYS 40 -7.761 -5.152 -1.901
335 HD2 LYS 40 HD2 LYS 40 -7.496 -4.776 1.077
336 HD3 LYS 40 HD3 LYS 40 -8.993 -4.524 0.184
337 HE2 LYS 40 HE2 LYS 40 -8.843 -6.881 -0.600
338 HE3 LYS 40 HE3 LYS 40 -7.445 -7.094 0.455
339 HZ1 LYS 40 HZ1 LYS 40 -10.126 -6.226 1.413
340 HZ2 LYS 40 HZ2 LYS 40 -8.786 -6.662 2.363
341 HZ3 LYS 40 HZ3 LYS 40 -9.583 -7.833 1.438
342 HA PRO 41 HA PRO 41 -4.737 -3.603 -5.845
343 HB2 PRO 41 HB2 PRO 41 -2.065 -4.609 -6.443
344 HB3 PRO 41 HB3 PRO 41 -2.701 -2.971 -6.602
345 HG2 PRO 41 HG2 PRO 41 -0.855 -3.647 -4.739
346 HG3 PRO 41 HG3 PRO 41 -2.064 -2.376 -4.476
347 HD2 PRO 41 HD2 PRO 41 -2.057 -5.213 -3.505
348 HD3 PRO 41 HD3 PRO 41 -2.513 -3.727 -2.642
349 H ALA 42 H ALA 42 -2.719 -6.466 -5.239
350 HA ALA 42 HA ALA 42 -4.601 -8.287 -6.326
351 HB1 ALA 42 HB1 ALA 42 -3.837 -7.309 -8.444
352 HB2 ALA 42 HB2 ALA 42 -3.346 -8.998 -8.303
353 HB3 ALA 42 HB3 ALA 42 -2.172 -7.712 -8.024
354 H ILE 43 H ILE 43 -1.346 -7.508 -5.416
355 HA ILE 43 HA ILE 43 -0.610 -10.195 -4.726
356 HB ILE 43 HB ILE 43 1.324 -8.964 -3.574
357 HG12 ILE 43 HG12 ILE 43 0.263 -6.647 -5.195
358 HG13 ILE 43 HG13 ILE 43 -0.014 -6.801 -3.466
359 HG21 ILE 43 HG21 ILE 43 2.434 -8.526 -5.722
360 HG22 ILE 43 HG22 ILE 43 0.873 -8.620 -6.537
361 HG23 ILE 43 HG23 ILE 43 1.539 -10.045 -5.738
362 HD11 ILE 43 HD11 ILE 43 1.838 -5.303 -3.941
363 HD12 ILE 43 HD12 ILE 43 2.666 -6.586 -4.823
364 HD13 ILE 43 HD13 ILE 43 2.403 -6.738 -3.086
365 H GLY 44 H GLY 44 -3.039 -8.936 -3.446
366 HA2 GLY 44 HA2 GLY 44 -2.453 -8.326 -0.735
367 HA3 GLY 44 HA3 GLY 44 -4.025 -8.792 -1.377
368 H SER 45 H SER 45 -3.216 -11.289 -2.446
369 HA SER 45 HA SER 45 -3.247 -12.888 -0.042
370 HB2 SER 45 HB2 SER 45 -3.156 -13.836 -2.913
371 HB3 SER 45 HB3 SER 45 -3.730 -14.730 -1.505
372 HG SER 45 HG SER 45 -5.165 -12.572 -1.501
373 H LEU 46 H LEU 46 -0.841 -11.316 -1.018
374 HA LEU 46 HA LEU 46 1.118 -13.515 -0.922
375 HB2 LEU 46 HB2 LEU 46 1.021 -12.255 -3.093
376 HB3 LEU 46 HB3 LEU 46 1.466 -10.805 -2.218
377 HG LEU 46 HG LEU 46 3.617 -11.858 -1.607
378 HD11 LEU 46 HD11 LEU 46 2.910 -14.192 -1.676
379 HD12 LEU 46 HD12 LEU 46 4.297 -13.918 -2.731
380 HD13 LEU 46 HD13 LEU 46 2.682 -14.077 -3.421
381 HD21 LEU 46 HD21 LEU 46 3.004 -11.821 -4.559
382 HD22 LEU 46 HD22 LEU 46 4.610 -11.733 -3.839
383 HD23 LEU 46 HD23 LEU 46 3.453 -10.429 -3.576
384 H LYS 47 H LYS 47 3.206 -12.827 0.153
385 HA LYS 47 HA LYS 47 2.480 -11.474 2.612
386 HB2 LYS 47 HB2 LYS 47 5.019 -12.892 1.817
387 HB3 LYS 47 HB3 LYS 47 4.735 -12.171 3.392
388 HG2 LYS 47 HG2 LYS 47 2.779 -13.702 3.648
389 HG3 LYS 47 HG3 LYS 47 3.300 -14.507 2.165
390 HD2 LYS 47 HD2 LYS 47 4.837 -14.252 4.743
391 HD3 LYS 47 HD3 LYS 47 4.185 -15.727 4.026
392 HE2 LYS 47 HE2 LYS 47 5.691 -15.462 2.120
393 HE3 LYS 47 HE3 LYS 47 6.340 -13.988 2.831
394 HZ1 LYS 47 HZ1 LYS 47 7.291 -15.194 4.597
395 HZ2 LYS 47 HZ2 LYS 47 7.691 -16.053 3.189
396 HZ3 LYS 47 HZ3 LYS 47 6.451 -16.614 4.201
397 H VAL 48 H VAL 48 4.412 -10.224 3.614
398 HA VAL 48 HA VAL 48 4.705 -7.862 1.975
399 HB VAL 48 HB VAL 48 5.840 -8.331 4.734
400 HG11 VAL 48 HG11 VAL 48 6.716 -6.362 3.617
401 HG12 VAL 48 HG12 VAL 48 5.641 -5.888 4.934
402 HG13 VAL 48 HG13 VAL 48 5.078 -5.810 3.265
403 HG21 VAL 48 HG21 VAL 48 3.101 -7.306 3.996
404 HG22 VAL 48 HG22 VAL 48 3.786 -7.321 5.621
405 HG23 VAL 48 HG23 VAL 48 3.461 -8.841 4.786
406 H GLU 49 H GLU 49 6.592 -10.578 2.915
407 HA GLU 49 HA GLU 49 9.186 -9.494 2.501
408 HB2 GLU 49 HB2 GLU 49 8.263 -12.368 2.328
409 HB3 GLU 49 HB3 GLU 49 9.924 -11.827 2.517
410 HG2 GLU 49 HG2 GLU 49 9.460 -10.972 4.703
411 HG3 GLU 49 HG3 GLU 49 7.738 -11.301 4.511
412 H ASP 50 H ASP 50 6.701 -10.433 0.386
413 HA ASP 50 HA ASP 50 8.514 -11.226 -1.757
414 HB2 ASP 50 HB2 ASP 50 5.508 -11.355 -1.512
415 HB3 ASP 50 HB3 ASP 50 6.403 -11.859 -2.941
416 H VAL 51 H VAL 51 6.760 -8.466 -0.741
417 HA VAL 51 HA VAL 51 6.405 -7.473 -3.436
418 HB VAL 51 HB VAL 51 4.634 -6.950 -1.903
419 HG11 VAL 51 HG11 VAL 51 5.875 -6.987 0.196
420 HG12 VAL 51 HG12 VAL 51 4.918 -5.513 0.045
421 HG13 VAL 51 HG13 VAL 51 6.659 -5.466 -0.233
422 HG21 VAL 51 HG21 VAL 51 5.085 -5.311 -3.632
423 HG22 VAL 51 HG22 VAL 51 6.221 -4.476 -2.573
424 HG23 VAL 51 HG23 VAL 51 4.505 -4.518 -2.168
425 H LYS 52 H LYS 52 8.563 -7.485 -4.085
426 HA LYS 52 HA LYS 52 10.449 -5.669 -2.916
427 HB2 LYS 52 HB2 LYS 52 11.869 -6.240 -4.826
428 HB3 LYS 52 HB3 LYS 52 11.207 -7.682 -4.076
429 HG2 LYS 52 HG2 LYS 52 9.491 -7.762 -5.861
430 HG3 LYS 52 HG3 LYS 52 10.296 -6.399 -6.642
431 HD2 LYS 52 HD2 LYS 52 11.097 -8.365 -7.704
432 HD3 LYS 52 HD3 LYS 52 12.396 -7.795 -6.656
433 HE2 LYS 52 HE2 LYS 52 11.622 -9.415 -4.929
434 HE3 LYS 52 HE3 LYS 52 10.467 -10.045 -6.101
435 HZ1 LYS 52 HZ1 LYS 52 12.293 -11.459 -6.255
436 HZ2 LYS 52 HZ2 LYS 52 13.419 -10.201 -6.155
437 HZ3 LYS 52 HZ3 LYS 52 12.511 -10.409 -7.572
438 HA PRO 53 HA PRO 53 9.679 -1.705 -4.607
439 HB2 PRO 53 HB2 PRO 53 12.169 -2.067 -6.228
440 HB3 PRO 53 HB3 PRO 53 11.650 -0.683 -5.258
441 HG2 PRO 53 HG2 PRO 53 13.462 -2.393 -4.323
442 HG3 PRO 53 HG3 PRO 53 12.226 -1.700 -3.257
443 HD2 PRO 53 HD2 PRO 53 12.462 -4.447 -4.344
444 HD3 PRO 53 HD3 PRO 53 11.698 -3.887 -2.845
445 H ARG 54 H ARG 54 10.801 -4.012 -7.089
446 HA ARG 54 HA ARG 54 9.785 -2.626 -9.301
447 HB2 ARG 54 HB2 ARG 54 10.642 -5.422 -8.801
448 HB3 ARG 54 HB3 ARG 54 9.683 -5.112 -10.245
449 HG2 ARG 54 HG2 ARG 54 12.279 -3.779 -9.504
450 HG3 ARG 54 HG3 ARG 54 12.030 -4.982 -10.776
451 HD2 ARG 54 HD2 ARG 54 10.527 -3.463 -11.938
452 HD3 ARG 54 HD3 ARG 54 10.714 -2.269 -10.658
453 HE ARG 54 HE ARG 54 13.256 -2.891 -11.671
454 HH11 ARG 54 HH11 ARG 54 10.286 -1.344 -12.722
455 HH12 ARG 54 HH12 ARG 54 11.088 -0.210 -13.765
456 HH21 ARG 54 HH21 ARG 54 14.320 -1.393 -13.044
457 HH22 ARG 54 HH22 ARG 54 13.382 -0.245 -13.954
458 H HIS 55 H HIS 55 8.159 -4.668 -7.009
459 HA HIS 55 HA HIS 55 5.804 -5.068 -8.567
460 HB2 HIS 55 HB2 HIS 55 6.277 -5.210 -5.586
461 HB3 HIS 55 HB3 HIS 55 4.708 -5.524 -6.320
462 HD1 HIS 55 HD1 HIS 55 5.366 -7.315 -8.636
463 HD2 HIS 55 HD2 HIS 55 7.258 -7.635 -4.945
464 HE1 HIS 55 HE1 HIS 55 6.263 -9.662 -8.525
465 HE2 HIS 55 HE2 HIS 55 7.312 -9.873 -6.247
466 H ILE 56 H ILE 56 6.908 -2.603 -6.327
467 HA ILE 56 HA ILE 56 4.488 -1.146 -6.168
468 HB ILE 56 HB ILE 56 7.311 -0.084 -5.907
469 HG12 ILE 56 HG12 ILE 56 6.918 -1.964 -4.379
470 HG13 ILE 56 HG13 ILE 56 7.043 -0.448 -3.494
471 HG21 ILE 56 HG21 ILE 56 5.653 1.680 -6.183
472 HG22 ILE 56 HG22 ILE 56 6.294 1.674 -4.540
473 HG23 ILE 56 HG23 ILE 56 4.697 1.000 -4.865
474 HD11 ILE 56 HD11 ILE 56 4.485 -1.876 -4.188
475 HD12 ILE 56 HD12 ILE 56 4.617 -0.367 -3.286
476 HD13 ILE 56 HD13 ILE 56 5.272 -1.857 -2.609
477 H ASP 57 H ASP 57 7.248 -1.061 -8.349
478 HA ASP 57 HA ASP 57 6.522 1.175 -9.886
479 HB2 ASP 57 HB2 ASP 57 8.743 0.124 -10.005
480 HB3 ASP 57 HB3 ASP 57 8.031 -1.318 -10.720
481 H ASP 58 H ASP 58 5.597 -2.199 -10.032
482 HA ASP 58 HA ASP 58 4.174 -1.986 -12.502
483 HB2 ASP 58 HB2 ASP 58 5.126 -4.118 -11.708
484 HB3 ASP 58 HB3 ASP 58 3.999 -4.113 -10.357
485 H VAL 59 H VAL 59 3.214 -2.001 -9.069
486 HA VAL 59 HA VAL 59 0.433 -1.907 -9.661
487 HB VAL 59 HB VAL 59 0.049 -1.378 -7.315
488 HG11 VAL 59 HG11 VAL 59 1.047 -3.371 -6.325
489 HG12 VAL 59 HG12 VAL 59 2.159 -3.494 -7.688
490 HG13 VAL 59 HG13 VAL 59 0.425 -3.694 -7.944
491 HG21 VAL 59 HG21 VAL 59 1.893 0.160 -6.922
492 HG22 VAL 59 HG22 VAL 59 3.045 -1.167 -7.070
493 HG23 VAL 59 HG23 VAL 59 1.894 -1.141 -5.734
494 H LEU 60 H LEU 60 2.864 0.603 -9.116
495 HA LEU 60 HA LEU 60 1.093 2.785 -8.923
496 HB2 LEU 60 HB2 LEU 60 3.921 2.608 -9.948
497 HB3 LEU 60 HB3 LEU 60 3.055 4.126 -9.806
498 HG LEU 60 HG LEU 60 3.744 2.264 -7.527
499 HD11 LEU 60 HD11 LEU 60 5.254 4.046 -6.831
500 HD12 LEU 60 HD12 LEU 60 4.828 4.980 -8.265
501 HD13 LEU 60 HD13 LEU 60 5.681 3.446 -8.434
502 HD21 LEU 60 HD21 LEU 60 2.379 4.955 -7.527
503 HD22 LEU 60 HD22 LEU 60 2.902 4.071 -6.094
504 HD23 LEU 60 HD23 LEU 60 1.636 3.406 -7.125
505 H LYS 61 H LYS 61 2.474 1.115 -11.689
506 HA LYS 61 HA LYS 61 1.378 2.806 -13.677
507 HB2 LYS 61 HB2 LYS 61 3.226 1.420 -14.222
508 HB3 LYS 61 HB3 LYS 61 2.425 -0.014 -13.607
509 HG2 LYS 61 HG2 LYS 61 0.748 0.312 -15.481
510 HG3 LYS 61 HG3 LYS 61 1.908 1.464 -16.154
511 HD2 LYS 61 HD2 LYS 61 2.203 -0.785 -17.073
512 HD3 LYS 61 HD3 LYS 61 3.626 -0.252 -16.187
513 HE2 LYS 61 HE2 LYS 61 2.816 -1.532 -14.227
514 HE3 LYS 61 HE3 LYS 61 1.472 -2.124 -15.202
515 HZ1 LYS 61 HZ1 LYS 61 3.249 -3.733 -15.109
516 HZ2 LYS 61 HZ2 LYS 61 4.354 -2.607 -15.737
517 HZ3 LYS 61 HZ3 LYS 61 3.066 -3.159 -16.696
518 H ALA 62 H ALA 62 0.340 -0.132 -12.039
519 HA ALA 62 HA ALA 62 -1.937 -0.667 -13.614
520 HB1 ALA 62 HB1 ALA 62 -1.416 -1.464 -10.752
521 HB2 ALA 62 HB2 ALA 62 -0.864 -2.342 -12.179
522 HB3 ALA 62 HB3 ALA 62 -2.590 -2.195 -11.847
523 H VAL 63 H VAL 63 -1.566 1.092 -10.534
524 HA VAL 63 HA VAL 63 -4.333 1.532 -10.153
525 HB VAL 63 HB VAL 63 -2.849 1.714 -8.267
526 HG11 VAL 63 HG11 VAL 63 -0.861 2.541 -9.403
527 HG12 VAL 63 HG12 VAL 63 -1.260 3.537 -8.002
528 HG13 VAL 63 HG13 VAL 63 -1.636 4.109 -9.626
529 HG21 VAL 63 HG21 VAL 63 -4.060 4.396 -8.907
530 HG22 VAL 63 HG22 VAL 63 -3.597 3.830 -7.302
531 HG23 VAL 63 HG23 VAL 63 -4.898 3.026 -8.181
532 H MET 64 H MET 64 -1.872 3.372 -11.882
533 HA MET 64 HA MET 64 -3.525 5.636 -12.374
534 HB2 MET 64 HB2 MET 64 -1.103 4.580 -13.846
535 HB3 MET 64 HB3 MET 64 -1.897 6.099 -14.239
536 HG2 MET 64 HG2 MET 64 -1.409 6.943 -12.009
537 HG3 MET 64 HG3 MET 64 -0.635 5.414 -11.596
538 HE1 MET 64 HE1 MET 64 0.757 8.276 -11.244
539 HE2 MET 64 HE2 MET 64 2.382 7.907 -11.824
540 HE3 MET 64 HE3 MET 64 1.520 6.749 -10.809
541 H LYS 65 H LYS 65 -3.052 2.555 -13.941
542 HA LYS 65 HA LYS 65 -4.496 3.180 -16.306
543 HB2 LYS 65 HB2 LYS 65 -2.767 1.479 -16.279
544 HB3 LYS 65 HB3 LYS 65 -3.633 0.569 -15.058
545 HG2 LYS 65 HG2 LYS 65 -4.944 1.101 -17.678
546 HG3 LYS 65 HG3 LYS 65 -3.708 -0.154 -17.554
547 HD2 LYS 65 HD2 LYS 65 -6.169 0.030 -15.822
548 HD3 LYS 65 HD3 LYS 65 -5.994 -1.018 -17.221
549 HE2 LYS 65 HE2 LYS 65 -4.158 -1.105 -14.842
550 HE3 LYS 65 HE3 LYS 65 -5.594 -2.111 -14.998
551 HZ1 LYS 65 HZ1 LYS 65 -4.657 -3.043 -17.038
552 HZ2 LYS 65 HZ2 LYS 65 -3.643 -3.310 -15.706
553 HZ3 LYS 65 HZ3 LYS 65 -3.253 -2.106 -16.833
554 H ARG 66 H ARG 66 -5.252 1.341 -13.355
555 HA ARG 66 HA ARG 66 -7.962 0.870 -14.280
556 HB2 ARG 66 HB2 ARG 66 -8.226 -0.526 -12.354
557 HB3 ARG 66 HB3 ARG 66 -6.652 -0.862 -13.058
558 HG2 ARG 66 HG2 ARG 66 -5.580 0.496 -11.338
559 HG3 ARG 66 HG3 ARG 66 -7.160 0.864 -10.638
560 HD2 ARG 66 HD2 ARG 66 -7.520 -1.535 -10.248
561 HD3 ARG 66 HD3 ARG 66 -5.917 -1.872 -10.894
562 HE ARG 66 HE ARG 66 -5.649 -0.033 -8.794
563 HH11 ARG 66 HH11 ARG 66 -6.557 -3.387 -9.319
564 HH12 ARG 66 HH12 ARG 66 -6.072 -3.896 -7.727
565 HH21 ARG 66 HH21 ARG 66 -5.014 -0.676 -6.725
566 HH22 ARG 66 HH22 ARG 66 -5.198 -2.341 -6.240
567 H GLY 67 H GLY 67 -6.423 3.339 -12.629
568 HA2 GLY 67 HA2 GLY 67 -9.016 4.336 -11.679
569 HA3 GLY 67 HA3 GLY 67 -7.652 4.309 -10.572
570 H ALA 68 H ALA 68 -6.188 5.921 -10.627
571 HA ALA 68 HA ALA 68 -6.047 7.786 -12.821
572 HB1 ALA 68 HB1 ALA 68 -6.782 9.734 -11.544
573 HB2 ALA 68 HB2 ALA 68 -7.170 8.699 -10.170
574 HB3 ALA 68 HB3 ALA 68 -8.082 8.548 -11.672
575 HA PRO 69 HA PRO 69 -1.991 8.408 -11.142
576 HB2 PRO 69 HB2 PRO 69 -1.558 11.059 -11.661
577 HB3 PRO 69 HB3 PRO 69 -1.465 9.792 -12.889
578 HG2 PRO 69 HG2 PRO 69 -3.713 11.672 -12.274
579 HG3 PRO 69 HG3 PRO 69 -3.078 11.160 -13.850
580 HD2 PRO 69 HD2 PRO 69 -5.324 10.104 -12.809
581 HD3 PRO 69 HD3 PRO 69 -4.198 9.140 -13.788
582 H SER 70 H SER 70 -4.580 10.537 -10.146
583 HA SER 70 HA SER 70 -3.302 11.882 -8.050
584 HB2 SER 70 HB2 SER 70 -6.217 11.109 -8.039
585 HB3 SER 70 HB3 SER 70 -5.469 12.576 -7.403
586 HG SER 70 HG SER 70 -4.944 13.125 -9.603
587 H ILE 71 H ILE 71 -5.344 8.958 -7.976
588 HA ILE 71 HA ILE 71 -4.970 8.522 -5.200
589 HB ILE 71 HB ILE 71 -5.944 6.265 -5.616
590 HG12 ILE 71 HG12 ILE 71 -6.161 7.249 -8.471
591 HG13 ILE 71 HG13 ILE 71 -5.098 5.958 -7.923
592 HG21 ILE 71 HG21 ILE 71 -7.450 8.611 -6.762
593 HG22 ILE 71 HG22 ILE 71 -7.338 8.176 -5.057
594 HG23 ILE 71 HG23 ILE 71 -8.171 7.108 -6.188
595 HD11 ILE 71 HD11 ILE 71 -7.056 4.646 -7.266
596 HD12 ILE 71 HD12 ILE 71 -7.077 5.059 -8.981
597 HD13 ILE 71 HD13 ILE 71 -8.105 5.938 -7.848
598 H ALA 72 H ALA 72 -3.194 7.568 -8.031
599 HA ALA 72 HA ALA 72 -1.681 5.451 -7.079
600 HB1 ALA 72 HB1 ALA 72 0.026 6.130 -8.693
601 HB2 ALA 72 HB2 ALA 72 -0.762 7.698 -8.871
602 HB3 ALA 72 HB3 ALA 72 -1.591 6.230 -9.392
603 H ASN 73 H ASN 73 -1.093 8.934 -6.709
604 HA ASN 73 HA ASN 73 1.278 8.619 -5.147
605 HB2 ASN 73 HB2 ASN 73 -0.599 10.970 -5.483
606 HB3 ASN 73 HB3 ASN 73 0.907 11.041 -4.575
607 HD21 ASN 73 HD21 ASN 73 -0.546 10.845 -7.713
608 HD22 ASN 73 HD22 ASN 73 0.888 11.174 -8.612
609 H ASP 74 H ASP 74 -2.126 8.927 -4.494
610 HA ASP 74 HA ASP 74 -2.060 9.437 -1.738
611 HB2 ASP 74 HB2 ASP 74 -4.059 9.549 -3.311
612 HB3 ASP 74 HB3 ASP 74 -4.162 7.800 -3.165
613 H THR 75 H THR 75 -2.416 6.336 -3.474
614 HA THR 75 HA THR 75 -2.383 4.658 -1.242
615 HB THR 75 HB THR 75 -1.337 4.019 -4.010
616 HG1 THR 75 HG1 THR 75 -3.516 3.255 -4.330
617 HG21 THR 75 HG21 THR 75 -2.431 2.229 -1.837
618 HG22 THR 75 HG22 THR 75 -0.744 2.333 -2.339
619 HG23 THR 75 HG23 THR 75 -1.960 1.712 -3.455
620 H LEU 76 H LEU 76 0.291 5.691 -3.342
621 HA LEU 76 HA LEU 76 2.362 4.266 -2.145
622 HB2 LEU 76 HB2 LEU 76 2.552 5.483 -4.277
623 HB3 LEU 76 HB3 LEU 76 2.464 7.006 -3.417
624 HG LEU 76 HG LEU 76 4.591 6.410 -2.253
625 HD11 LEU 76 HD11 LEU 76 5.968 4.625 -3.232
626 HD12 LEU 76 HD12 LEU 76 4.599 4.130 -4.226
627 HD13 LEU 76 HD13 LEU 76 4.505 3.999 -2.469
628 HD21 LEU 76 HD21 LEU 76 6.023 6.855 -4.198
629 HD22 LEU 76 HD22 LEU 76 4.593 7.888 -4.174
630 HD23 LEU 76 HD23 LEU 76 4.663 6.505 -5.265
631 H ARG 77 H ARG 77 0.877 7.306 -1.268
632 HA ARG 77 HA ARG 77 2.717 8.209 0.643
633 HB2 ARG 77 HB2 ARG 77 0.892 9.546 -0.360
634 HB3 ARG 77 HB3 ARG 77 -0.276 8.609 0.556
635 HG2 ARG 77 HG2 ARG 77 0.664 9.466 2.640
636 HG3 ARG 77 HG3 ARG 77 1.849 10.400 1.718
637 HD2 ARG 77 HD2 ARG 77 -0.000 11.574 0.590
638 HD3 ARG 77 HD3 ARG 77 -1.149 10.681 1.581
639 HE ARG 77 HE ARG 77 0.834 12.274 2.999
640 HH11 ARG 77 HH11 ARG 77 -2.427 11.960 1.763
641 HH12 ARG 77 HH12 ARG 77 -3.063 13.266 2.724
642 HH21 ARG 77 HH21 ARG 77 0.005 13.981 4.289
643 HH22 ARG 77 HH22 ARG 77 -1.675 14.411 4.176
644 H TRP 78 H TRP 78 -0.110 6.087 0.957
645 HA TRP 78 HA TRP 78 0.150 5.822 3.799
646 HB2 TRP 78 HB2 TRP 78 -1.384 4.048 1.889
647 HB3 TRP 78 HB3 TRP 78 -1.600 4.151 3.632
648 HD1 TRP 78 HD1 TRP 78 -3.232 5.249 0.642
649 HE1 TRP 78 HE1 TRP 78 -4.678 7.342 1.009
650 HE3 TRP 78 HE3 TRP 78 -1.361 6.731 5.169
651 HZ2 TRP 78 HZ2 TRP 78 -4.992 9.347 2.972
652 HZ3 TRP 78 HZ3 TRP 78 -2.293 8.751 6.219
653 HH2 TRP 78 HH2 TRP 78 -4.068 10.030 5.144
654 H LEU 79 H LEU 79 1.310 4.076 1.002
655 HA LEU 79 HA LEU 79 1.980 1.638 2.205
656 HB2 LEU 79 HB2 LEU 79 3.319 3.052 -0.100
657 HB3 LEU 79 HB3 LEU 79 3.590 1.376 0.336
658 HG LEU 79 HG LEU 79 0.980 2.555 -0.612
659 HD11 LEU 79 HD11 LEU 79 2.596 2.396 -2.400
660 HD12 LEU 79 HD12 LEU 79 1.369 1.145 -2.596
661 HD13 LEU 79 HD13 LEU 79 2.962 0.728 -1.962
662 HD21 LEU 79 HD21 LEU 79 1.706 -0.293 0.075
663 HD22 LEU 79 HD22 LEU 79 0.186 0.236 -0.647
664 HD23 LEU 79 HD23 LEU 79 0.613 0.752 0.984
665 H LYS 80 H LYS 80 3.752 4.669 2.011
666 HA LYS 80 HA LYS 80 6.246 3.849 2.949
667 HB2 LYS 80 HB2 LYS 80 4.893 6.442 3.698
668 HB3 LYS 80 HB3 LYS 80 6.620 6.130 3.606
669 HG2 LYS 80 HG2 LYS 80 6.424 5.812 1.185
670 HG3 LYS 80 HG3 LYS 80 4.699 6.173 1.292
671 HD2 LYS 80 HD2 LYS 80 6.978 8.025 1.976
672 HD3 LYS 80 HD3 LYS 80 5.902 8.130 0.589
673 HE2 LYS 80 HE2 LYS 80 4.008 8.543 2.046
674 HE3 LYS 80 HE3 LYS 80 5.044 8.375 3.462
675 HZ1 LYS 80 HZ1 LYS 80 5.276 10.472 1.372
676 HZ2 LYS 80 HZ2 LYS 80 6.316 10.295 2.696
677 HZ3 LYS 80 HZ3 LYS 80 4.686 10.693 2.947
678 H ARG 81 H ARG 81 3.548 5.182 4.817
679 HA ARG 81 HA ARG 81 4.547 4.720 7.379
680 HB2 ARG 81 HB2 ARG 81 1.724 4.825 6.335
681 HB3 ARG 81 HB3 ARG 81 2.084 4.626 8.045
682 HG2 ARG 81 HG2 ARG 81 3.329 6.750 8.000
683 HG3 ARG 81 HG3 ARG 81 2.880 6.951 6.305
684 HD2 ARG 81 HD2 ARG 81 0.578 7.140 6.845
685 HD3 ARG 81 HD3 ARG 81 0.853 6.600 8.501
686 HE ARG 81 HE ARG 81 2.373 8.900 8.119
687 HH11 ARG 81 HH11 ARG 81 -1.033 8.007 8.199
688 HH12 ARG 81 HH12 ARG 81 -1.547 9.575 8.739
689 HH21 ARG 81 HH21 ARG 81 1.681 10.937 8.835
690 HH22 ARG 81 HH22 ARG 81 -0.011 11.256 9.069
691 H MET 82 H MET 82 2.771 2.573 5.223
692 HA MET 82 HA MET 82 2.354 0.451 7.012
693 HB2 MET 82 HB2 MET 82 1.220 0.606 4.842
694 HB3 MET 82 HB3 MET 82 2.751 0.360 4.014
695 HG2 MET 82 HG2 MET 82 2.924 -1.868 4.982
696 HG3 MET 82 HG3 MET 82 1.395 -1.625 5.823
697 HE1 MET 82 HE1 MET 82 -0.943 -1.385 4.608
698 HE2 MET 82 HE2 MET 82 -1.149 -1.410 2.857
699 HE3 MET 82 HE3 MET 82 -0.319 -0.058 3.628
700 H PHE 83 H PHE 83 5.000 0.991 4.674
701 HA PHE 83 HA PHE 83 6.452 -1.328 5.364
702 HB2 PHE 83 HB2 PHE 83 7.433 1.271 4.164
703 HB3 PHE 83 HB3 PHE 83 8.379 -0.209 4.262
704 HD1 PHE 83 HD1 PHE 83 6.397 -2.247 3.527
705 HD2 PHE 83 HD2 PHE 83 7.097 1.625 1.903
706 HE1 PHE 83 HE1 PHE 83 5.482 -2.992 1.369
707 HE2 PHE 83 HE2 PHE 83 6.180 0.887 -0.258
708 HZ PHE 83 HZ PHE 83 5.369 -1.422 -0.526
709 H ASN 84 H ASN 84 6.489 1.954 6.619
710 HA ASN 84 HA ASN 84 8.716 1.791 8.289
711 HB2 ASN 84 HB2 ASN 84 7.684 3.918 7.962
712 HB3 ASN 84 HB3 ASN 84 6.134 3.335 8.559
713 HD21 ASN 84 HD21 ASN 84 5.756 3.275 10.739
714 HD22 ASN 84 HD22 ASN 84 6.844 3.937 11.908
715 H TYR 85 H TYR 85 5.346 0.911 8.922
716 HA TYR 85 HA TYR 85 5.823 0.061 11.601
717 HB2 TYR 85 HB2 TYR 85 3.602 0.786 10.777
718 HB3 TYR 85 HB3 TYR 85 3.540 -0.636 9.748
719 HD1 TYR 85 HD2 TYR 85 4.212 0.087 13.364
720 HD2 TYR 85 HD1 TYR 85 2.181 -2.330 10.509
721 HE1 TYR 85 HE2 TYR 85 3.161 -1.182 15.190
722 HE2 TYR 85 HE1 TYR 85 1.125 -3.600 12.329
723 HH TYR 85 HH TYR 85 1.155 -4.026 14.552
724 H ALA 86 H ALA 86 5.807 -1.507 8.467
725 HA ALA 86 HA ALA 86 5.959 -4.173 9.377
726 HB1 ALA 86 HB1 ALA 86 7.046 -3.014 6.812
727 HB2 ALA 86 HB2 ALA 86 5.385 -3.548 7.069
728 HB3 ALA 86 HB3 ALA 86 6.706 -4.715 7.134
729 H ILE 87 H ILE 87 8.433 -1.728 8.739
730 HA ILE 87 HA ILE 87 10.625 -3.519 9.105
731 HB ILE 87 HB ILE 87 10.512 -0.502 9.090
732 HG12 ILE 87 HG12 ILE 87 11.487 -2.538 7.072
733 HG13 ILE 87 HG13 ILE 87 10.016 -1.579 6.951
734 HG21 ILE 87 HG21 ILE 87 12.962 -0.547 8.918
735 HG22 ILE 87 HG22 ILE 87 12.943 -2.291 9.179
736 HG23 ILE 87 HG23 ILE 87 12.401 -1.202 10.457
737 HD11 ILE 87 HD11 ILE 87 11.768 -0.684 5.538
738 HD12 ILE 87 HD12 ILE 87 12.828 -0.509 6.937
739 HD13 ILE 87 HD13 ILE 87 11.355 0.454 6.818
740 H LYS 88 H LYS 88 8.918 -1.260 11.257
741 HA LYS 88 HA LYS 88 10.737 -1.657 13.421
742 HB2 LYS 88 HB2 LYS 88 9.086 -0.548 14.829
743 HB3 LYS 88 HB3 LYS 88 9.325 0.336 13.331
744 HG2 LYS 88 HG2 LYS 88 7.254 -0.538 12.444
745 HG3 LYS 88 HG3 LYS 88 7.031 -1.529 13.887
746 HD2 LYS 88 HD2 LYS 88 7.157 1.488 13.852
747 HD3 LYS 88 HD3 LYS 88 5.677 0.530 13.936
748 HE2 LYS 88 HE2 LYS 88 6.461 -0.470 16.032
749 HE3 LYS 88 HE3 LYS 88 7.915 0.523 15.956
750 HZ1 LYS 88 HZ1 LYS 88 6.404 1.588 17.410
751 HZ2 LYS 88 HZ2 LYS 88 5.117 1.428 16.328
752 HZ3 LYS 88 HZ3 LYS 88 6.389 2.496 15.979
753 H ARG 89 H ARG 89 8.128 -3.455 12.133
754 HA ARG 89 HA ARG 89 7.949 -5.223 14.451
755 HB2 ARG 89 HB2 ARG 89 5.995 -4.563 12.901
756 HB3 ARG 89 HB3 ARG 89 6.710 -5.663 11.734
757 HG2 ARG 89 HG2 ARG 89 4.985 -6.833 12.862
758 HG3 ARG 89 HG3 ARG 89 6.521 -7.472 13.452
759 HD2 ARG 89 HD2 ARG 89 6.346 -6.233 15.479
760 HD3 ARG 89 HD3 ARG 89 4.973 -5.312 14.865
761 HE ARG 89 HE ARG 89 4.941 -8.036 15.892
762 HH11 ARG 89 HH11 ARG 89 3.227 -5.471 14.254
763 HH12 ARG 89 HH12 ARG 89 1.648 -6.100 14.612
764 HH21 ARG 89 HH21 ARG 89 2.873 -8.873 16.402
765 HH22 ARG 89 HH22 ARG 89 1.445 -8.047 15.829
766 H HIS 90 H HIS 90 9.911 -4.714 11.878
767 HA HIS 90 HA HIS 90 11.508 -5.785 10.734
768 HB2 HIS 90 HB2 HIS 90 12.171 -6.311 13.155
769 HB3 HIS 90 HB3 HIS 90 11.542 -7.928 12.842
770 HD1 HIS 90 HD1 HIS 90 13.226 -9.527 11.975
771 HD2 HIS 90 HD2 HIS 90 14.201 -5.590 11.061
772 HE1 HIS 90 HE1 HIS 90 15.440 -9.633 10.787
773 HE2 HIS 90 HE2 HIS 90 15.894 -7.260 10.050
774 H ILE 91 H ILE 91 8.921 -6.349 9.899
775 HA ILE 91 HA ILE 91 8.810 -9.133 9.143
776 HB ILE 91 HB ILE 91 7.379 -6.776 7.883
777 HG12 ILE 91 HG12 ILE 91 6.381 -8.665 10.031
778 HG13 ILE 91 HG13 ILE 91 6.912 -7.010 10.321
779 HG21 ILE 91 HG21 ILE 91 6.814 -9.741 7.788
780 HG22 ILE 91 HG22 ILE 91 7.404 -8.741 6.461
781 HG23 ILE 91 HG23 ILE 91 5.783 -8.484 7.103
782 HD11 ILE 91 HD11 ILE 91 5.114 -6.166 8.941
783 HD12 ILE 91 HD12 ILE 91 4.477 -7.207 10.214
784 HD13 ILE 91 HD13 ILE 91 4.607 -7.811 8.562
785 H ILE 92 H ILE 92 9.742 -6.070 7.699
786 HA ILE 92 HA ILE 92 11.390 -7.523 5.748
787 HB ILE 92 HB ILE 92 11.071 -5.558 4.205
788 HG12 ILE 92 HG12 ILE 92 8.772 -4.955 6.085
789 HG13 ILE 92 HG13 ILE 92 10.212 -3.964 5.875
790 HG21 ILE 92 HG21 ILE 92 8.915 -6.351 3.342
791 HG22 ILE 92 HG22 ILE 92 8.637 -7.212 4.856
792 HG23 ILE 92 HG23 ILE 92 9.974 -7.683 3.807
793 HD11 ILE 92 HD11 ILE 92 8.140 -4.533 3.770
794 HD12 ILE 92 HD12 ILE 92 9.578 -3.533 3.563
795 HD13 ILE 92 HD13 ILE 92 8.312 -3.034 4.685
796 H GLU 93 H GLU 93 13.244 -6.198 4.975
797 HA GLU 93 HA GLU 93 14.379 -4.794 7.293
798 HB2 GLU 93 HB2 GLU 93 15.464 -6.869 6.292
799 HB3 GLU 93 HB3 GLU 93 15.862 -5.878 4.898
800 HG2 GLU 93 HG2 GLU 93 17.768 -6.020 6.332
801 HG3 GLU 93 HG3 GLU 93 17.141 -4.374 6.378
802 H TYR 94 H TYR 94 13.177 -4.190 4.165
803 HA TYR 94 HA TYR 94 14.573 -1.608 4.101
804 HB2 TYR 94 HB2 TYR 94 14.260 -3.564 1.835
805 HB3 TYR 94 HB3 TYR 94 14.581 -1.855 1.555
806 HD1 TYR 94 HD1 TYR 94 16.706 -0.858 2.355
807 HD2 TYR 94 HD2 TYR 94 15.987 -5.045 2.548
808 HE1 TYR 94 HE1 TYR 94 19.114 -1.250 2.652
809 HE2 TYR 94 HE2 TYR 94 18.393 -5.450 2.847
810 HH TYR 94 HH TYR 94 20.592 -2.993 3.611
811 H ASN 95 H ASN 95 13.588 -0.103 2.499
812 HA ASN 95 HA ASN 95 10.655 -0.173 2.704
813 HB2 ASN 95 HB2 ASN 95 12.516 2.152 2.135
814 HB3 ASN 95 HB3 ASN 95 10.765 2.258 2.258
815 HD21 ASN 95 HD21 ASN 95 9.791 2.128 4.269
816 HD22 ASN 95 HD22 ASN 95 10.684 2.281 5.745
817 HA PRO 96 HA PRO 96 11.329 -1.516 -1.653
818 HB2 PRO 96 HB2 PRO 96 8.357 -1.639 -1.400
819 HB3 PRO 96 HB3 PRO 96 9.479 -2.812 -2.106
820 HG2 PRO 96 HG2 PRO 96 8.427 -3.245 0.290
821 HG3 PRO 96 HG3 PRO 96 10.127 -3.635 -0.031
822 HD2 PRO 96 HD2 PRO 96 8.960 -1.332 1.470
823 HD3 PRO 96 HD3 PRO 96 10.442 -2.255 1.792
824 H ALA 97 H ALA 97 9.356 1.063 -0.374
825 HA ALA 97 HA ALA 97 8.665 2.158 -2.951
826 HB1 ALA 97 HB1 ALA 97 7.672 3.984 -1.690
827 HB2 ALA 97 HB2 ALA 97 8.412 3.383 -0.206
828 HB3 ALA 97 HB3 ALA 97 7.175 2.429 -1.025
829 H ALA 98 H ALA 98 11.438 2.200 -1.032
830 HA ALA 98 HA ALA 98 12.303 4.880 -1.459
831 HB1 ALA 98 HB1 ALA 98 14.441 4.145 -0.592
832 HB2 ALA 98 HB2 ALA 98 13.956 2.458 -0.759
833 HB3 ALA 98 HB3 ALA 98 13.129 3.505 0.396
834 H ALA 99 H ALA 99 12.034 2.315 -3.579
835 HA ALA 99 HA ALA 99 14.292 2.908 -5.253
836 HB1 ALA 99 HB1 ALA 99 11.748 1.417 -5.906
837 HB2 ALA 99 HB2 ALA 99 13.227 0.692 -5.271
838 HB3 ALA 99 HB3 ALA 99 13.223 1.431 -6.873
839 H PHE 100 H PHE 100 11.455 4.472 -4.534
840 HA PHE 100 HA PHE 100 11.539 6.030 -7.029
841 HB2 PHE 100 HB2 PHE 100 9.030 5.474 -5.436
842 HB3 PHE 100 HB3 PHE 100 9.150 6.220 -7.028
843 HD1 PHE 100 HD2 PHE 100 9.815 4.834 -8.982
844 HD2 PHE 100 HD1 PHE 100 8.943 3.137 -5.179
845 HE1 PHE 100 HE2 PHE 100 9.564 2.621 -10.028
846 HE2 PHE 100 HE1 PHE 100 8.690 0.925 -6.217
847 HZ PHE 100 HZ PHE 100 9.005 0.666 -8.643
848 H ASP 101 H ASP 101 10.019 8.123 -6.458
849 HA ASP 101 HA ASP 101 11.323 9.309 -4.125
850 HB2 ASP 101 HB2 ASP 101 11.292 10.475 -6.370
851 HB3 ASP 101 HB3 ASP 101 9.555 10.680 -6.159
852 HA PRO 102 HA PRO 102 7.347 8.516 -2.151
853 HB2 PRO 102 HB2 PRO 102 8.245 8.330 0.354
854 HB3 PRO 102 HB3 PRO 102 8.571 7.061 -0.832
855 HG2 PRO 102 HG2 PRO 102 10.371 9.208 0.191
856 HG3 PRO 102 HG3 PRO 102 10.749 7.528 -0.226
857 HD2 PRO 102 HD2 PRO 102 11.191 9.759 -1.852
858 HD3 PRO 102 HD3 PRO 102 11.178 8.069 -2.390
859 H GLY 103 H GLY 103 9.309 11.246 -2.028
860 HA2 GLY 103 HA2 GLY 103 9.056 13.383 -1.265
861 HA3 GLY 103 HA3 GLY 103 7.331 13.053 -1.327
862 H ASP 104 H ASP 104 6.729 14.074 0.476
863 HA ASP 104 HA ASP 104 7.398 12.765 2.998
864 HB2 ASP 104 HB2 ASP 104 8.907 14.780 2.714
865 HB3 ASP 104 HB3 ASP 104 7.462 15.784 2.718
866 H ALA 105 H ALA 105 5.893 15.663 3.616
867 HA ALA 105 HA ALA 105 3.790 16.365 4.037
868 HB1 ALA 105 HB1 ALA 105 3.688 16.356 1.589
869 HB2 ALA 105 HB2 ALA 105 2.120 16.033 2.327
870 HB3 ALA 105 HB3 ALA 105 3.055 14.710 1.630
871 H GLY 106 H GLY 106 3.723 15.195 6.048
872 HA2 GLY 106 HA2 GLY 106 1.549 14.320 7.022
873 HA3 GLY 106 HA3 GLY 106 1.800 12.950 5.951
874 H GLY 107 H GLY 107 2.443 14.293 8.995
875 HA2 GLY 107 HA2 GLY 107 3.696 11.823 9.839
876 HA3 GLY 107 HA3 GLY 107 4.741 13.232 9.939
877 H LYS 108 H LYS 108 3.265 15.195 10.846
878 HA LYS 108 HA LYS 108 2.245 16.154 12.610
879 HB2 LYS 108 HB2 LYS 108 1.137 13.395 13.098
880 HB3 LYS 108 HB3 LYS 108 0.741 14.783 14.097
881 HG2 LYS 108 HG2 LYS 108 0.205 14.562 11.140
882 HG3 LYS 108 HG3 LYS 108 -0.980 14.299 12.417
883 HD2 LYS 108 HD2 LYS 108 -1.398 16.492 11.764
884 HD3 LYS 108 HD3 LYS 108 -0.353 16.698 13.170
885 HE2 LYS 108 HE2 LYS 108 1.574 16.989 11.695
886 HE3 LYS 108 HE3 LYS 108 0.541 16.758 10.287
887 HZ1 LYS 108 HZ1 LYS 108 0.900 19.073 10.600
888 HZ2 LYS 108 HZ2 LYS 108 0.440 19.000 12.231
889 HZ3 LYS 108 HZ3 LYS 108 -0.715 18.751 11.014
890 H LEU 109 H LEU 109 1.977 15.542 15.244
891 HA LEU 109 HA LEU 109 4.761 14.933 15.997
892 HB2 LEU 109 HB2 LEU 109 3.029 17.202 16.974
893 HB3 LEU 109 HB3 LEU 109 4.568 16.757 17.685
894 HG LEU 109 HG LEU 109 4.199 17.698 14.839
895 HD11 LEU 109 HD11 LEU 109 5.251 19.765 15.599
896 HD12 LEU 109 HD12 LEU 109 5.261 19.156 17.254
897 HD13 LEU 109 HD13 LEU 109 3.728 19.473 16.440
898 HD21 LEU 109 HD21 LEU 109 6.638 17.875 14.836
899 HD22 LEU 109 HD22 LEU 109 6.117 16.213 15.120
900 HD23 LEU 109 HD23 LEU 109 6.693 17.199 16.465
901 H GLU 110 H GLU 110 4.734 15.128 18.609
902 HA GLU 110 HA GLU 110 2.704 13.204 19.521
903 HB2 GLU 110 HB2 GLU 110 5.586 13.340 19.827
904 HB3 GLU 110 HB3 GLU 110 4.788 13.280 21.391
905 HG2 GLU 110 HG2 GLU 110 4.131 11.339 19.209
906 HG3 GLU 110 HG3 GLU 110 5.482 11.085 20.310
907 H HIS 111 H HIS 111 2.575 13.370 22.062
908 HA HIS 111 HA HIS 111 2.600 16.201 22.874
909 HB2 HIS 111 HB2 HIS 111 0.262 15.402 22.332
910 HB3 HIS 111 HB3 HIS 111 0.420 14.250 23.654
911 HD1 HIS 111 HD1 HIS 111 -0.025 15.101 25.989
912 HD2 HIS 111 HD2 HIS 111 0.254 18.155 23.178
913 HE1 HIS 111 HE1 HIS 111 -0.726 17.199 27.189
914 HE2 HIS 111 HE2 HIS 111 -0.592 19.032 25.460
915 H HIS 112 H HIS 112 3.028 12.859 23.572
916 HA HIS 112 HA HIS 112 4.895 13.277 25.622
917 HB2 HIS 112 HB2 HIS 112 2.882 13.886 26.962
918 HB3 HIS 112 HB3 HIS 112 2.199 12.301 26.619
919 HD1 HIS 112 HD1 HIS 112 4.654 14.054 28.790
920 HD2 HIS 112 HD2 HIS 112 3.429 10.151 28.009
921 HE1 HIS 112 HE1 HIS 112 5.626 12.651 30.639
922 HE2 HIS 112 HE2 HIS 112 4.760 10.317 30.225
923 H HIS 113 H HIS 113 2.274 11.049 24.812
924 HA HIS 113 HA HIS 113 3.825 9.147 23.499
925 HB2 HIS 113 HB2 HIS 113 4.783 8.733 25.768
926 HB3 HIS 113 HB3 HIS 113 3.166 8.362 26.356
927 HD1 HIS 113 HD1 HIS 113 5.910 6.989 24.172
928 HD2 HIS 113 HD2 HIS 113 2.241 5.803 25.753
929 HE1 HIS 113 HE1 HIS 113 5.758 4.513 23.761
930 HE2 HIS 113 HE2 HIS 113 3.543 3.802 24.731
931 H HIS 114 H HIS 114 2.263 8.575 22.108
932 HA HIS 114 HA HIS 114 -0.478 8.575 22.548
933 HB2 HIS 114 HB2 HIS 114 1.220 6.955 20.660
934 HB3 HIS 114 HB3 HIS 114 -0.527 6.748 20.716
935 HD1 HIS 114 HD1 HIS 114 -1.813 8.220 19.182
936 HD2 HIS 114 HD2 HIS 114 1.944 9.771 20.068
937 HE1 HIS 114 HE1 HIS 114 -1.577 10.291 17.771
938 HE2 HIS 114 HE2 HIS 114 0.805 11.031 18.126
939 H HIS 115 H HIS 115 -1.723 7.461 23.852
940 HA HIS 115 HA HIS 115 -0.600 5.473 25.548
941 HB2 HIS 115 HB2 HIS 115 -2.388 7.182 26.140
942 HB3 HIS 115 HB3 HIS 115 -3.529 6.150 25.287
943 HD1 HIS 115 HD1 HIS 115 -4.889 5.532 27.330
944 HD2 HIS 115 HD2 HIS 115 -0.843 4.648 27.726
945 HE1 HIS 115 HE1 HIS 115 -4.693 4.164 29.434
946 HE2 HIS 115 HE2 HIS 115 -2.219 3.798 29.745
947 H HIS 116 H HIS 116 -2.440 5.393 22.623
948 HA HIS 116 HA HIS 116 -2.140 2.525 22.466
949 HB2 HIS 116 HB2 HIS 116 -4.526 2.065 22.054
950 HB3 HIS 116 HB3 HIS 116 -4.256 2.675 23.681
951 HD1 HIS 116 HD1 HIS 116 -6.351 3.162 20.782
952 HD2 HIS 116 HD2 HIS 116 -4.936 5.545 23.887
953 HE1 HIS 116 HE1 HIS 116 -7.834 5.195 20.813
954 HE2 HIS 116 HE2 HIS 116 -7.120 6.476 22.865
Start of MODEL 2
1 H1 MET 1 H1 MET 1 -5.070 -16.870 14.333
2 H2 MET 1 H2 MET 1 -6.760 -16.775 14.403
3 H3 MET 1 H3 MET 1 -5.897 -15.742 13.369
4 HA MET 1 HA MET 1 -6.127 -18.688 13.137
5 HB2 MET 1 HB2 MET 1 -7.145 -16.456 11.362
6 HB3 MET 1 HB3 MET 1 -7.280 -18.175 11.017
7 HG2 MET 1 HG2 MET 1 -8.700 -18.476 12.963
8 HG3 MET 1 HG3 MET 1 -8.533 -16.768 13.365
9 HE1 MET 1 HE1 MET 1 -10.708 -18.339 9.606
10 HE2 MET 1 HE2 MET 1 -9.992 -19.384 10.834
11 HE3 MET 1 HE3 MET 1 -8.955 -18.400 9.800
12 H ALA 2 H ALA 2 -5.010 -15.734 11.483
13 HA ALA 2 HA ALA 2 -2.618 -17.241 10.632
14 HB1 ALA 2 HB1 ALA 2 -4.103 -15.158 9.028
15 HB2 ALA 2 HB2 ALA 2 -4.083 -16.893 8.712
16 HB3 ALA 2 HB3 ALA 2 -2.602 -15.951 8.551
17 H GLU 3 H GLU 3 -3.960 -14.600 12.221
18 HA GLU 3 HA GLU 3 -1.529 -12.988 12.051
19 HB2 GLU 3 HB2 GLU 3 -3.535 -11.826 13.744
20 HB3 GLU 3 HB3 GLU 3 -2.868 -11.210 12.242
21 HG2 GLU 3 HG2 GLU 3 -5.198 -11.321 11.953
22 HG3 GLU 3 HG3 GLU 3 -4.523 -12.664 11.036
23 H LYS 4 H LYS 4 -0.039 -13.345 13.485
24 HA LYS 4 HA LYS 4 -0.426 -13.159 16.262
25 HB2 LYS 4 HB2 LYS 4 0.309 -15.461 16.909
26 HB3 LYS 4 HB3 LYS 4 -1.295 -15.412 16.191
27 HG2 LYS 4 HG2 LYS 4 -0.540 -16.355 14.178
28 HG3 LYS 4 HG3 LYS 4 1.151 -16.050 14.575
29 HD2 LYS 4 HD2 LYS 4 -0.666 -17.979 16.019
30 HD3 LYS 4 HD3 LYS 4 0.550 -18.417 14.818
31 HE2 LYS 4 HE2 LYS 4 2.269 -17.347 16.286
32 HE3 LYS 4 HE3 LYS 4 1.020 -17.155 17.513
33 HZ1 LYS 4 HZ1 LYS 4 1.961 -19.729 16.370
34 HZ2 LYS 4 HZ2 LYS 4 0.730 -19.567 17.525
35 HZ3 LYS 4 HZ3 LYS 4 2.323 -19.132 17.915
36 H ASN 5 H ASN 5 1.529 -14.516 13.698
37 HA ASN 5 HA ASN 5 3.695 -12.752 14.063
38 HB2 ASN 5 HB2 ASN 5 4.179 -14.211 16.008
39 HB3 ASN 5 HB3 ASN 5 4.161 -15.618 14.948
40 HD21 ASN 5 HD21 ASN 5 6.254 -16.186 15.412
41 HD22 ASN 5 HD22 ASN 5 7.619 -15.279 14.835
42 H ALA 6 H ALA 6 5.152 -12.959 12.294
43 HA ALA 6 HA ALA 6 5.607 -13.325 10.087
44 HB1 ALA 6 HB1 ALA 6 6.367 -15.477 10.978
45 HB2 ALA 6 HB2 ALA 6 5.694 -15.654 9.357
46 HB3 ALA 6 HB3 ALA 6 4.746 -16.140 10.763
47 H TYR 7 H TYR 7 3.073 -12.316 10.726
48 HA TYR 7 HA TYR 7 0.940 -13.658 9.438
49 HB2 TYR 7 HB2 TYR 7 -0.218 -11.418 9.699
50 HB3 TYR 7 HB3 TYR 7 0.378 -12.155 11.182
51 HD1 TYR 7 HD1 TYR 7 0.913 -9.443 8.750
52 HD2 TYR 7 HD2 TYR 7 2.137 -11.133 12.457
53 HE1 TYR 7 HE1 TYR 7 2.167 -7.392 9.263
54 HE2 TYR 7 HE2 TYR 7 3.395 -9.088 12.981
55 HH TYR 7 HH TYR 7 4.442 -7.202 11.746
56 H THR 8 H THR 8 -0.416 -12.164 7.852
57 HA THR 8 HA THR 8 1.196 -12.078 5.438
58 HB THR 8 HB THR 8 -1.041 -11.812 4.320
59 HG1 THR 8 HG1 THR 8 -2.827 -12.418 5.878
60 HG21 THR 8 HG21 THR 8 -1.782 -14.107 4.754
61 HG22 THR 8 HG22 THR 8 -0.768 -14.167 6.195
62 HG23 THR 8 HG23 THR 8 -0.027 -14.023 4.601
63 H VAL 9 H VAL 9 0.713 -10.302 3.842
64 HA VAL 9 HA VAL 9 1.169 -7.756 4.990
65 HB VAL 9 HB VAL 9 1.946 -8.315 2.733
66 HG11 VAL 9 HG11 VAL 9 0.091 -9.699 2.003
67 HG12 VAL 9 HG12 VAL 9 0.392 -8.400 0.848
68 HG13 VAL 9 HG13 VAL 9 -0.967 -8.287 1.966
69 HG21 VAL 9 HG21 VAL 9 1.657 -5.964 3.294
70 HG22 VAL 9 HG22 VAL 9 -0.019 -6.026 2.742
71 HG23 VAL 9 HG23 VAL 9 1.300 -6.248 1.590
72 H ALA 10 H ALA 10 -1.697 -9.523 4.191
73 HA ALA 10 HA ALA 10 -3.570 -7.466 3.975
74 HB1 ALA 10 HB1 ALA 10 -5.241 -9.121 4.554
75 HB2 ALA 10 HB2 ALA 10 -3.992 -10.194 5.182
76 HB3 ALA 10 HB3 ALA 10 -4.048 -9.823 3.459
77 H GLN 11 H GLN 11 -2.558 -9.295 6.852
78 HA GLN 11 HA GLN 11 -4.216 -7.848 8.629
79 HB2 GLN 11 HB2 GLN 11 -3.333 -10.112 9.112
80 HB3 GLN 11 HB3 GLN 11 -1.719 -9.431 9.248
81 HG2 GLN 11 HG2 GLN 11 -2.807 -9.849 11.419
82 HG3 GLN 11 HG3 GLN 11 -2.332 -8.170 11.174
83 HE21 GLN 11 HE21 GLN 11 -3.799 -7.406 12.682
84 HE22 GLN 11 HE22 GLN 11 -5.503 -7.366 12.391
85 H LEU 12 H LEU 12 -0.866 -7.476 7.608
86 HA LEU 12 HA LEU 12 -0.057 -5.523 9.436
87 HB2 LEU 12 HB2 LEU 12 1.480 -6.676 7.921
88 HB3 LEU 12 HB3 LEU 12 0.743 -5.879 6.544
89 HG LEU 12 HG LEU 12 1.526 -3.696 7.424
90 HD11 LEU 12 HD11 LEU 12 3.166 -3.637 9.218
91 HD12 LEU 12 HD12 LEU 12 2.983 -5.375 9.458
92 HD13 LEU 12 HD13 LEU 12 1.631 -4.292 9.788
93 HD21 LEU 12 HD21 LEU 12 3.893 -4.037 6.881
94 HD22 LEU 12 HD22 LEU 12 2.834 -4.886 5.756
95 HD23 LEU 12 HD23 LEU 12 3.669 -5.782 7.025
96 H ALA 13 H ALA 13 -1.567 -5.170 6.247
97 HA ALA 13 HA ALA 13 -1.575 -2.336 6.264
98 HB1 ALA 13 HB1 ALA 13 -3.016 -2.509 4.327
99 HB2 ALA 13 HB2 ALA 13 -3.316 -4.213 4.673
100 HB3 ALA 13 HB3 ALA 13 -1.700 -3.674 4.211
101 H ASP 14 H ASP 14 -4.017 -4.750 7.165
102 HA ASP 14 HA ASP 14 -6.115 -2.851 7.492
103 HB2 ASP 14 HB2 ASP 14 -5.825 -5.678 8.524
104 HB3 ASP 14 HB3 ASP 14 -7.277 -4.706 8.732
105 H GLU 15 H GLU 15 -3.808 -4.351 9.704
106 HA GLU 15 HA GLU 15 -4.918 -3.346 12.087
107 HB2 GLU 15 HB2 GLU 15 -3.209 -5.170 11.930
108 HB3 GLU 15 HB3 GLU 15 -2.004 -3.951 11.547
109 HG2 GLU 15 HG2 GLU 15 -1.939 -4.630 13.897
110 HG3 GLU 15 HG3 GLU 15 -2.303 -2.916 13.706
111 H TYR 16 H TYR 16 -2.330 -2.088 9.987
112 HA TYR 16 HA TYR 16 -1.792 0.243 11.460
113 HB2 TYR 16 HB2 TYR 16 -0.386 -0.666 9.589
114 HB3 TYR 16 HB3 TYR 16 -1.595 -0.077 8.455
115 HD1 TYR 16 HD1 TYR 16 0.859 0.988 11.014
116 HD2 TYR 16 HD2 TYR 16 -1.610 2.188 7.762
117 HE1 TYR 16 HE1 TYR 16 1.983 3.172 10.974
118 HE2 TYR 16 HE2 TYR 16 -0.495 4.380 7.717
119 HH TYR 16 HH TYR 16 0.772 5.837 9.247
120 H PHE 17 H PHE 17 -4.115 -0.445 8.904
121 HA PHE 17 HA PHE 17 -5.223 2.086 8.556
122 HB2 PHE 17 HB2 PHE 17 -5.907 0.501 6.995
123 HB3 PHE 17 HB3 PHE 17 -6.241 -0.714 8.221
124 HD1 PHE 17 HD1 PHE 17 -7.489 2.503 6.837
125 HD2 PHE 17 HD2 PHE 17 -8.401 -1.050 8.995
126 HE1 PHE 17 HE1 PHE 17 -9.884 3.067 6.758
127 HE2 PHE 17 HE2 PHE 17 -10.792 -0.492 8.918
128 HZ PHE 17 HZ PHE 17 -11.537 1.570 7.798
129 H GLU 18 H GLU 18 -6.234 -0.495 10.802
130 HA GLU 18 HA GLU 18 -8.377 0.980 11.890
131 HB2 GLU 18 HB2 GLU 18 -6.847 -1.370 13.001
132 HB3 GLU 18 HB3 GLU 18 -8.320 -0.729 13.714
133 HG2 GLU 18 HG2 GLU 18 -9.483 -1.200 11.568
134 HG3 GLU 18 HG3 GLU 18 -8.011 -1.986 11.000
135 H ARG 19 H ARG 19 -4.990 1.047 12.534
136 HA ARG 19 HA ARG 19 -5.266 2.175 15.171
137 HB2 ARG 19 HB2 ARG 19 -2.866 1.893 13.360
138 HB3 ARG 19 HB3 ARG 19 -2.798 2.513 15.004
139 HG2 ARG 19 HG2 ARG 19 -3.658 -0.247 14.169
140 HG3 ARG 19 HG3 ARG 19 -2.147 0.194 14.968
141 HD2 ARG 19 HD2 ARG 19 -3.372 0.944 16.918
142 HD3 ARG 19 HD3 ARG 19 -4.902 0.596 16.119
143 HE ARG 19 HE ARG 19 -3.722 -1.800 16.034
144 HH11 ARG 19 HH11 ARG 19 -4.137 0.481 18.667
145 HH12 ARG 19 HH12 ARG 19 -4.159 -0.742 19.897
146 HH21 ARG 19 HH21 ARG 19 -3.767 -3.405 17.636
147 HH22 ARG 19 HH22 ARG 19 -3.970 -2.963 19.308
148 H MET 20 H MET 20 -4.295 3.405 11.981
149 HA MET 20 HA MET 20 -4.017 6.089 13.030
150 HB2 MET 20 HB2 MET 20 -3.750 4.977 10.237
151 HB3 MET 20 HB3 MET 20 -3.508 6.672 10.638
152 HG2 MET 20 HG2 MET 20 -1.926 4.352 11.718
153 HG3 MET 20 HG3 MET 20 -1.394 5.492 10.483
154 HE1 MET 20 HE1 MET 20 0.298 4.817 13.094
155 HE2 MET 20 HE2 MET 20 0.838 6.429 13.563
156 HE3 MET 20 HE3 MET 20 0.823 5.966 11.862
157 H ILE 21 H ILE 21 -6.433 4.256 11.337
158 HA ILE 21 HA ILE 21 -8.008 6.688 10.861
159 HB ILE 21 HB ILE 21 -8.648 3.877 9.938
160 HG12 ILE 21 HG12 ILE 21 -6.471 4.587 9.032
161 HG13 ILE 21 HG13 ILE 21 -7.692 4.501 7.766
162 HG21 ILE 21 HG21 ILE 21 -10.549 5.412 9.936
163 HG22 ILE 21 HG22 ILE 21 -10.066 5.004 8.289
164 HG23 ILE 21 HG23 ILE 21 -9.622 6.567 8.976
165 HD11 ILE 21 HD11 ILE 21 -6.745 7.019 9.123
166 HD12 ILE 21 HD12 ILE 21 -7.937 6.922 7.826
167 HD13 ILE 21 HD13 ILE 21 -6.262 6.461 7.522
168 H ALA 22 H ALA 22 -7.558 5.758 13.495
169 HA ALA 22 HA ALA 22 -10.209 4.793 14.312
170 HB1 ALA 22 HB1 ALA 22 -9.212 4.289 16.460
171 HB2 ALA 22 HB2 ALA 22 -7.694 5.037 15.962
172 HB3 ALA 22 HB3 ALA 22 -8.251 3.561 15.172
173 H GLY 23 H GLY 23 -10.759 5.789 16.631
174 HA2 GLY 23 HA2 GLY 23 -11.045 7.672 17.981
175 HA3 GLY 23 HA3 GLY 23 -10.016 8.584 16.884
176 H ARG 24 H ARG 24 -10.920 9.656 15.146
177 HA ARG 24 HA ARG 24 -13.830 9.546 14.835
178 HB2 ARG 24 HB2 ARG 24 -13.255 11.403 16.408
179 HB3 ARG 24 HB3 ARG 24 -12.281 12.131 15.140
180 HG2 ARG 24 HG2 ARG 24 -14.379 13.258 15.208
181 HG3 ARG 24 HG3 ARG 24 -14.336 12.280 13.739
182 HD2 ARG 24 HD2 ARG 24 -15.714 10.593 14.759
183 HD3 ARG 24 HD3 ARG 24 -15.646 11.420 16.314
184 HE ARG 24 HE ARG 24 -16.823 12.832 14.037
185 HH11 ARG 24 HH11 ARG 24 -17.279 11.098 17.046
186 HH12 ARG 24 HH12 ARG 24 -18.865 11.757 17.333
187 HH21 ARG 24 HH21 ARG 24 -18.897 13.709 14.412
188 HH22 ARG 24 HH22 ARG 24 -19.790 13.238 15.830
189 H TRP 25 H TRP 25 -13.736 8.673 12.823
190 HA TRP 25 HA TRP 25 -12.256 10.196 10.791
191 HB2 TRP 25 HB2 TRP 25 -11.732 8.102 9.645
192 HB3 TRP 25 HB3 TRP 25 -11.118 8.062 11.285
193 HD1 TRP 25 HD1 TRP 25 -13.140 6.107 8.900
194 HE1 TRP 25 HE1 TRP 25 -14.246 4.098 10.064
195 HE3 TRP 25 HE3 TRP 25 -12.317 7.415 13.777
196 HZ2 TRP 25 HZ2 TRP 25 -14.724 3.191 12.678
197 HZ3 TRP 25 HZ3 TRP 25 -13.142 5.921 15.546
198 HH2 TRP 25 HH2 TRP 25 -14.322 3.855 15.006
199 H LYS 26 H LYS 26 -14.967 7.985 11.362
200 HA LYS 26 HA LYS 26 -16.900 7.568 10.281
201 HB2 LYS 26 HB2 LYS 26 -17.200 10.053 10.593
202 HB3 LYS 26 HB3 LYS 26 -16.587 10.267 8.959
203 HG2 LYS 26 HG2 LYS 26 -19.014 10.327 8.989
204 HG3 LYS 26 HG3 LYS 26 -18.434 8.925 8.085
205 HD2 LYS 26 HD2 LYS 26 -18.739 7.581 10.187
206 HD3 LYS 26 HD3 LYS 26 -19.553 8.985 10.881
207 HE2 LYS 26 HE2 LYS 26 -21.210 8.909 9.090
208 HE3 LYS 26 HE3 LYS 26 -20.391 7.515 8.384
209 HZ1 LYS 26 HZ1 LYS 26 -22.284 6.829 9.710
210 HZ2 LYS 26 HZ2 LYS 26 -21.653 7.615 11.072
211 HZ3 LYS 26 HZ3 LYS 26 -20.847 6.273 10.420
212 H HIS 27 H HIS 27 -17.653 6.658 8.393
213 HA HIS 27 HA HIS 27 -17.399 5.406 6.528
214 HB2 HIS 27 HB2 HIS 27 -16.913 6.720 4.434
215 HB3 HIS 27 HB3 HIS 27 -18.240 7.309 5.418
216 HD1 HIS 27 HD1 HIS 27 -18.180 9.718 6.053
217 HD2 HIS 27 HD2 HIS 27 -14.503 8.368 4.651
218 HE1 HIS 27 HE1 HIS 27 -16.716 11.759 5.907
219 HE2 HIS 27 HE2 HIS 27 -14.464 10.907 5.159
220 HA PRO 28 HA PRO 28 -12.829 4.726 7.055
221 HB2 PRO 28 HB2 PRO 28 -13.095 2.060 7.611
222 HB3 PRO 28 HB3 PRO 28 -13.119 3.319 8.849
223 HG2 PRO 28 HG2 PRO 28 -15.401 1.883 7.560
224 HG3 PRO 28 HG3 PRO 28 -15.175 2.326 9.263
225 HD2 PRO 28 HD2 PRO 28 -16.771 3.736 7.603
226 HD3 PRO 28 HD3 PRO 28 -15.856 4.504 8.916
227 H ASN 29 H ASN 29 -15.434 3.204 5.328
228 HA ASN 29 HA ASN 29 -14.020 1.433 3.696
229 HB2 ASN 29 HB2 ASN 29 -15.974 1.400 2.258
230 HB3 ASN 29 HB3 ASN 29 -16.486 1.421 3.940
231 HD21 ASN 29 HD21 ASN 29 -17.601 3.180 4.734
232 HD22 ASN 29 HD22 ASN 29 -18.202 4.444 3.710
233 H ILE 30 H ILE 30 -14.372 4.875 3.509
234 HA ILE 30 HA ILE 30 -13.795 5.217 0.773
235 HB ILE 30 HB ILE 30 -13.362 7.080 3.111
236 HG12 ILE 30 HG12 ILE 30 -15.699 6.487 2.730
237 HG13 ILE 30 HG13 ILE 30 -15.410 8.167 2.294
238 HG21 ILE 30 HG21 ILE 30 -11.892 7.728 1.295
239 HG22 ILE 30 HG22 ILE 30 -13.216 8.884 1.451
240 HG23 ILE 30 HG23 ILE 30 -13.240 7.683 0.160
241 HD11 ILE 30 HD11 ILE 30 -15.332 7.532 -0.069
242 HD12 ILE 30 HD12 ILE 30 -16.865 7.096 0.685
243 HD13 ILE 30 HD13 ILE 30 -15.648 5.856 0.381
244 H VAL 31 H VAL 31 -11.677 5.332 3.639
245 HA VAL 31 HA VAL 31 -9.326 5.565 1.991
246 HB VAL 31 HB VAL 31 -9.342 6.684 4.145
247 HG11 VAL 31 HG11 VAL 31 -9.582 3.939 5.349
248 HG12 VAL 31 HG12 VAL 31 -10.784 5.228 5.399
249 HG13 VAL 31 HG13 VAL 31 -9.251 5.419 6.248
250 HG21 VAL 31 HG21 VAL 31 -7.203 5.871 5.045
251 HG22 VAL 31 HG22 VAL 31 -7.188 6.008 3.287
252 HG23 VAL 31 HG23 VAL 31 -7.350 4.424 4.047
253 H ARG 32 H ARG 32 -11.025 2.998 3.691
254 HA ARG 32 HA ARG 32 -8.918 1.083 3.534
255 HB2 ARG 32 HB2 ARG 32 -11.112 1.184 5.020
256 HB3 ARG 32 HB3 ARG 32 -11.777 0.236 3.700
257 HG2 ARG 32 HG2 ARG 32 -9.239 -0.569 5.079
258 HG3 ARG 32 HG3 ARG 32 -10.820 -1.003 5.725
259 HD2 ARG 32 HD2 ARG 32 -11.360 -2.170 3.661
260 HD3 ARG 32 HD3 ARG 32 -9.809 -1.695 2.966
261 HE ARG 32 HE ARG 32 -8.911 -3.005 5.034
262 HH11 ARG 32 HH11 ARG 32 -11.685 -3.854 3.058
263 HH12 ARG 32 HH12 ARG 32 -11.530 -5.563 3.374
264 HH21 ARG 32 HH21 ARG 32 -8.698 -5.240 5.423
265 HH22 ARG 32 HH22 ARG 32 -9.846 -6.341 4.715
266 H SER 33 H SER 33 -11.371 2.150 1.338
267 HA SER 33 HA SER 33 -11.721 -0.064 -0.288
268 HB2 SER 33 HB2 SER 33 -12.964 2.116 -0.457
269 HB3 SER 33 HB3 SER 33 -11.553 2.798 -1.263
270 HG SER 33 HG SER 33 -13.105 0.583 -2.150
271 H ARG 34 H ARG 34 -9.215 2.467 -0.535
272 HA ARG 34 HA ARG 34 -8.012 1.382 -2.861
273 HB2 ARG 34 HB2 ARG 34 -6.297 2.975 -2.580
274 HB3 ARG 34 HB3 ARG 34 -7.731 3.750 -1.924
275 HG2 ARG 34 HG2 ARG 34 -7.018 3.282 0.326
276 HG3 ARG 34 HG3 ARG 34 -5.644 2.349 -0.267
277 HD2 ARG 34 HD2 ARG 34 -4.766 4.445 0.327
278 HD3 ARG 34 HD3 ARG 34 -4.896 4.472 -1.431
279 HE ARG 34 HE ARG 34 -7.247 5.542 -0.327
280 HH11 ARG 34 HH11 ARG 34 -3.862 6.323 -0.763
281 HH12 ARG 34 HH12 ARG 34 -4.113 8.043 -0.655
282 HH21 ARG 34 HH21 ARG 34 -7.578 7.778 -0.167
283 HH22 ARG 34 HH22 ARG 34 -6.227 8.862 -0.302
284 H ILE 35 H ILE 35 -7.791 0.637 0.491
285 HA ILE 35 HA ILE 35 -5.194 -0.529 0.466
286 HB ILE 35 HB ILE 35 -7.450 -0.921 2.445
287 HG12 ILE 35 HG12 ILE 35 -5.102 0.991 2.479
288 HG13 ILE 35 HG13 ILE 35 -6.781 1.438 2.196
289 HG21 ILE 35 HG21 ILE 35 -5.669 -1.589 4.005
290 HG22 ILE 35 HG22 ILE 35 -4.496 -1.484 2.691
291 HG23 ILE 35 HG23 ILE 35 -5.791 -2.679 2.624
292 HD11 ILE 35 HD11 ILE 35 -7.354 0.731 4.452
293 HD12 ILE 35 HD12 ILE 35 -6.085 1.956 4.465
294 HD13 ILE 35 HD13 ILE 35 -5.679 0.260 4.737
295 H GLU 36 H GLU 36 -8.495 -1.825 0.276
296 HA GLU 36 HA GLU 36 -7.444 -4.523 0.001
297 HB2 GLU 36 HB2 GLU 36 -9.780 -5.230 0.031
298 HB3 GLU 36 HB3 GLU 36 -9.412 -4.183 1.394
299 HG2 GLU 36 HG2 GLU 36 -10.443 -2.302 0.213
300 HG3 GLU 36 HG3 GLU 36 -10.835 -3.374 -1.130
301 H LYS 37 H LYS 37 -7.964 -1.991 -2.077
302 HA LYS 37 HA LYS 37 -8.751 -3.756 -4.275
303 HB2 LYS 37 HB2 LYS 37 -10.119 -1.703 -3.807
304 HB3 LYS 37 HB3 LYS 37 -8.722 -0.737 -4.249
305 HG2 LYS 37 HG2 LYS 37 -9.823 -2.752 -6.160
306 HG3 LYS 37 HG3 LYS 37 -10.581 -1.170 -5.983
307 HD2 LYS 37 HD2 LYS 37 -9.027 -0.241 -7.263
308 HD3 LYS 37 HD3 LYS 37 -7.751 -0.844 -6.210
309 HE2 LYS 37 HE2 LYS 37 -7.796 -2.988 -7.404
310 HE3 LYS 37 HE3 LYS 37 -9.047 -2.356 -8.469
311 HZ1 LYS 37 HZ1 LYS 37 -7.555 -0.806 -9.386
312 HZ2 LYS 37 HZ2 LYS 37 -6.713 -2.274 -9.346
313 HZ3 LYS 37 HZ3 LYS 37 -6.389 -1.073 -8.188
314 H ASP 38 H ASP 38 -6.503 -1.033 -3.676
315 HA ASP 38 HA ASP 38 -4.892 -1.978 -5.927
316 HB2 ASP 38 HB2 ASP 38 -4.905 0.634 -4.417
317 HB3 ASP 38 HB3 ASP 38 -3.687 0.229 -5.624
318 H ILE 39 H ILE 39 -4.520 -1.105 -2.504
319 HA ILE 39 HA ILE 39 -1.758 -1.671 -2.356
320 HB ILE 39 HB ILE 39 -3.833 -1.762 -0.158
321 HG12 ILE 39 HG12 ILE 39 -1.913 0.417 -1.024
322 HG13 ILE 39 HG13 ILE 39 -3.655 0.422 -1.267
323 HG21 ILE 39 HG21 ILE 39 -0.824 -1.669 0.016
324 HG22 ILE 39 HG22 ILE 39 -1.858 -3.022 0.474
325 HG23 ILE 39 HG23 ILE 39 -1.931 -1.509 1.380
326 HD11 ILE 39 HD11 ILE 39 -4.008 0.516 1.132
327 HD12 ILE 39 HD12 ILE 39 -2.981 1.846 0.594
328 HD13 ILE 39 HD13 ILE 39 -2.266 0.451 1.401
329 H LYS 40 H LYS 40 -4.583 -3.640 -1.485
330 HA LYS 40 HA LYS 40 -2.927 -6.046 -1.894
331 HB2 LYS 40 HB2 LYS 40 -5.237 -5.732 0.039
332 HB3 LYS 40 HB3 LYS 40 -4.294 -7.193 -0.215
333 HG2 LYS 40 HG2 LYS 40 -2.334 -6.149 0.706
334 HG3 LYS 40 HG3 LYS 40 -3.175 -4.603 0.832
335 HD2 LYS 40 HD2 LYS 40 -4.005 -7.123 2.267
336 HD3 LYS 40 HD3 LYS 40 -3.024 -5.846 2.985
337 HE2 LYS 40 HE2 LYS 40 -4.836 -4.250 2.663
338 HE3 LYS 40 HE3 LYS 40 -5.811 -5.496 1.884
339 HZ1 LYS 40 HZ1 LYS 40 -4.821 -5.752 4.668
340 HZ2 LYS 40 HZ2 LYS 40 -6.025 -6.669 3.904
341 HZ3 LYS 40 HZ3 LYS 40 -6.312 -5.046 4.297
342 HA PRO 41 HA PRO 41 -6.472 -5.979 -4.867
343 HB2 PRO 41 HB2 PRO 41 -4.574 -7.167 -6.744
344 HB3 PRO 41 HB3 PRO 41 -5.506 -5.676 -6.893
345 HG2 PRO 41 HG2 PRO 41 -2.824 -5.690 -6.551
346 HG3 PRO 41 HG3 PRO 41 -3.863 -4.395 -5.929
347 HD2 PRO 41 HD2 PRO 41 -2.645 -6.714 -4.476
348 HD3 PRO 41 HD3 PRO 41 -2.828 -5.025 -3.953
349 H ALA 42 H ALA 42 -3.991 -8.540 -5.110
350 HA ALA 42 HA ALA 42 -6.005 -10.483 -4.250
351 HB1 ALA 42 HB1 ALA 42 -5.383 -12.034 -6.036
352 HB2 ALA 42 HB2 ALA 42 -4.300 -10.820 -6.717
353 HB3 ALA 42 HB3 ALA 42 -6.042 -10.536 -6.693
354 H ILE 43 H ILE 43 -3.378 -9.131 -3.400
355 HA ILE 43 HA ILE 43 -1.788 -11.548 -2.872
356 HB ILE 43 HB ILE 43 0.041 -9.901 -2.313
357 HG12 ILE 43 HG12 ILE 43 -1.728 -7.929 -3.768
358 HG13 ILE 43 HG13 ILE 43 -1.567 -7.968 -2.017
359 HG21 ILE 43 HG21 ILE 43 0.597 -9.469 -4.669
360 HG22 ILE 43 HG22 ILE 43 -1.053 -9.890 -5.125
361 HG23 ILE 43 HG23 ILE 43 0.005 -11.112 -4.418
362 HD11 ILE 43 HD11 ILE 43 0.659 -7.487 -3.985
363 HD12 ILE 43 HD12 ILE 43 0.815 -7.497 -2.227
364 HD13 ILE 43 HD13 ILE 43 -0.158 -6.258 -3.019
365 H GLY 44 H GLY 44 -4.195 -10.628 -1.358
366 HA2 GLY 44 HA2 GLY 44 -3.425 -9.429 1.072
367 HA3 GLY 44 HA3 GLY 44 -4.857 -10.417 0.836
368 H SER 45 H SER 45 -3.652 -12.846 0.152
369 HA SER 45 HA SER 45 -2.827 -13.730 2.771
370 HB2 SER 45 HB2 SER 45 -2.859 -16.001 1.618
371 HB3 SER 45 HB3 SER 45 -4.394 -15.134 1.655
372 HG SER 45 HG SER 45 -2.770 -15.792 -0.486
373 H LEU 46 H LEU 46 -1.127 -12.185 0.609
374 HA LEU 46 HA LEU 46 1.096 -13.985 0.202
375 HB2 LEU 46 HB2 LEU 46 0.326 -12.193 -1.422
376 HB3 LEU 46 HB3 LEU 46 0.986 -11.013 -0.309
377 HG LEU 46 HG LEU 46 3.219 -12.160 -0.583
378 HD11 LEU 46 HD11 LEU 46 3.528 -13.539 -2.572
379 HD12 LEU 46 HD12 LEU 46 1.793 -13.484 -2.886
380 HD13 LEU 46 HD13 LEU 46 2.404 -14.291 -1.441
381 HD21 LEU 46 HD21 LEU 46 2.690 -10.055 -1.681
382 HD22 LEU 46 HD22 LEU 46 1.940 -10.926 -3.019
383 HD23 LEU 46 HD23 LEU 46 3.674 -11.076 -2.730
384 H LYS 47 H LYS 47 3.021 -13.970 1.281
385 HA LYS 47 HA LYS 47 3.180 -12.955 3.897
386 HB2 LYS 47 HB2 LYS 47 4.462 -14.898 2.851
387 HB3 LYS 47 HB3 LYS 47 5.519 -13.693 2.135
388 HG2 LYS 47 HG2 LYS 47 6.557 -14.521 4.109
389 HG3 LYS 47 HG3 LYS 47 6.026 -12.867 4.423
390 HD2 LYS 47 HD2 LYS 47 5.524 -14.339 6.307
391 HD3 LYS 47 HD3 LYS 47 4.050 -13.711 5.578
392 HE2 LYS 47 HE2 LYS 47 3.682 -15.796 4.424
393 HE3 LYS 47 HE3 LYS 47 5.232 -16.424 4.983
394 HZ1 LYS 47 HZ1 LYS 47 3.151 -15.593 6.904
395 HZ2 LYS 47 HZ2 LYS 47 4.453 -16.650 7.140
396 HZ3 LYS 47 HZ3 LYS 47 3.123 -17.135 6.207
397 H VAL 48 H VAL 48 4.318 -11.204 4.736
398 HA VAL 48 HA VAL 48 4.321 -8.828 3.257
399 HB VAL 48 HB VAL 48 5.967 -9.356 5.739
400 HG11 VAL 48 HG11 VAL 48 6.461 -7.244 4.611
401 HG12 VAL 48 HG12 VAL 48 5.671 -6.975 6.164
402 HG13 VAL 48 HG13 VAL 48 4.753 -6.811 4.669
403 HG21 VAL 48 HG21 VAL 48 3.665 -10.080 6.101
404 HG22 VAL 48 HG22 VAL 48 3.077 -8.517 5.536
405 HG23 VAL 48 HG23 VAL 48 4.020 -8.619 7.022
406 H GLU 49 H GLU 49 6.692 -11.323 3.545
407 HA GLU 49 HA GLU 49 8.937 -9.745 2.723
408 HB2 GLU 49 HB2 GLU 49 8.547 -12.737 2.797
409 HB3 GLU 49 HB3 GLU 49 10.075 -11.930 2.476
410 HG2 GLU 49 HG2 GLU 49 9.962 -10.897 4.708
411 HG3 GLU 49 HG3 GLU 49 8.485 -11.808 5.025
412 H ASP 50 H ASP 50 6.312 -11.131 1.049
413 HA ASP 50 HA ASP 50 7.882 -11.592 -1.374
414 HB2 ASP 50 HB2 ASP 50 5.098 -12.362 -0.557
415 HB3 ASP 50 HB3 ASP 50 5.583 -12.404 -2.248
416 H VAL 51 H VAL 51 6.234 -9.034 -0.017
417 HA VAL 51 HA VAL 51 5.079 -8.082 -2.485
418 HB VAL 51 HB VAL 51 3.916 -7.544 -0.424
419 HG11 VAL 51 HG11 VAL 51 5.752 -7.397 1.132
420 HG12 VAL 51 HG12 VAL 51 4.804 -5.910 1.177
421 HG13 VAL 51 HG13 VAL 51 6.351 -5.945 0.331
422 HG21 VAL 51 HG21 VAL 51 3.586 -5.136 -0.779
423 HG22 VAL 51 HG22 VAL 51 3.637 -6.034 -2.295
424 HG23 VAL 51 HG23 VAL 51 5.039 -5.097 -1.780
425 H LYS 52 H LYS 52 7.097 -8.305 -3.615
426 HA LYS 52 HA LYS 52 9.231 -6.471 -3.172
427 HB2 LYS 52 HB2 LYS 52 10.055 -7.246 -5.349
428 HB3 LYS 52 HB3 LYS 52 9.584 -8.593 -4.325
429 HG2 LYS 52 HG2 LYS 52 7.462 -8.760 -5.549
430 HG3 LYS 52 HG3 LYS 52 7.989 -7.446 -6.605
431 HD2 LYS 52 HD2 LYS 52 8.389 -9.575 -7.677
432 HD3 LYS 52 HD3 LYS 52 9.926 -8.805 -7.286
433 HE2 LYS 52 HE2 LYS 52 10.175 -10.224 -5.336
434 HE3 LYS 52 HE3 LYS 52 8.590 -10.941 -5.628
435 HZ1 LYS 52 HZ1 LYS 52 9.500 -11.688 -7.824
436 HZ2 LYS 52 HZ2 LYS 52 10.177 -12.442 -6.467
437 HZ3 LYS 52 HZ3 LYS 52 11.040 -11.227 -7.278
438 HA PRO 53 HA PRO 53 8.097 -2.630 -4.949
439 HB2 PRO 53 HB2 PRO 53 10.218 -3.084 -7.007
440 HB3 PRO 53 HB3 PRO 53 9.915 -1.666 -5.996
441 HG2 PRO 53 HG2 PRO 53 11.879 -3.346 -5.393
442 HG3 PRO 53 HG3 PRO 53 10.872 -2.637 -4.116
443 HD2 PRO 53 HD2 PRO 53 10.860 -5.399 -5.230
444 HD3 PRO 53 HD3 PRO 53 10.514 -4.844 -3.581
445 H ARG 54 H ARG 54 8.635 -5.204 -7.340
446 HA ARG 54 HA ARG 54 7.345 -4.048 -9.514
447 HB2 ARG 54 HB2 ARG 54 7.888 -6.857 -8.686
448 HB3 ARG 54 HB3 ARG 54 6.793 -6.577 -10.035
449 HG2 ARG 54 HG2 ARG 54 9.638 -5.609 -9.825
450 HG3 ARG 54 HG3 ARG 54 9.053 -6.941 -10.829
451 HD2 ARG 54 HD2 ARG 54 7.623 -5.381 -12.056
452 HD3 ARG 54 HD3 ARG 54 8.206 -4.056 -11.053
453 HE ARG 54 HE ARG 54 10.362 -5.406 -12.331
454 HH11 ARG 54 HH11 ARG 54 7.774 -3.105 -12.898
455 HH12 ARG 54 HH12 ARG 54 8.589 -2.299 -14.198
456 HH21 ARG 54 HH21 ARG 54 11.448 -4.349 -14.045
457 HH22 ARG 54 HH22 ARG 54 10.682 -3.018 -14.862
458 H HIS 55 H HIS 55 5.942 -5.808 -6.788
459 HA HIS 55 HA HIS 55 3.331 -6.027 -7.853
460 HB2 HIS 55 HB2 HIS 55 4.241 -5.882 -4.971
461 HB3 HIS 55 HB3 HIS 55 2.597 -6.258 -5.471
462 HD1 HIS 55 HD1 HIS 55 2.645 -8.419 -7.337
463 HD2 HIS 55 HD2 HIS 55 5.627 -8.126 -4.450
464 HE1 HIS 55 HE1 HIS 55 3.612 -10.729 -7.114
465 HE2 HIS 55 HE2 HIS 55 5.516 -10.500 -5.484
466 H ILE 56 H ILE 56 4.982 -3.501 -6.080
467 HA ILE 56 HA ILE 56 2.673 -1.827 -5.776
468 HB ILE 56 HB ILE 56 5.606 -1.090 -5.599
469 HG12 ILE 56 HG12 ILE 56 5.060 -2.877 -4.024
470 HG13 ILE 56 HG13 ILE 56 5.334 -1.366 -3.163
471 HG21 ILE 56 HG21 ILE 56 3.167 0.314 -4.524
472 HG22 ILE 56 HG22 ILE 56 4.171 0.853 -5.869
473 HG23 ILE 56 HG23 ILE 56 4.840 0.792 -4.238
474 HD11 ILE 56 HD11 ILE 56 2.939 -1.053 -2.923
475 HD12 ILE 56 HD12 ILE 56 3.443 -2.607 -2.257
476 HD13 ILE 56 HD13 ILE 56 2.642 -2.537 -3.827
477 H ASP 57 H ASP 57 5.285 -2.177 -8.078
478 HA ASP 57 HA ASP 57 4.903 0.195 -9.543
479 HB2 ASP 57 HB2 ASP 57 6.908 -1.275 -9.704
480 HB3 ASP 57 HB3 ASP 57 5.929 -2.481 -10.530
481 H ASP 58 H ASP 58 3.529 -3.035 -9.834
482 HA ASP 58 HA ASP 58 2.037 -2.574 -12.195
483 HB2 ASP 58 HB2 ASP 58 2.007 -4.651 -10.051
484 HB3 ASP 58 HB3 ASP 58 0.606 -4.541 -11.111
485 H VAL 59 H VAL 59 1.274 -2.049 -8.789
486 HA VAL 59 HA VAL 59 -1.495 -1.533 -9.427
487 HB VAL 59 HB VAL 59 -1.829 -1.043 -7.062
488 HG11 VAL 59 HG11 VAL 59 -0.169 -3.517 -7.519
489 HG12 VAL 59 HG12 VAL 59 -1.900 -3.356 -7.817
490 HG13 VAL 59 HG13 VAL 59 -1.275 -3.248 -6.172
491 HG21 VAL 59 HG21 VAL 59 -0.014 -1.264 -5.443
492 HG22 VAL 59 HG22 VAL 59 0.287 0.064 -6.565
493 HG23 VAL 59 HG23 VAL 59 1.142 -1.467 -6.760
494 H LEU 60 H LEU 60 1.393 0.370 -8.746
495 HA LEU 60 HA LEU 60 0.105 2.859 -8.462
496 HB2 LEU 60 HB2 LEU 60 2.882 2.150 -9.386
497 HB3 LEU 60 HB3 LEU 60 2.340 3.805 -9.190
498 HG LEU 60 HG LEU 60 2.555 1.729 -7.010
499 HD11 LEU 60 HD11 LEU 60 4.306 3.187 -6.136
500 HD12 LEU 60 HD12 LEU 60 4.119 4.252 -7.529
501 HD13 LEU 60 HD13 LEU 60 4.704 2.603 -7.751
502 HD21 LEU 60 HD21 LEU 60 1.674 4.611 -6.865
503 HD22 LEU 60 HD22 LEU 60 1.944 3.543 -5.486
504 HD23 LEU 60 HD23 LEU 60 0.647 3.197 -6.629
505 H LYS 61 H LYS 61 1.401 1.199 -11.321
506 HA LYS 61 HA LYS 61 0.818 3.300 -13.125
507 HB2 LYS 61 HB2 LYS 61 1.159 1.647 -14.893
508 HB3 LYS 61 HB3 LYS 61 2.407 1.511 -13.670
509 HG2 LYS 61 HG2 LYS 61 1.222 -0.417 -12.713
510 HG3 LYS 61 HG3 LYS 61 0.019 -0.287 -14.000
511 HD2 LYS 61 HD2 LYS 61 1.800 -0.625 -15.666
512 HD3 LYS 61 HD3 LYS 61 2.971 -0.808 -14.357
513 HE2 LYS 61 HE2 LYS 61 1.618 -2.717 -13.506
514 HE3 LYS 61 HE3 LYS 61 0.600 -2.579 -14.937
515 HZ1 LYS 61 HZ1 LYS 61 2.362 -4.288 -15.106
516 HZ2 LYS 61 HZ2 LYS 61 3.528 -3.058 -15.026
517 HZ3 LYS 61 HZ3 LYS 61 2.441 -3.113 -16.327
518 H ALA 62 H ALA 62 -1.096 0.690 -11.814
519 HA ALA 62 HA ALA 62 -3.222 0.935 -13.725
520 HB1 ALA 62 HB1 ALA 62 -4.411 -0.646 -12.332
521 HB2 ALA 62 HB2 ALA 62 -3.241 -0.423 -11.032
522 HB3 ALA 62 HB3 ALA 62 -2.743 -1.177 -12.546
523 H VAL 63 H VAL 63 -2.590 2.220 -10.487
524 HA VAL 63 HA VAL 63 -5.245 3.300 -10.258
525 HB VAL 63 HB VAL 63 -3.985 2.621 -8.251
526 HG11 VAL 63 HG11 VAL 63 -1.752 3.296 -8.904
527 HG12 VAL 63 HG12 VAL 63 -2.199 4.042 -7.369
528 HG13 VAL 63 HG13 VAL 63 -2.231 4.993 -8.853
529 HG21 VAL 63 HG21 VAL 63 -4.682 5.554 -8.299
530 HG22 VAL 63 HG22 VAL 63 -4.540 4.545 -6.860
531 HG23 VAL 63 HG23 VAL 63 -5.809 4.221 -8.041
532 H MET 64 H MET 64 -2.155 4.457 -11.426
533 HA MET 64 HA MET 64 -2.923 7.220 -11.341
534 HB2 MET 64 HB2 MET 64 -0.855 7.690 -12.504
535 HB3 MET 64 HB3 MET 64 -0.553 6.538 -11.215
536 HG2 MET 64 HG2 MET 64 -0.449 4.727 -12.804
537 HG3 MET 64 HG3 MET 64 -0.875 5.820 -14.118
538 HE1 MET 64 HE1 MET 64 1.844 4.927 -11.411
539 HE2 MET 64 HE2 MET 64 1.544 6.641 -11.113
540 HE3 MET 64 HE3 MET 64 3.095 6.121 -11.767
541 H LYS 65 H LYS 65 -3.316 4.641 -13.645
542 HA LYS 65 HA LYS 65 -3.585 6.362 -15.908
543 HB2 LYS 65 HB2 LYS 65 -4.336 4.373 -17.119
544 HB3 LYS 65 HB3 LYS 65 -2.866 4.070 -16.214
545 HG2 LYS 65 HG2 LYS 65 -4.072 2.854 -14.543
546 HG3 LYS 65 HG3 LYS 65 -5.613 3.285 -15.286
547 HD2 LYS 65 HD2 LYS 65 -3.452 1.614 -16.567
548 HD3 LYS 65 HD3 LYS 65 -4.936 0.994 -15.845
549 HE2 LYS 65 HE2 LYS 65 -6.247 2.295 -17.472
550 HE3 LYS 65 HE3 LYS 65 -4.747 2.855 -18.212
551 HZ1 LYS 65 HZ1 LYS 65 -5.563 1.040 -19.481
552 HZ2 LYS 65 HZ2 LYS 65 -5.766 0.069 -18.107
553 HZ3 LYS 65 HZ3 LYS 65 -4.204 0.480 -18.632
554 H ARG 66 H ARG 66 -5.955 4.572 -13.941
555 HA ARG 66 HA ARG 66 -8.104 5.949 -15.360
556 HB2 ARG 66 HB2 ARG 66 -9.575 4.381 -13.958
557 HB3 ARG 66 HB3 ARG 66 -8.592 3.678 -15.231
558 HG2 ARG 66 HG2 ARG 66 -8.383 2.218 -13.424
559 HG3 ARG 66 HG3 ARG 66 -6.892 3.155 -13.420
560 HD2 ARG 66 HD2 ARG 66 -7.866 4.617 -11.677
561 HD3 ARG 66 HD3 ARG 66 -9.292 3.580 -11.643
562 HE ARG 66 HE ARG 66 -6.905 2.082 -11.239
563 HH11 ARG 66 HH11 ARG 66 -9.215 4.167 -9.610
564 HH12 ARG 66 HH12 ARG 66 -8.810 3.564 -8.025
565 HH21 ARG 66 HH21 ARG 66 -6.390 1.307 -9.160
566 HH22 ARG 66 HH22 ARG 66 -7.208 1.949 -7.770
567 H GLY 67 H GLY 67 -6.355 6.294 -12.490
568 HA2 GLY 67 HA2 GLY 67 -8.548 7.816 -11.246
569 HA3 GLY 67 HA3 GLY 67 -7.122 7.220 -10.406
570 H ALA 68 H ALA 68 -5.395 8.491 -10.222
571 HA ALA 68 HA ALA 68 -4.872 10.677 -11.995
572 HB1 ALA 68 HB1 ALA 68 -5.065 12.466 -10.336
573 HB2 ALA 68 HB2 ALA 68 -5.721 11.320 -9.168
574 HB3 ALA 68 HB3 ALA 68 -6.627 11.702 -10.633
575 HA PRO 69 HA PRO 69 -0.738 9.791 -10.725
576 HB2 PRO 69 HB2 PRO 69 0.254 12.398 -10.780
577 HB3 PRO 69 HB3 PRO 69 0.187 11.294 -12.155
578 HG2 PRO 69 HG2 PRO 69 -1.673 13.497 -11.393
579 HG3 PRO 69 HG3 PRO 69 -1.140 12.982 -13.005
580 HD2 PRO 69 HD2 PRO 69 -3.574 12.362 -12.077
581 HD3 PRO 69 HD3 PRO 69 -2.649 11.214 -13.071
582 H SER 70 H SER 70 -2.150 12.724 -9.282
583 HA SER 70 HA SER 70 -0.525 12.843 -7.021
584 HB2 SER 70 HB2 SER 70 -3.411 13.731 -7.210
585 HB3 SER 70 HB3 SER 70 -2.169 14.365 -6.127
586 HG SER 70 HG SER 70 -1.578 15.649 -7.667
587 H ILE 71 H ILE 71 -3.448 10.991 -7.653
588 HA ILE 71 HA ILE 71 -3.865 10.186 -4.941
589 HB ILE 71 HB ILE 71 -4.902 8.947 -7.501
590 HG12 ILE 71 HG12 ILE 71 -6.193 10.903 -5.582
591 HG13 ILE 71 HG13 ILE 71 -5.594 11.289 -7.193
592 HG21 ILE 71 HG21 ILE 71 -4.975 7.372 -5.638
593 HG22 ILE 71 HG22 ILE 71 -6.598 7.888 -6.093
594 HG23 ILE 71 HG23 ILE 71 -5.829 8.560 -4.654
595 HD11 ILE 71 HD11 ILE 71 -7.855 9.407 -6.554
596 HD12 ILE 71 HD12 ILE 71 -7.256 9.791 -8.167
597 HD13 ILE 71 HD13 ILE 71 -8.008 11.047 -7.184
598 H ALA 72 H ALA 72 -2.210 8.831 -7.735
599 HA ALA 72 HA ALA 72 -1.562 6.318 -6.645
600 HB1 ALA 72 HB1 ALA 72 -1.319 6.844 -9.027
601 HB2 ALA 72 HB2 ALA 72 0.190 6.235 -8.345
602 HB3 ALA 72 HB3 ALA 72 -0.008 7.961 -8.645
603 H ASN 73 H ASN 73 0.259 9.354 -6.751
604 HA ASN 73 HA ASN 73 2.466 8.559 -5.220
605 HB2 ASN 73 HB2 ASN 73 1.211 11.311 -5.395
606 HB3 ASN 73 HB3 ASN 73 2.844 10.957 -4.844
607 HD21 ASN 73 HD21 ASN 73 1.844 12.594 -7.069
608 HD22 ASN 73 HD22 ASN 73 2.609 11.971 -8.485
609 H ASP 74 H ASP 74 -0.581 10.066 -4.292
610 HA ASP 74 HA ASP 74 -0.182 10.360 -1.556
611 HB2 ASP 74 HB2 ASP 74 -2.125 11.273 -2.751
612 HB3 ASP 74 HB3 ASP 74 -2.744 9.644 -3.000
613 H THR 75 H THR 75 -1.338 7.544 -3.356
614 HA THR 75 HA THR 75 -1.783 5.917 -1.073
615 HB THR 75 HB THR 75 -1.275 5.077 -3.936
616 HG1 THR 75 HG1 THR 75 -3.093 6.347 -3.920
617 HG21 THR 75 HG21 THR 75 -2.504 3.036 -3.310
618 HG22 THR 75 HG22 THR 75 -2.584 3.604 -1.642
619 HG23 THR 75 HG23 THR 75 -1.023 3.217 -2.368
620 H LEU 76 H LEU 76 0.953 6.315 -3.294
621 HA LEU 76 HA LEU 76 2.600 4.285 -2.271
622 HB2 LEU 76 HB2 LEU 76 2.942 5.599 -4.390
623 HB3 LEU 76 HB3 LEU 76 3.482 6.945 -3.411
624 HG LEU 76 HG LEU 76 5.279 5.548 -4.516
625 HD11 LEU 76 HD11 LEU 76 6.783 5.615 -2.593
626 HD12 LEU 76 HD12 LEU 76 5.400 5.843 -1.523
627 HD13 LEU 76 HD13 LEU 76 5.809 7.080 -2.712
628 HD21 LEU 76 HD21 LEU 76 4.322 3.352 -4.120
629 HD22 LEU 76 HD22 LEU 76 4.492 3.578 -2.378
630 HD23 LEU 76 HD23 LEU 76 5.926 3.472 -3.398
631 H ARG 77 H ARG 77 2.235 7.682 -1.372
632 HA ARG 77 HA ARG 77 4.128 7.878 0.628
633 HB2 ARG 77 HB2 ARG 77 2.999 9.789 -0.224
634 HB3 ARG 77 HB3 ARG 77 1.430 9.142 0.222
635 HG2 ARG 77 HG2 ARG 77 1.828 9.529 2.516
636 HG3 ARG 77 HG3 ARG 77 3.535 9.882 2.224
637 HD2 ARG 77 HD2 ARG 77 2.128 11.888 2.558
638 HD3 ARG 77 HD3 ARG 77 3.000 11.871 1.038
639 HE ARG 77 HE ARG 77 0.154 11.120 1.207
640 HH11 ARG 77 HH11 ARG 77 2.749 12.971 -0.242
641 HH12 ARG 77 HH12 ARG 77 1.743 13.680 -1.457
642 HH21 ARG 77 HH21 ARG 77 -1.195 12.078 -0.378
643 HH22 ARG 77 HH22 ARG 77 -0.500 13.196 -1.519
644 H TRP 78 H TRP 78 0.749 6.807 0.839
645 HA TRP 78 HA TRP 78 0.761 6.210 3.598
646 HB2 TRP 78 HB2 TRP 78 -1.298 6.434 2.227
647 HB3 TRP 78 HB3 TRP 78 -0.895 4.931 1.407
648 HD1 TRP 78 HD1 TRP 78 -1.289 2.654 2.751
649 HE1 TRP 78 HE1 TRP 78 -2.681 2.107 4.843
650 HE3 TRP 78 HE3 TRP 78 -2.050 7.406 4.490
651 HZ2 TRP 78 HZ2 TRP 78 -3.927 3.499 6.951
652 HZ3 TRP 78 HZ3 TRP 78 -3.351 7.707 6.553
653 HH2 TRP 78 HH2 TRP 78 -4.270 5.792 7.759
654 H LEU 79 H LEU 79 1.557 4.294 0.738
655 HA LEU 79 HA LEU 79 1.841 1.787 1.943
656 HB2 LEU 79 HB2 LEU 79 3.306 2.939 -0.432
657 HB3 LEU 79 HB3 LEU 79 3.329 1.246 0.024
658 HG LEU 79 HG LEU 79 0.870 2.792 -0.791
659 HD11 LEU 79 HD11 LEU 79 0.964 1.458 -2.828
660 HD12 LEU 79 HD12 LEU 79 2.472 0.722 -2.286
661 HD13 LEU 79 HD13 LEU 79 2.413 2.446 -2.650
662 HD21 LEU 79 HD21 LEU 79 -0.205 0.596 -0.837
663 HD22 LEU 79 HD22 LEU 79 0.371 0.999 0.781
664 HD23 LEU 79 HD23 LEU 79 1.272 -0.142 -0.218
665 H LYS 80 H LYS 80 4.232 4.383 1.480
666 HA LYS 80 HA LYS 80 6.486 3.018 2.371
667 HB2 LYS 80 HB2 LYS 80 6.772 5.106 1.312
668 HB3 LYS 80 HB3 LYS 80 5.669 5.908 2.421
669 HG2 LYS 80 HG2 LYS 80 7.510 5.084 4.170
670 HG3 LYS 80 HG3 LYS 80 8.523 5.257 2.732
671 HD2 LYS 80 HD2 LYS 80 6.624 7.372 3.704
672 HD3 LYS 80 HD3 LYS 80 8.322 7.306 4.148
673 HE2 LYS 80 HE2 LYS 80 7.454 7.301 1.288
674 HE3 LYS 80 HE3 LYS 80 7.640 8.801 2.186
675 HZ1 LYS 80 HZ1 LYS 80 9.705 8.514 1.202
676 HZ2 LYS 80 HZ2 LYS 80 9.695 6.836 1.401
677 HZ3 LYS 80 HZ3 LYS 80 9.964 7.842 2.737
678 H ARG 81 H ARG 81 4.127 4.958 4.177
679 HA ARG 81 HA ARG 81 5.182 4.814 6.728
680 HB2 ARG 81 HB2 ARG 81 2.297 4.694 5.844
681 HB3 ARG 81 HB3 ARG 81 2.790 4.895 7.517
682 HG2 ARG 81 HG2 ARG 81 3.810 7.016 7.012
683 HG3 ARG 81 HG3 ARG 81 3.489 6.797 5.288
684 HD2 ARG 81 HD2 ARG 81 1.133 6.916 5.633
685 HD3 ARG 81 HD3 ARG 81 1.327 6.851 7.383
686 HE ARG 81 HE ARG 81 2.702 9.095 6.598
687 HH11 ARG 81 HH11 ARG 81 -0.589 7.938 6.300
688 HH12 ARG 81 HH12 ARG 81 -1.295 9.524 6.350
689 HH21 ARG 81 HH21 ARG 81 1.777 11.193 6.669
690 HH22 ARG 81 HH22 ARG 81 0.048 11.371 6.565
691 H MET 82 H MET 82 3.085 2.475 5.096
692 HA MET 82 HA MET 82 2.814 0.706 7.283
693 HB2 MET 82 HB2 MET 82 1.238 0.727 5.418
694 HB3 MET 82 HB3 MET 82 2.502 0.199 4.319
695 HG2 MET 82 HG2 MET 82 2.680 -1.910 5.544
696 HG3 MET 82 HG3 MET 82 1.399 -1.376 6.633
697 HE1 MET 82 HE1 MET 82 1.656 -0.778 2.746
698 HE2 MET 82 HE2 MET 82 0.778 -2.178 2.127
699 HE3 MET 82 HE3 MET 82 2.318 -2.399 2.958
700 H PHE 83 H PHE 83 4.929 0.594 4.413
701 HA PHE 83 HA PHE 83 6.189 -1.838 5.141
702 HB2 PHE 83 HB2 PHE 83 7.120 0.374 3.304
703 HB3 PHE 83 HB3 PHE 83 7.939 -1.176 3.478
704 HD1 PHE 83 HD1 PHE 83 5.976 -3.181 3.427
705 HD2 PHE 83 HD2 PHE 83 5.996 0.518 1.325
706 HE1 PHE 83 HE1 PHE 83 4.503 -4.152 1.713
707 HE2 PHE 83 HE2 PHE 83 4.520 -0.443 -0.392
708 HZ PHE 83 HZ PHE 83 3.771 -2.779 -0.199
709 H ASN 84 H ASN 84 6.977 1.541 5.736
710 HA ASN 84 HA ASN 84 9.486 1.234 6.917
711 HB2 ASN 84 HB2 ASN 84 8.752 3.442 6.449
712 HB3 ASN 84 HB3 ASN 84 7.269 3.228 7.372
713 HD21 ASN 84 HD21 ASN 84 10.707 3.754 7.554
714 HD22 ASN 84 HD22 ASN 84 10.736 4.267 9.205
715 H TYR 85 H TYR 85 6.263 1.086 8.368
716 HA TYR 85 HA TYR 85 7.059 0.629 11.014
717 HB2 TYR 85 HB2 TYR 85 4.753 1.220 10.325
718 HB3 TYR 85 HB3 TYR 85 4.571 -0.375 9.604
719 HD1 TYR 85 HD2 TYR 85 5.203 1.341 12.837
720 HD2 TYR 85 HD1 TYR 85 3.817 -2.175 10.885
721 HE1 TYR 85 HE2 TYR 85 4.414 0.463 14.994
722 HE2 TYR 85 HE1 TYR 85 3.028 -3.065 13.036
723 HH TYR 85 HH TYR 85 2.668 -1.219 15.787
724 H ALA 86 H ALA 86 6.534 -1.600 8.326
725 HA ALA 86 HA ALA 86 6.925 -3.992 9.788
726 HB1 ALA 86 HB1 ALA 86 5.851 -3.960 7.596
727 HB2 ALA 86 HB2 ALA 86 7.237 -5.050 7.610
728 HB3 ALA 86 HB3 ALA 86 7.371 -3.463 6.852
729 H ILE 87 H ILE 87 9.097 -1.643 8.445
730 HA ILE 87 HA ILE 87 11.469 -3.201 8.512
731 HB ILE 87 HB ILE 87 11.118 -0.205 8.717
732 HG12 ILE 87 HG12 ILE 87 11.890 -1.974 6.391
733 HG13 ILE 87 HG13 ILE 87 10.323 -1.203 6.613
734 HG21 ILE 87 HG21 ILE 87 13.497 -0.053 8.134
735 HG22 ILE 87 HG22 ILE 87 13.631 -1.808 8.254
736 HG23 ILE 87 HG23 ILE 87 13.248 -0.852 9.687
737 HD11 ILE 87 HD11 ILE 87 12.944 0.221 6.233
738 HD12 ILE 87 HD12 ILE 87 11.369 0.986 6.445
739 HD13 ILE 87 HD13 ILE 87 11.689 0.006 5.013
740 H LYS 88 H LYS 88 10.049 -0.900 10.832
741 HA LYS 88 HA LYS 88 12.016 -1.147 12.805
742 HB2 LYS 88 HB2 LYS 88 9.094 -0.459 13.030
743 HB3 LYS 88 HB3 LYS 88 10.190 -0.427 14.404
744 HG2 LYS 88 HG2 LYS 88 10.632 1.672 13.867
745 HG3 LYS 88 HG3 LYS 88 11.496 1.048 12.461
746 HD2 LYS 88 HD2 LYS 88 9.952 2.664 11.672
747 HD3 LYS 88 HD3 LYS 88 9.315 1.088 11.230
748 HE2 LYS 88 HE2 LYS 88 7.678 1.151 12.911
749 HE3 LYS 88 HE3 LYS 88 8.472 2.481 13.751
750 HZ1 LYS 88 HZ1 LYS 88 6.443 3.099 12.444
751 HZ2 LYS 88 HZ2 LYS 88 7.318 2.746 11.033
752 HZ3 LYS 88 HZ3 LYS 88 7.835 3.986 12.058
753 H ARG 89 H ARG 89 8.959 -2.881 12.414
754 HA ARG 89 HA ARG 89 9.392 -4.601 14.649
755 HB2 ARG 89 HB2 ARG 89 7.523 -4.718 12.307
756 HB3 ARG 89 HB3 ARG 89 7.641 -6.066 13.426
757 HG2 ARG 89 HG2 ARG 89 7.169 -4.360 15.261
758 HG3 ARG 89 HG3 ARG 89 6.688 -3.276 13.952
759 HD2 ARG 89 HD2 ARG 89 5.046 -4.901 13.188
760 HD3 ARG 89 HD3 ARG 89 5.546 -6.024 14.450
761 HE ARG 89 HE ARG 89 4.293 -3.406 15.016
762 HH11 ARG 89 HH11 ARG 89 4.713 -6.815 15.698
763 HH12 ARG 89 HH12 ARG 89 3.512 -6.851 16.949
764 HH21 ARG 89 HH21 ARG 89 2.703 -3.443 16.634
765 HH22 ARG 89 HH22 ARG 89 2.345 -4.926 17.465
766 H HIS 90 H HIS 90 11.044 -4.481 11.796
767 HA HIS 90 HA HIS 90 12.557 -5.826 10.781
768 HB2 HIS 90 HB2 HIS 90 12.282 -7.309 13.390
769 HB3 HIS 90 HB3 HIS 90 13.375 -7.845 12.119
770 HD1 HIS 90 HD1 HIS 90 14.818 -7.250 14.555
771 HD2 HIS 90 HD2 HIS 90 13.790 -4.210 11.905
772 HE1 HIS 90 HE1 HIS 90 16.407 -5.361 15.036
773 HE2 HIS 90 HE2 HIS 90 15.711 -3.497 13.482
774 H ILE 91 H ILE 91 9.637 -6.299 10.453
775 HA ILE 91 HA ILE 91 9.192 -9.071 10.041
776 HB ILE 91 HB ILE 91 7.878 -6.743 8.619
777 HG12 ILE 91 HG12 ILE 91 7.670 -6.561 11.068
778 HG13 ILE 91 HG13 ILE 91 6.118 -6.895 10.310
779 HG21 ILE 91 HG21 ILE 91 7.507 -8.860 7.487
780 HG22 ILE 91 HG22 ILE 91 6.018 -8.291 8.243
781 HG23 ILE 91 HG23 ILE 91 6.949 -9.586 8.995
782 HD11 ILE 91 HD11 ILE 91 7.864 -8.919 11.694
783 HD12 ILE 91 HD12 ILE 91 6.288 -9.230 10.965
784 HD13 ILE 91 HD13 ILE 91 6.419 -8.165 12.364
785 H ILE 92 H ILE 92 10.168 -6.426 7.925
786 HA ILE 92 HA ILE 92 11.441 -8.386 6.147
787 HB ILE 92 HB ILE 92 10.926 -6.795 4.238
788 HG12 ILE 92 HG12 ILE 92 8.883 -5.764 6.223
789 HG13 ILE 92 HG13 ILE 92 10.240 -4.855 5.570
790 HG21 ILE 92 HG21 ILE 92 8.681 -7.737 3.880
791 HG22 ILE 92 HG22 ILE 92 8.656 -8.270 5.562
792 HG23 ILE 92 HG23 ILE 92 9.841 -8.941 4.440
793 HD11 ILE 92 HD11 ILE 92 9.263 -5.000 3.340
794 HD12 ILE 92 HD12 ILE 92 8.160 -4.238 4.484
795 HD13 ILE 92 HD13 ILE 92 7.905 -5.913 3.995
796 H GLU 93 H GLU 93 11.311 -5.069 7.317
797 HA GLU 93 HA GLU 93 12.903 -3.543 7.797
798 HB2 GLU 93 HB2 GLU 93 14.096 -5.752 8.579
799 HB3 GLU 93 HB3 GLU 93 15.120 -5.455 7.182
800 HG2 GLU 93 HG2 GLU 93 15.746 -3.290 8.054
801 HG3 GLU 93 HG3 GLU 93 14.653 -3.500 9.422
802 H TYR 94 H TYR 94 12.222 -4.644 4.911
803 HA TYR 94 HA TYR 94 14.056 -2.790 3.549
804 HB2 TYR 94 HB2 TYR 94 12.606 -5.213 2.459
805 HB3 TYR 94 HB3 TYR 94 13.443 -4.039 1.450
806 HD1 TYR 94 HD2 TYR 94 15.960 -3.680 1.946
807 HD2 TYR 94 HD1 TYR 94 13.754 -7.058 3.291
808 HE1 TYR 94 HE2 TYR 94 18.056 -4.938 2.205
809 HE2 TYR 94 HE1 TYR 94 15.844 -8.327 3.554
810 HH TYR 94 HH TYR 94 18.153 -8.285 2.585
811 H ASN 95 H ASN 95 13.143 -1.153 2.343
812 HA ASN 95 HA ASN 95 10.240 -0.889 2.508
813 HB2 ASN 95 HB2 ASN 95 11.823 0.843 3.501
814 HB3 ASN 95 HB3 ASN 95 12.231 1.267 1.840
815 HD21 ASN 95 HD21 ASN 95 11.010 2.852 3.876
816 HD22 ASN 95 HD22 ASN 95 9.483 3.331 3.257
817 HA PRO 96 HA PRO 96 10.829 -1.867 -1.977
818 HB2 PRO 96 HB2 PRO 96 8.204 -2.607 -2.320
819 HB3 PRO 96 HB3 PRO 96 9.492 -3.713 -1.832
820 HG2 PRO 96 HG2 PRO 96 7.453 -2.317 -0.152
821 HG3 PRO 96 HG3 PRO 96 8.057 -3.980 -0.031
822 HD2 PRO 96 HD2 PRO 96 8.907 -2.036 1.624
823 HD3 PRO 96 HD3 PRO 96 9.986 -3.332 1.069
824 H ALA 97 H ALA 97 8.755 0.263 -0.224
825 HA ALA 97 HA ALA 97 7.672 1.510 -2.618
826 HB1 ALA 97 HB1 ALA 97 6.412 2.914 -1.070
827 HB2 ALA 97 HB2 ALA 97 7.289 2.211 0.289
828 HB3 ALA 97 HB3 ALA 97 6.215 1.205 -0.682
829 H ALA 98 H ALA 98 10.529 1.695 -0.986
830 HA ALA 98 HA ALA 98 10.868 4.549 -0.901
831 HB1 ALA 98 HB1 ALA 98 12.960 2.382 -0.720
832 HB2 ALA 98 HB2 ALA 98 12.066 3.055 0.644
833 HB3 ALA 98 HB3 ALA 98 13.166 4.078 -0.280
834 H ALA 99 H ALA 99 10.806 2.371 -3.396
835 HA ALA 99 HA ALA 99 12.866 3.585 -5.033
836 HB1 ALA 99 HB1 ALA 99 10.779 1.515 -5.723
837 HB2 ALA 99 HB2 ALA 99 12.435 1.188 -5.210
838 HB3 ALA 99 HB3 ALA 99 12.134 1.999 -6.746
839 H PHE 100 H PHE 100 9.900 4.564 -4.093
840 HA PHE 100 HA PHE 100 9.548 6.179 -6.512
841 HB2 PHE 100 HB2 PHE 100 7.959 4.152 -6.384
842 HB3 PHE 100 HB3 PHE 100 7.192 4.994 -5.044
843 HD1 PHE 100 HD1 PHE 100 8.062 5.314 -8.631
844 HD2 PHE 100 HD2 PHE 100 5.589 6.649 -5.436
845 HE1 PHE 100 HE1 PHE 100 6.681 6.575 -10.231
846 HE2 PHE 100 HE2 PHE 100 4.206 7.913 -7.026
847 HZ PHE 100 HZ PHE 100 4.752 7.877 -9.430
848 H ASP 101 H ASP 101 8.646 8.246 -6.109
849 HA ASP 101 HA ASP 101 9.036 9.129 -3.357
850 HB2 ASP 101 HB2 ASP 101 10.116 10.365 -5.214
851 HB3 ASP 101 HB3 ASP 101 8.524 10.758 -5.857
852 HA PRO 102 HA PRO 102 4.755 9.182 -2.283
853 HB2 PRO 102 HB2 PRO 102 4.841 11.320 -0.537
854 HB3 PRO 102 HB3 PRO 102 5.266 9.656 -0.123
855 HG2 PRO 102 HG2 PRO 102 7.043 11.940 -0.879
856 HG3 PRO 102 HG3 PRO 102 7.274 10.708 0.377
857 HD2 PRO 102 HD2 PRO 102 8.570 10.548 -1.946
858 HD3 PRO 102 HD3 PRO 102 7.930 9.090 -1.157
859 H GLY 103 H GLY 103 6.318 11.892 -3.738
860 HA2 GLY 103 HA2 GLY 103 5.539 13.506 -5.155
861 HA3 GLY 103 HA3 GLY 103 4.175 12.438 -5.420
862 H ASP 104 H ASP 104 5.394 14.853 -3.096
863 HA ASP 104 HA ASP 104 2.742 15.507 -2.219
864 HB2 ASP 104 HB2 ASP 104 4.761 15.869 -0.793
865 HB3 ASP 104 HB3 ASP 104 5.273 17.139 -1.902
866 H ALA 105 H ALA 105 1.328 16.525 -3.460
867 HA ALA 105 HA ALA 105 2.137 18.777 -5.101
868 HB1 ALA 105 HB1 ALA 105 1.261 17.852 -7.176
869 HB2 ALA 105 HB2 ALA 105 0.910 16.326 -6.362
870 HB3 ALA 105 HB3 ALA 105 2.579 16.857 -6.558
871 H GLY 106 H GLY 106 0.117 19.562 -6.387
872 HA2 GLY 106 HA2 GLY 106 -2.012 19.822 -4.415
873 HA3 GLY 106 HA3 GLY 106 -1.826 20.764 -5.890
874 H GLY 107 H GLY 107 -2.867 17.679 -4.576
875 HA2 GLY 107 HA2 GLY 107 -4.650 17.380 -6.899
876 HA3 GLY 107 HA3 GLY 107 -3.639 16.030 -6.407
877 H LYS 108 H LYS 108 -4.402 17.611 -3.624
878 HA LYS 108 HA LYS 108 -6.305 15.652 -2.813
879 HB2 LYS 108 HB2 LYS 108 -5.200 18.139 -1.540
880 HB3 LYS 108 HB3 LYS 108 -6.514 17.242 -0.789
881 HG2 LYS 108 HG2 LYS 108 -3.820 16.109 -1.500
882 HG3 LYS 108 HG3 LYS 108 -4.331 16.620 0.113
883 HD2 LYS 108 HD2 LYS 108 -6.099 14.964 0.109
884 HD3 LYS 108 HD3 LYS 108 -5.676 14.483 -1.536
885 HE2 LYS 108 HE2 LYS 108 -3.524 13.724 -0.803
886 HE3 LYS 108 HE3 LYS 108 -3.831 14.318 0.824
887 HZ1 LYS 108 HZ1 LYS 108 -4.159 11.916 0.632
888 HZ2 LYS 108 HZ2 LYS 108 -5.371 12.165 -0.525
889 HZ3 LYS 108 HZ3 LYS 108 -5.597 12.708 1.067
890 H LEU 109 H LEU 109 -8.367 16.358 -1.699
891 HA LEU 109 HA LEU 109 -9.983 17.716 -3.669
892 HB2 LEU 109 HB2 LEU 109 -10.841 15.735 -2.509
893 HB3 LEU 109 HB3 LEU 109 -10.711 16.566 -0.970
894 HG LEU 109 HG LEU 109 -12.405 18.211 -1.768
895 HD11 LEU 109 HD11 LEU 109 -13.744 17.649 -3.738
896 HD12 LEU 109 HD12 LEU 109 -12.649 16.313 -4.096
897 HD13 LEU 109 HD13 LEU 109 -12.062 17.975 -4.159
898 HD21 LEU 109 HD21 LEU 109 -14.321 16.696 -1.559
899 HD22 LEU 109 HD22 LEU 109 -13.070 16.349 -0.366
900 HD23 LEU 109 HD23 LEU 109 -13.246 15.316 -1.785
901 H GLU 110 H GLU 110 -9.485 19.864 -3.703
902 HA GLU 110 HA GLU 110 -9.199 21.410 -1.312
903 HB2 GLU 110 HB2 GLU 110 -8.217 21.874 -3.666
904 HB3 GLU 110 HB3 GLU 110 -9.796 22.559 -4.026
905 HG2 GLU 110 HG2 GLU 110 -8.340 24.331 -3.397
906 HG3 GLU 110 HG3 GLU 110 -9.503 24.093 -2.090
907 H HIS 111 H HIS 111 -10.909 21.664 -0.024
908 HA HIS 111 HA HIS 111 -13.440 22.507 -1.236
909 HB2 HIS 111 HB2 HIS 111 -14.714 21.014 0.235
910 HB3 HIS 111 HB3 HIS 111 -13.641 20.100 -0.813
911 HD1 HIS 111 HD1 HIS 111 -11.359 19.218 0.425
912 HD2 HIS 111 HD2 HIS 111 -14.501 20.431 2.865
913 HE1 HIS 111 HE1 HIS 111 -10.890 18.223 2.685
914 HE2 HIS 111 HE2 HIS 111 -12.673 19.175 4.194
915 H HIS 112 H HIS 112 -13.970 24.401 -0.427
916 HA HIS 112 HA HIS 112 -13.535 24.918 2.430
917 HB2 HIS 112 HB2 HIS 112 -12.632 26.791 0.228
918 HB3 HIS 112 HB3 HIS 112 -12.645 27.182 1.942
919 HD1 HIS 112 HD1 HIS 112 -10.929 25.781 3.456
920 HD2 HIS 112 HD2 HIS 112 -10.394 25.496 -0.659
921 HE1 HIS 112 HE1 HIS 112 -8.612 24.858 3.131
922 HE2 HIS 112 HE2 HIS 112 -8.396 24.503 0.643
923 H HIS 113 H HIS 113 -15.148 26.005 3.367
924 HA HIS 113 HA HIS 113 -16.884 27.654 1.676
925 HB2 HIS 113 HB2 HIS 113 -18.871 26.933 3.005
926 HB3 HIS 113 HB3 HIS 113 -18.192 25.663 2.001
927 HD1 HIS 113 HD1 HIS 113 -18.915 26.572 5.522
928 HD2 HIS 113 HD2 HIS 113 -16.946 23.558 3.437
929 HE1 HIS 113 HE1 HIS 113 -18.603 24.700 7.172
930 HE2 HIS 113 HE2 HIS 113 -17.577 22.819 5.838
931 H HIS 114 H HIS 114 -16.790 29.638 2.339
932 HA HIS 114 HA HIS 114 -15.472 30.347 4.760
933 HB2 HIS 114 HB2 HIS 114 -15.452 31.649 2.588
934 HB3 HIS 114 HB3 HIS 114 -17.088 32.168 2.969
935 HD1 HIS 114 HD1 HIS 114 -13.516 32.610 4.035
936 HD2 HIS 114 HD2 HIS 114 -17.276 34.168 4.913
937 HE1 HIS 114 HE1 HIS 114 -13.095 34.681 5.403
938 HE2 HIS 114 HE2 HIS 114 -15.371 35.705 5.760
939 H HIS 115 H HIS 115 -16.273 31.189 6.652
940 HA HIS 115 HA HIS 115 -19.068 30.637 7.193
941 HB2 HIS 115 HB2 HIS 115 -17.382 30.014 8.862
942 HB3 HIS 115 HB3 HIS 115 -16.875 31.693 9.001
943 HD1 HIS 115 HD1 HIS 115 -19.796 29.431 9.794
944 HD2 HIS 115 HD2 HIS 115 -18.358 33.216 10.756
945 HE1 HIS 115 HE1 HIS 115 -21.241 30.248 11.686
946 HE2 HIS 115 HE2 HIS 115 -20.206 32.436 12.391
947 H HIS 116 H HIS 116 -20.351 32.124 6.249
948 HA HIS 116 HA HIS 116 -20.278 34.810 7.330
949 HB2 HIS 116 HB2 HIS 116 -18.813 34.839 5.271
950 HB3 HIS 116 HB3 HIS 116 -20.238 34.419 4.330
951 HD1 HIS 116 HD1 HIS 116 -21.891 36.292 3.794
952 HD2 HIS 116 HD2 HIS 116 -18.815 37.465 6.342
953 HE1 HIS 116 HE1 HIS 116 -22.055 38.799 3.957
954 HE2 HIS 116 HE2 HIS 116 -20.308 39.460 5.648
Start of MODEL 3
1 H1 MET 1 H1 MET 1 -0.031 -8.449 16.329
2 H2 MET 1 H2 MET 1 0.002 -8.115 14.668
3 H3 MET 1 H3 MET 1 -0.328 -6.873 15.768
4 HA MET 1 HA MET 1 1.915 -6.701 14.945
5 HB2 MET 1 HB2 MET 1 1.749 -7.605 17.832
6 HB3 MET 1 HB3 MET 1 3.105 -6.736 17.130
7 HG2 MET 1 HG2 MET 1 1.820 -5.152 18.306
8 HG3 MET 1 HG3 MET 1 1.510 -4.878 16.593
9 HE1 MET 1 HE1 MET 1 -0.345 -3.554 18.688
10 HE2 MET 1 HE2 MET 1 -1.946 -3.939 18.058
11 HE3 MET 1 HE3 MET 1 -0.649 -3.481 16.952
12 H ALA 2 H ALA 2 4.101 -7.617 14.977
13 HA ALA 2 HA ALA 2 4.058 -10.379 14.228
14 HB1 ALA 2 HB1 ALA 2 6.443 -10.094 13.776
15 HB2 ALA 2 HB2 ALA 2 6.409 -8.515 14.559
16 HB3 ALA 2 HB3 ALA 2 5.503 -8.780 13.069
17 H GLU 3 H GLU 3 3.524 -11.596 15.965
18 HA GLU 3 HA GLU 3 5.022 -11.343 18.450
19 HB2 GLU 3 HB2 GLU 3 2.779 -13.226 17.695
20 HB3 GLU 3 HB3 GLU 3 3.442 -13.007 19.308
21 HG2 GLU 3 HG2 GLU 3 2.613 -10.764 19.410
22 HG3 GLU 3 HG3 GLU 3 2.102 -10.833 17.723
23 H LYS 4 H LYS 4 4.483 -13.629 15.831
24 HA LYS 4 HA LYS 4 6.999 -14.942 16.439
25 HB2 LYS 4 HB2 LYS 4 5.920 -17.210 16.392
26 HB3 LYS 4 HB3 LYS 4 5.569 -16.259 17.826
27 HG2 LYS 4 HG2 LYS 4 3.378 -15.728 17.014
28 HG3 LYS 4 HG3 LYS 4 3.726 -16.485 15.458
29 HD2 LYS 4 HD2 LYS 4 3.958 -18.654 16.564
30 HD3 LYS 4 HD3 LYS 4 3.620 -17.898 18.125
31 HE2 LYS 4 HE2 LYS 4 1.402 -17.276 17.381
32 HE3 LYS 4 HE3 LYS 4 1.737 -17.912 15.770
33 HZ1 LYS 4 HZ1 LYS 4 0.420 -19.430 17.155
34 HZ2 LYS 4 HZ2 LYS 4 1.709 -19.549 18.251
35 HZ3 LYS 4 HZ3 LYS 4 1.890 -20.117 16.665
36 H ASN 5 H ASN 5 4.207 -14.497 14.385
37 HA ASN 5 HA ASN 5 5.710 -15.646 12.125
38 HB2 ASN 5 HB2 ASN 5 2.713 -15.357 12.462
39 HB3 ASN 5 HB3 ASN 5 3.518 -15.991 11.032
40 HD21 ASN 5 HD21 ASN 5 1.570 -17.216 12.810
41 HD22 ASN 5 HD22 ASN 5 2.303 -18.684 13.366
42 H ALA 6 H ALA 6 6.119 -14.378 10.403
43 HA ALA 6 HA ALA 6 5.424 -11.583 10.517
44 HB1 ALA 6 HB1 ALA 6 7.623 -12.292 9.704
45 HB2 ALA 6 HB2 ALA 6 6.745 -11.387 8.472
46 HB3 ALA 6 HB3 ALA 6 6.854 -13.145 8.366
47 H TYR 7 H TYR 7 3.301 -11.237 10.184
48 HA TYR 7 HA TYR 7 1.689 -12.747 8.422
49 HB2 TYR 7 HB2 TYR 7 0.073 -10.749 8.786
50 HB3 TYR 7 HB3 TYR 7 0.477 -11.793 10.142
51 HD1 TYR 7 HD2 TYR 7 1.985 -11.005 11.901
52 HD2 TYR 7 HD1 TYR 7 0.737 -8.431 8.756
53 HE1 TYR 7 HE2 TYR 7 2.695 -9.067 13.218
54 HE2 TYR 7 HE1 TYR 7 1.440 -6.473 10.076
55 HH TYR 7 HH TYR 7 1.775 -5.939 12.557
56 H THR 8 H THR 8 0.242 -11.446 6.792
57 HA THR 8 HA THR 8 2.111 -10.670 4.726
58 HB THR 8 HB THR 8 0.085 -10.748 3.267
59 HG1 THR 8 HG1 THR 8 -1.365 -11.980 5.319
60 HG21 THR 8 HG21 THR 8 1.496 -12.728 3.581
61 HG22 THR 8 HG22 THR 8 -0.200 -13.179 3.400
62 HG23 THR 8 HG23 THR 8 0.549 -13.182 4.998
63 H VAL 9 H VAL 9 1.263 -8.905 3.168
64 HA VAL 9 HA VAL 9 1.291 -6.440 4.530
65 HB VAL 9 HB VAL 9 2.153 -6.721 2.239
66 HG11 VAL 9 HG11 VAL 9 0.454 -8.222 1.359
67 HG12 VAL 9 HG12 VAL 9 0.630 -6.800 0.330
68 HG13 VAL 9 HG13 VAL 9 -0.743 -6.930 1.431
69 HG21 VAL 9 HG21 VAL 9 -0.038 -4.666 2.484
70 HG22 VAL 9 HG22 VAL 9 1.261 -4.636 1.292
71 HG23 VAL 9 HG23 VAL 9 1.637 -4.487 3.008
72 H ALA 10 H ALA 10 -1.294 -8.518 3.467
73 HA ALA 10 HA ALA 10 -3.432 -6.693 3.550
74 HB1 ALA 10 HB1 ALA 10 -3.613 -8.958 2.607
75 HB2 ALA 10 HB2 ALA 10 -4.867 -8.639 3.806
76 HB3 ALA 10 HB3 ALA 10 -3.474 -9.633 4.231
77 H GLN 11 H GLN 11 -2.012 -8.762 6.041
78 HA GLN 11 HA GLN 11 -3.782 -7.862 8.100
79 HB2 GLN 11 HB2 GLN 11 -1.144 -9.326 8.319
80 HB3 GLN 11 HB3 GLN 11 -2.320 -9.137 9.611
81 HG2 GLN 11 HG2 GLN 11 -2.682 -10.670 7.049
82 HG3 GLN 11 HG3 GLN 11 -2.500 -11.336 8.671
83 HE21 GLN 11 HE21 GLN 11 -4.223 -11.197 10.116
84 HE22 GLN 11 HE22 GLN 11 -5.833 -10.850 9.591
85 H LEU 12 H LEU 12 -0.560 -7.044 7.003
86 HA LEU 12 HA LEU 12 0.195 -5.358 9.117
87 HB2 LEU 12 HB2 LEU 12 1.722 -6.239 7.372
88 HB3 LEU 12 HB3 LEU 12 0.969 -5.173 6.204
89 HG LEU 12 HG LEU 12 1.761 -3.219 7.491
90 HD11 LEU 12 HD11 LEU 12 3.393 -3.517 9.268
91 HD12 LEU 12 HD12 LEU 12 3.204 -5.268 9.166
92 HD13 LEU 12 HD13 LEU 12 1.855 -4.266 9.699
93 HD21 LEU 12 HD21 LEU 12 3.896 -5.195 6.711
94 HD22 LEU 12 HD22 LEU 12 4.134 -3.460 6.924
95 HD23 LEU 12 HD23 LEU 12 3.081 -4.058 5.640
96 H ALA 13 H ALA 13 -1.435 -4.664 6.042
97 HA ALA 13 HA ALA 13 -1.676 -1.875 6.457
98 HB1 ALA 13 HB1 ALA 13 -3.268 -1.920 4.617
99 HB2 ALA 13 HB2 ALA 13 -3.376 -3.676 4.734
100 HB3 ALA 13 HB3 ALA 13 -1.860 -2.916 4.243
101 H ASP 14 H ASP 14 -3.724 -4.612 7.305
102 HA ASP 14 HA ASP 14 -5.996 -3.131 8.101
103 HB2 ASP 14 HB2 ASP 14 -6.170 -5.519 7.717
104 HB3 ASP 14 HB3 ASP 14 -5.018 -5.847 9.009
105 H GLU 15 H GLU 15 -3.185 -4.309 9.895
106 HA GLU 15 HA GLU 15 -4.016 -3.294 12.413
107 HB2 GLU 15 HB2 GLU 15 -2.331 -5.104 12.082
108 HB3 GLU 15 HB3 GLU 15 -1.212 -3.902 11.457
109 HG2 GLU 15 HG2 GLU 15 -0.909 -2.918 13.529
110 HG3 GLU 15 HG3 GLU 15 -2.404 -3.592 14.180
111 H TYR 16 H TYR 16 -2.009 -2.042 9.804
112 HA TYR 16 HA TYR 16 -1.231 0.384 10.962
113 HB2 TYR 16 HB2 TYR 16 -0.307 -0.515 8.858
114 HB3 TYR 16 HB3 TYR 16 -1.850 -0.240 8.062
115 HD1 TYR 16 HD1 TYR 16 0.956 1.520 9.750
116 HD2 TYR 16 HD2 TYR 16 -2.301 1.816 7.028
117 HE1 TYR 16 HE1 TYR 16 1.713 3.767 9.093
118 HE2 TYR 16 HE2 TYR 16 -1.556 4.063 6.369
119 HH TYR 16 HH TYR 16 -0.223 5.884 7.223
120 H PHE 17 H PHE 17 -4.118 -0.499 9.117
121 HA PHE 17 HA PHE 17 -5.355 1.986 8.942
122 HB2 PHE 17 HB2 PHE 17 -6.112 -0.048 7.756
123 HB3 PHE 17 HB3 PHE 17 -6.663 -0.728 9.280
124 HD1 PHE 17 HD2 PHE 17 -8.600 0.316 10.460
125 HD2 PHE 17 HD1 PHE 17 -7.436 1.479 6.537
126 HE1 PHE 17 HE2 PHE 17 -10.808 1.342 10.113
127 HE2 PHE 17 HE1 PHE 17 -9.641 2.505 6.184
128 HZ PHE 17 HZ PHE 17 -11.332 2.439 7.971
129 H GLU 18 H GLU 18 -5.687 -0.485 11.474
130 HA GLU 18 HA GLU 18 -7.677 0.862 12.935
131 HB2 GLU 18 HB2 GLU 18 -6.286 -1.583 13.111
132 HB3 GLU 18 HB3 GLU 18 -6.056 -0.774 14.655
133 HG2 GLU 18 HG2 GLU 18 -8.706 -1.339 13.341
134 HG3 GLU 18 HG3 GLU 18 -7.999 -2.236 14.682
135 H ARG 19 H ARG 19 -4.266 1.373 12.808
136 HA ARG 19 HA ARG 19 -4.338 2.862 15.326
137 HB2 ARG 19 HB2 ARG 19 -2.010 2.095 13.564
138 HB3 ARG 19 HB3 ARG 19 -1.873 3.017 15.056
139 HG2 ARG 19 HG2 ARG 19 -2.757 0.165 14.721
140 HG3 ARG 19 HG3 ARG 19 -1.342 0.774 15.585
141 HD2 ARG 19 HD2 ARG 19 -2.892 1.943 17.150
142 HD3 ARG 19 HD3 ARG 19 -4.237 1.140 16.344
143 HE ARG 19 HE ARG 19 -2.137 -0.203 17.927
144 HH11 ARG 19 HH11 ARG 19 -5.310 -0.203 16.434
145 HH12 ARG 19 HH12 ARG 19 -5.823 -1.672 17.209
146 HH21 ARG 19 HH21 ARG 19 -2.810 -2.114 18.971
147 HH22 ARG 19 HH22 ARG 19 -4.382 -2.777 18.639
148 H MET 20 H MET 20 -4.037 3.353 11.885
149 HA MET 20 HA MET 20 -3.303 6.157 12.284
150 HB2 MET 20 HB2 MET 20 -3.397 4.415 9.831
151 HB3 MET 20 HB3 MET 20 -3.112 6.147 9.757
152 HG2 MET 20 HG2 MET 20 -1.410 4.393 11.477
153 HG3 MET 20 HG3 MET 20 -1.103 4.536 9.749
154 HE1 MET 20 HE1 MET 20 -2.218 7.157 12.538
155 HE2 MET 20 HE2 MET 20 -0.671 7.949 12.837
156 HE3 MET 20 HE3 MET 20 -0.883 6.249 13.251
157 H ILE 21 H ILE 21 -6.079 4.285 11.650
158 HA ILE 21 HA ILE 21 -7.528 6.637 10.595
159 HB ILE 21 HB ILE 21 -8.374 3.732 10.436
160 HG12 ILE 21 HG12 ILE 21 -6.295 4.084 9.178
161 HG13 ILE 21 HG13 ILE 21 -7.649 3.801 8.089
162 HG21 ILE 21 HG21 ILE 21 -9.387 6.178 8.987
163 HG22 ILE 21 HG22 ILE 21 -10.235 5.287 10.252
164 HG23 ILE 21 HG23 ILE 21 -9.916 4.519 8.696
165 HD11 ILE 21 HD11 ILE 21 -6.432 6.478 8.742
166 HD12 ILE 21 HD12 ILE 21 -7.790 6.202 7.651
167 HD13 ILE 21 HD13 ILE 21 -6.199 5.558 7.255
168 H ALA 22 H ALA 22 -6.806 5.871 13.415
169 HA ALA 22 HA ALA 22 -9.525 5.698 14.534
170 HB1 ALA 22 HB1 ALA 22 -6.921 4.917 15.833
171 HB2 ALA 22 HB2 ALA 22 -8.087 3.806 15.113
172 HB3 ALA 22 HB3 ALA 22 -8.529 4.748 16.537
173 H GLY 23 H GLY 23 -7.700 8.089 13.703
174 HA2 GLY 23 HA2 GLY 23 -7.980 9.524 16.276
175 HA3 GLY 23 HA3 GLY 23 -6.522 9.679 15.312
176 H ARG 24 H ARG 24 -7.743 9.812 12.778
177 HA ARG 24 HA ARG 24 -9.575 12.052 12.757
178 HB2 ARG 24 HB2 ARG 24 -7.219 12.976 13.148
179 HB3 ARG 24 HB3 ARG 24 -6.832 12.390 11.539
180 HG2 ARG 24 HG2 ARG 24 -7.321 14.670 11.309
181 HG3 ARG 24 HG3 ARG 24 -8.734 13.808 10.694
182 HD2 ARG 24 HD2 ARG 24 -10.039 14.382 12.508
183 HD3 ARG 24 HD3 ARG 24 -8.644 14.630 13.563
184 HE ARG 24 HE ARG 24 -9.675 16.510 11.552
185 HH11 ARG 24 HH11 ARG 24 -7.544 15.764 14.232
186 HH12 ARG 24 HH12 ARG 24 -6.960 17.396 14.403
187 HH21 ARG 24 HH21 ARG 24 -8.948 18.670 11.784
188 HH22 ARG 24 HH22 ARG 24 -7.784 19.059 13.019
189 H TRP 25 H TRP 25 -10.936 10.903 11.354
190 HA TRP 25 HA TRP 25 -9.742 10.080 8.815
191 HB2 TRP 25 HB2 TRP 25 -10.664 7.844 8.958
192 HB3 TRP 25 HB3 TRP 25 -9.627 8.152 10.345
193 HD1 TRP 25 HD1 TRP 25 -12.998 6.975 9.437
194 HE1 TRP 25 HE1 TRP 25 -14.483 6.665 11.525
195 HE3 TRP 25 HE3 TRP 25 -10.056 9.352 12.863
196 HZ2 TRP 25 HZ2 TRP 25 -14.396 7.336 14.258
197 HZ3 TRP 25 HZ3 TRP 25 -10.828 9.473 15.195
198 HH2 TRP 25 HH2 TRP 25 -12.953 8.487 15.873
199 H LYS 26 H LYS 26 -12.807 10.258 10.632
200 HA LYS 26 HA LYS 26 -14.848 11.063 10.100
201 HB2 LYS 26 HB2 LYS 26 -13.455 12.244 7.701
202 HB3 LYS 26 HB3 LYS 26 -15.103 12.613 8.189
203 HG2 LYS 26 HG2 LYS 26 -14.247 13.472 10.334
204 HG3 LYS 26 HG3 LYS 26 -12.603 13.171 9.770
205 HD2 LYS 26 HD2 LYS 26 -14.602 15.005 8.454
206 HD3 LYS 26 HD3 LYS 26 -13.267 15.519 9.482
207 HE2 LYS 26 HE2 LYS 26 -11.690 14.483 7.878
208 HE3 LYS 26 HE3 LYS 26 -13.054 14.094 6.832
209 HZ1 LYS 26 HZ1 LYS 26 -11.958 16.124 6.125
210 HZ2 LYS 26 HZ2 LYS 26 -12.220 16.827 7.647
211 HZ3 LYS 26 HZ3 LYS 26 -13.537 16.459 6.649
212 H HIS 27 H HIS 27 -13.213 9.375 7.463
213 HA HIS 27 HA HIS 27 -15.727 8.078 6.756
214 HB2 HIS 27 HB2 HIS 27 -14.023 9.646 4.817
215 HB3 HIS 27 HB3 HIS 27 -15.119 8.376 4.288
216 HD1 HIS 27 HD1 HIS 27 -17.577 8.952 4.100
217 HD2 HIS 27 HD2 HIS 27 -15.320 11.963 5.883
218 HE1 HIS 27 HE1 HIS 27 -19.104 10.944 4.263
219 HE2 HIS 27 HE2 HIS 27 -17.664 12.797 5.177
220 HA PRO 28 HA PRO 28 -12.210 5.201 7.287
221 HB2 PRO 28 HB2 PRO 28 -14.392 3.320 7.901
222 HB3 PRO 28 HB3 PRO 28 -12.991 3.773 8.877
223 HG2 PRO 28 HG2 PRO 28 -15.456 4.599 9.522
224 HG3 PRO 28 HG3 PRO 28 -14.043 5.634 9.763
225 HD2 PRO 28 HD2 PRO 28 -16.084 5.684 7.575
226 HD3 PRO 28 HD3 PRO 28 -15.369 7.036 8.480
227 H ASN 29 H ASN 29 -15.253 4.586 5.599
228 HA ASN 29 HA ASN 29 -14.406 2.231 4.307
229 HB2 ASN 29 HB2 ASN 29 -16.367 2.465 2.891
230 HB3 ASN 29 HB3 ASN 29 -16.781 2.813 4.565
231 HD21 ASN 29 HD21 ASN 29 -17.924 3.591 1.912
232 HD22 ASN 29 HD22 ASN 29 -18.083 5.316 1.988
233 H ILE 30 H ILE 30 -14.114 5.612 3.452
234 HA ILE 30 HA ILE 30 -13.500 5.312 0.728
235 HB ILE 30 HB ILE 30 -12.544 7.454 2.638
236 HG12 ILE 30 HG12 ILE 30 -14.989 7.285 2.555
237 HG13 ILE 30 HG13 ILE 30 -14.436 8.769 1.790
238 HG21 ILE 30 HG21 ILE 30 -11.194 7.435 0.631
239 HG22 ILE 30 HG22 ILE 30 -12.265 8.837 0.620
240 HG23 ILE 30 HG23 ILE 30 -12.642 7.431 -0.377
241 HD11 ILE 30 HD11 ILE 30 -15.322 6.266 0.376
242 HD12 ILE 30 HD12 ILE 30 -14.737 7.733 -0.409
243 HD13 ILE 30 HD13 ILE 30 -16.234 7.766 0.524
244 H VAL 31 H VAL 31 -11.316 5.678 3.525
245 HA VAL 31 HA VAL 31 -8.981 5.194 1.971
246 HB VAL 31 HB VAL 31 -8.829 6.518 4.002
247 HG11 VAL 31 HG11 VAL 31 -9.505 3.990 5.496
248 HG12 VAL 31 HG12 VAL 31 -10.548 5.398 5.313
249 HG13 VAL 31 HG13 VAL 31 -9.040 5.531 6.217
250 HG21 VAL 31 HG21 VAL 31 -6.876 5.443 5.040
251 HG22 VAL 31 HG22 VAL 31 -6.819 5.373 3.279
252 HG23 VAL 31 HG23 VAL 31 -7.270 3.941 4.203
253 H ARG 32 H ARG 32 -11.162 3.159 3.820
254 HA ARG 32 HA ARG 32 -9.551 0.842 3.900
255 HB2 ARG 32 HB2 ARG 32 -11.554 1.066 5.288
256 HB3 ARG 32 HB3 ARG 32 -12.567 1.083 3.850
257 HG2 ARG 32 HG2 ARG 32 -12.677 -1.088 4.841
258 HG3 ARG 32 HG3 ARG 32 -11.781 -1.204 3.326
259 HD2 ARG 32 HD2 ARG 32 -9.673 -0.981 4.737
260 HD3 ARG 32 HD3 ARG 32 -10.710 -1.264 6.137
261 HE ARG 32 HE ARG 32 -10.194 -3.180 3.955
262 HH11 ARG 32 HH11 ARG 32 -11.322 -2.501 7.211
263 HH12 ARG 32 HH12 ARG 32 -11.507 -4.180 7.618
264 HH21 ARG 32 HH21 ARG 32 -10.424 -5.356 4.491
265 HH22 ARG 32 HH22 ARG 32 -10.975 -5.808 6.082
266 H SER 33 H SER 33 -11.809 2.091 1.485
267 HA SER 33 HA SER 33 -11.797 -0.152 -0.216
268 HB2 SER 33 HB2 SER 33 -12.184 2.770 -0.908
269 HB3 SER 33 HB3 SER 33 -12.597 1.410 -1.953
270 HG SER 33 HG SER 33 -13.750 2.132 0.536
271 H ARG 34 H ARG 34 -9.599 2.553 0.145
272 HA ARG 34 HA ARG 34 -8.034 2.033 -2.156
273 HB2 ARG 34 HB2 ARG 34 -7.723 3.648 0.315
274 HB3 ARG 34 HB3 ARG 34 -6.240 3.195 -0.513
275 HG2 ARG 34 HG2 ARG 34 -7.208 5.426 -1.140
276 HG3 ARG 34 HG3 ARG 34 -6.882 4.330 -2.485
277 HD2 ARG 34 HD2 ARG 34 -9.225 3.718 -2.586
278 HD3 ARG 34 HD3 ARG 34 -9.575 4.727 -1.185
279 HE ARG 34 HE ARG 34 -9.331 6.639 -2.513
280 HH11 ARG 34 HH11 ARG 34 -8.566 3.767 -4.374
281 HH12 ARG 34 HH12 ARG 34 -8.984 4.498 -5.898
282 HH21 ARG 34 HH21 ARG 34 -9.833 7.604 -4.504
283 HH22 ARG 34 HH22 ARG 34 -9.689 6.688 -5.969
284 H ILE 35 H ILE 35 -7.944 0.832 1.155
285 HA ILE 35 HA ILE 35 -5.535 -0.646 0.841
286 HB ILE 35 HB ILE 35 -7.802 -1.090 2.795
287 HG12 ILE 35 HG12 ILE 35 -5.204 0.441 3.054
288 HG13 ILE 35 HG13 ILE 35 -6.818 1.142 2.988
289 HG21 ILE 35 HG21 ILE 35 -6.404 -3.072 2.564
290 HG22 ILE 35 HG22 ILE 35 -6.143 -2.305 4.130
291 HG23 ILE 35 HG23 ILE 35 -4.959 -2.099 2.840
292 HD11 ILE 35 HD11 ILE 35 -7.375 0.081 5.100
293 HD12 ILE 35 HD12 ILE 35 -5.941 1.096 5.255
294 HD13 ILE 35 HD13 ILE 35 -5.775 -0.659 5.160
295 H GLU 36 H GLU 36 -8.968 -1.498 0.580
296 HA GLU 36 HA GLU 36 -8.555 -4.260 0.159
297 HB2 GLU 36 HB2 GLU 36 -10.894 -2.474 -0.500
298 HB3 GLU 36 HB3 GLU 36 -10.920 -4.219 -0.702
299 HG2 GLU 36 HG2 GLU 36 -10.523 -2.728 1.882
300 HG3 GLU 36 HG3 GLU 36 -11.981 -3.581 1.376
301 H LYS 37 H LYS 37 -8.555 -1.544 -2.043
302 HA LYS 37 HA LYS 37 -8.512 -3.399 -4.335
303 HB2 LYS 37 HB2 LYS 37 -10.306 -1.723 -4.301
304 HB3 LYS 37 HB3 LYS 37 -9.080 -0.456 -4.330
305 HG2 LYS 37 HG2 LYS 37 -8.288 -1.985 -6.405
306 HG3 LYS 37 HG3 LYS 37 -10.040 -2.202 -6.468
307 HD2 LYS 37 HD2 LYS 37 -10.415 -0.053 -7.023
308 HD3 LYS 37 HD3 LYS 37 -9.062 0.546 -6.055
309 HE2 LYS 37 HE2 LYS 37 -8.756 -0.968 -8.629
310 HE3 LYS 37 HE3 LYS 37 -8.768 0.777 -8.498
311 HZ1 LYS 37 HZ1 LYS 37 -6.834 -1.016 -7.166
312 HZ2 LYS 37 HZ2 LYS 37 -6.836 0.681 -7.070
313 HZ3 LYS 37 HZ3 LYS 37 -6.518 -0.093 -8.549
314 H ASP 38 H ASP 38 -7.062 -0.306 -3.357
315 HA ASP 38 HA ASP 38 -5.144 -0.482 -5.480
316 HB2 ASP 38 HB2 ASP 38 -5.283 1.520 -3.219
317 HB3 ASP 38 HB3 ASP 38 -4.412 1.703 -4.740
318 H ILE 39 H ILE 39 -4.967 -0.644 -1.932
319 HA ILE 39 HA ILE 39 -2.134 -1.052 -1.923
320 HB ILE 39 HB ILE 39 -4.206 -1.435 0.241
321 HG12 ILE 39 HG12 ILE 39 -2.156 0.732 -0.272
322 HG13 ILE 39 HG13 ILE 39 -3.896 0.881 -0.485
323 HG21 ILE 39 HG21 ILE 39 -1.199 -1.516 0.491
324 HG22 ILE 39 HG22 ILE 39 -2.287 -2.894 0.657
325 HG23 ILE 39 HG23 ILE 39 -2.355 -1.574 1.823
326 HD11 ILE 39 HD11 ILE 39 -4.209 0.574 1.918
327 HD12 ILE 39 HD12 ILE 39 -3.172 1.955 1.556
328 HD13 ILE 39 HD13 ILE 39 -2.462 0.442 2.121
329 H LYS 40 H LYS 40 -4.962 -3.161 -1.818
330 HA LYS 40 HA LYS 40 -3.137 -5.467 -2.030
331 HB2 LYS 40 HB2 LYS 40 -5.940 -5.434 -0.898
332 HB3 LYS 40 HB3 LYS 40 -4.904 -6.847 -1.030
333 HG2 LYS 40 HG2 LYS 40 -3.338 -5.860 0.556
334 HG3 LYS 40 HG3 LYS 40 -4.352 -4.420 0.670
335 HD2 LYS 40 HD2 LYS 40 -5.214 -7.218 1.402
336 HD3 LYS 40 HD3 LYS 40 -4.705 -5.978 2.550
337 HE2 LYS 40 HE2 LYS 40 -6.564 -4.571 1.910
338 HE3 LYS 40 HE3 LYS 40 -7.033 -5.710 0.651
339 HZ1 LYS 40 HZ1 LYS 40 -8.400 -5.911 2.659
340 HZ2 LYS 40 HZ2 LYS 40 -7.020 -6.314 3.565
341 HZ3 LYS 40 HZ3 LYS 40 -7.546 -7.342 2.323
342 HA PRO 41 HA PRO 41 -5.630 -5.318 -5.933
343 HB2 PRO 41 HB2 PRO 41 -3.566 -5.556 -7.662
344 HB3 PRO 41 HB3 PRO 41 -4.082 -3.997 -7.011
345 HG2 PRO 41 HG2 PRO 41 -1.778 -5.718 -6.215
346 HG3 PRO 41 HG3 PRO 41 -1.871 -3.953 -6.338
347 HD2 PRO 41 HD2 PRO 41 -2.044 -5.356 -3.977
348 HD3 PRO 41 HD3 PRO 41 -2.724 -3.738 -4.227
349 H ALA 42 H ALA 42 -2.720 -7.296 -5.383
350 HA ALA 42 HA ALA 42 -4.156 -9.756 -5.545
351 HB1 ALA 42 HB1 ALA 42 -3.079 -10.641 -7.560
352 HB2 ALA 42 HB2 ALA 42 -2.309 -9.079 -7.839
353 HB3 ALA 42 HB3 ALA 42 -4.064 -9.228 -7.941
354 H ILE 43 H ILE 43 -2.446 -8.451 -3.716
355 HA ILE 43 HA ILE 43 -0.221 -10.353 -3.585
356 HB ILE 43 HB ILE 43 1.290 -8.482 -2.814
357 HG12 ILE 43 HG12 ILE 43 -0.760 -6.736 -4.185
358 HG13 ILE 43 HG13 ILE 43 -0.579 -6.858 -2.440
359 HG21 ILE 43 HG21 ILE 43 0.344 -8.413 -5.674
360 HG22 ILE 43 HG22 ILE 43 1.548 -9.510 -5.000
361 HG23 ILE 43 HG23 ILE 43 1.882 -7.779 -5.087
362 HD11 ILE 43 HD11 ILE 43 0.504 -4.869 -3.336
363 HD12 ILE 43 HD12 ILE 43 1.527 -5.885 -4.353
364 HD13 ILE 43 HD13 ILE 43 1.674 -5.963 -2.597
365 H GLY 44 H GLY 44 -2.866 -9.451 -2.157
366 HA2 GLY 44 HA2 GLY 44 -2.351 -8.362 0.328
367 HA3 GLY 44 HA3 GLY 44 -3.679 -9.456 -0.016
368 H SER 45 H SER 45 -2.435 -11.839 -0.471
369 HA SER 45 HA SER 45 -1.351 -12.373 2.207
370 HB2 SER 45 HB2 SER 45 -3.476 -13.528 1.394
371 HB3 SER 45 HB3 SER 45 -2.451 -14.415 0.270
372 HG SER 45 HG SER 45 -1.847 -15.661 1.844
373 H LEU 46 H LEU 46 0.210 -11.334 -0.043
374 HA LEU 46 HA LEU 46 1.947 -13.620 -0.668
375 HB2 LEU 46 HB2 LEU 46 1.020 -12.157 -2.510
376 HB3 LEU 46 HB3 LEU 46 2.005 -10.853 -1.876
377 HG LEU 46 HG LEU 46 4.037 -12.148 -2.347
378 HD11 LEU 46 HD11 LEU 46 2.155 -14.166 -3.570
379 HD12 LEU 46 HD12 LEU 46 3.089 -14.394 -2.091
380 HD13 LEU 46 HD13 LEU 46 3.918 -14.209 -3.637
381 HD21 LEU 46 HD21 LEU 46 3.918 -12.015 -4.794
382 HD22 LEU 46 HD22 LEU 46 3.187 -10.607 -4.022
383 HD23 LEU 46 HD23 LEU 46 2.163 -11.876 -4.694
384 H LYS 47 H LYS 47 2.001 -12.686 1.915
385 HA LYS 47 HA LYS 47 3.362 -12.041 3.605
386 HB2 LYS 47 HB2 LYS 47 4.833 -13.604 2.191
387 HB3 LYS 47 HB3 LYS 47 5.642 -12.138 1.654
388 HG2 LYS 47 HG2 LYS 47 6.973 -12.763 3.397
389 HG3 LYS 47 HG3 LYS 47 5.854 -11.667 4.211
390 HD2 LYS 47 HD2 LYS 47 6.099 -13.642 5.550
391 HD3 LYS 47 HD3 LYS 47 4.482 -13.637 4.845
392 HE2 LYS 47 HE2 LYS 47 5.615 -15.846 4.751
393 HE3 LYS 47 HE3 LYS 47 5.123 -15.225 3.180
394 HZ1 LYS 47 HZ1 LYS 47 7.442 -16.213 3.357
395 HZ2 LYS 47 HZ2 LYS 47 7.875 -14.813 4.210
396 HZ3 LYS 47 HZ3 LYS 47 7.311 -14.698 2.612
397 H VAL 48 H VAL 48 4.892 -10.357 4.414
398 HA VAL 48 HA VAL 48 4.622 -7.827 3.032
399 HB VAL 48 HB VAL 48 6.154 -8.501 5.556
400 HG11 VAL 48 HG11 VAL 48 6.208 -6.087 5.940
401 HG12 VAL 48 HG12 VAL 48 5.430 -5.818 4.380
402 HG13 VAL 48 HG13 VAL 48 7.048 -6.517 4.449
403 HG21 VAL 48 HG21 VAL 48 3.459 -7.202 5.177
404 HG22 VAL 48 HG22 VAL 48 4.292 -7.422 6.715
405 HG23 VAL 48 HG23 VAL 48 3.752 -8.827 5.797
406 H GLU 49 H GLU 49 6.998 -10.336 3.410
407 HA GLU 49 HA GLU 49 9.176 -8.693 2.418
408 HB2 GLU 49 HB2 GLU 49 10.589 -10.575 2.853
409 HB3 GLU 49 HB3 GLU 49 9.475 -10.444 4.208
410 HG2 GLU 49 HG2 GLU 49 8.069 -12.186 3.136
411 HG3 GLU 49 HG3 GLU 49 9.321 -12.378 1.913
412 H ASP 50 H ASP 50 6.843 -10.922 1.207
413 HA ASP 50 HA ASP 50 8.409 -11.609 -1.132
414 HB2 ASP 50 HB2 ASP 50 5.758 -12.517 -0.057
415 HB3 ASP 50 HB3 ASP 50 6.221 -12.886 -1.712
416 H VAL 51 H VAL 51 6.183 -9.200 -0.241
417 HA VAL 51 HA VAL 51 5.283 -8.705 -2.929
418 HB VAL 51 HB VAL 51 4.435 -6.512 -2.011
419 HG11 VAL 51 HG11 VAL 51 2.592 -7.568 -0.776
420 HG12 VAL 51 HG12 VAL 51 3.528 -9.060 -0.674
421 HG13 VAL 51 HG13 VAL 51 3.001 -8.452 -2.244
422 HG21 VAL 51 HG21 VAL 51 5.963 -6.280 -0.120
423 HG22 VAL 51 HG22 VAL 51 5.273 -7.725 0.623
424 HG23 VAL 51 HG23 VAL 51 4.283 -6.279 0.418
425 H LYS 52 H LYS 52 7.203 -8.647 -4.025
426 HA LYS 52 HA LYS 52 9.343 -6.900 -3.413
427 HB2 LYS 52 HB2 LYS 52 8.621 -8.293 -5.993
428 HB3 LYS 52 HB3 LYS 52 10.175 -7.547 -5.645
429 HG2 LYS 52 HG2 LYS 52 10.560 -9.102 -3.841
430 HG3 LYS 52 HG3 LYS 52 8.969 -9.813 -4.077
431 HD2 LYS 52 HD2 LYS 52 9.616 -10.619 -6.266
432 HD3 LYS 52 HD3 LYS 52 11.185 -9.819 -6.123
433 HE2 LYS 52 HE2 LYS 52 11.804 -11.238 -4.288
434 HE3 LYS 52 HE3 LYS 52 10.190 -11.944 -4.231
435 HZ1 LYS 52 HZ1 LYS 52 12.055 -12.193 -6.533
436 HZ2 LYS 52 HZ2 LYS 52 10.561 -12.974 -6.343
437 HZ3 LYS 52 HZ3 LYS 52 11.853 -13.365 -5.322
438 HA PRO 53 HA PRO 53 8.522 -2.855 -4.679
439 HB2 PRO 53 HB2 PRO 53 10.522 -3.282 -6.867
440 HB3 PRO 53 HB3 PRO 53 10.353 -1.921 -5.751
441 HG2 PRO 53 HG2 PRO 53 12.187 -3.795 -5.323
442 HG3 PRO 53 HG3 PRO 53 11.276 -3.089 -3.975
443 HD2 PRO 53 HD2 PRO 53 11.057 -5.781 -5.200
444 HD3 PRO 53 HD3 PRO 53 10.683 -5.256 -3.547
445 H ARG 54 H ARG 54 8.891 -4.938 -7.588
446 HA ARG 54 HA ARG 54 7.510 -3.169 -9.286
447 HB2 ARG 54 HB2 ARG 54 7.415 -4.927 -10.904
448 HB3 ARG 54 HB3 ARG 54 8.966 -5.025 -10.083
449 HG2 ARG 54 HG2 ARG 54 8.469 -7.008 -9.079
450 HG3 ARG 54 HG3 ARG 54 6.733 -6.679 -9.041
451 HD2 ARG 54 HD2 ARG 54 8.323 -7.317 -11.525
452 HD3 ARG 54 HD3 ARG 54 7.343 -8.477 -10.626
453 HE ARG 54 HE ARG 54 5.544 -6.560 -11.158
454 HH11 ARG 54 HH11 ARG 54 7.889 -8.158 -13.236
455 HH12 ARG 54 HH12 ARG 54 6.900 -8.001 -14.666
456 HH21 ARG 54 HH21 ARG 54 4.272 -6.339 -13.033
457 HH22 ARG 54 HH22 ARG 54 4.867 -6.953 -14.553
458 H HIS 55 H HIS 55 6.308 -5.422 -6.954
459 HA HIS 55 HA HIS 55 3.747 -5.896 -8.097
460 HB2 HIS 55 HB2 HIS 55 4.519 -5.861 -5.168
461 HB3 HIS 55 HB3 HIS 55 3.045 -6.551 -5.830
462 HD1 HIS 55 HD1 HIS 55 5.638 -7.499 -8.089
463 HD2 HIS 55 HD2 HIS 55 4.411 -8.772 -4.342
464 HE1 HIS 55 HE1 HIS 55 6.688 -9.762 -7.779
465 HE2 HIS 55 HE2 HIS 55 5.709 -10.622 -5.617
466 H ILE 56 H ILE 56 5.058 -3.450 -5.961
467 HA ILE 56 HA ILE 56 2.635 -2.028 -5.523
468 HB ILE 56 HB ILE 56 5.478 -0.990 -5.430
469 HG12 ILE 56 HG12 ILE 56 5.188 -2.915 -3.947
470 HG13 ILE 56 HG13 ILE 56 5.355 -1.434 -3.008
471 HG21 ILE 56 HG21 ILE 56 3.852 0.807 -5.519
472 HG22 ILE 56 HG22 ILE 56 4.580 0.717 -3.915
473 HG23 ILE 56 HG23 ILE 56 2.953 0.088 -4.183
474 HD11 ILE 56 HD11 ILE 56 3.648 -2.859 -2.064
475 HD12 ILE 56 HD12 ILE 56 2.787 -2.890 -3.603
476 HD13 ILE 56 HD13 ILE 56 2.919 -1.382 -2.697
477 H ASP 57 H ASP 57 5.250 -1.778 -7.878
478 HA ASP 57 HA ASP 57 4.365 0.512 -9.253
479 HB2 ASP 57 HB2 ASP 57 6.583 -0.266 -9.664
480 HB3 ASP 57 HB3 ASP 57 6.010 -1.863 -10.131
481 H ASP 58 H ASP 58 3.620 -2.897 -9.605
482 HA ASP 58 HA ASP 58 2.253 -2.865 -12.016
483 HB2 ASP 58 HB2 ASP 58 2.039 -4.613 -9.584
484 HB3 ASP 58 HB3 ASP 58 0.937 -4.841 -10.938
485 H VAL 59 H VAL 59 0.965 -2.251 -8.751
486 HA VAL 59 HA VAL 59 -1.685 -1.876 -9.829
487 HB VAL 59 HB VAL 59 -1.473 -2.882 -7.628
488 HG11 VAL 59 HG11 VAL 59 0.523 -1.791 -6.818
489 HG12 VAL 59 HG12 VAL 59 -0.796 -1.552 -5.673
490 HG13 VAL 59 HG13 VAL 59 -0.315 -0.241 -6.750
491 HG21 VAL 59 HG21 VAL 59 -2.814 -0.180 -7.577
492 HG22 VAL 59 HG22 VAL 59 -3.109 -1.487 -6.429
493 HG23 VAL 59 HG23 VAL 59 -3.518 -1.700 -8.131
494 H LEU 60 H LEU 60 0.890 0.226 -8.578
495 HA LEU 60 HA LEU 60 -0.609 2.614 -8.587
496 HB2 LEU 60 HB2 LEU 60 2.358 2.186 -8.936
497 HB3 LEU 60 HB3 LEU 60 1.610 3.756 -8.720
498 HG LEU 60 HG LEU 60 1.679 1.504 -6.715
499 HD11 LEU 60 HD11 LEU 60 2.991 3.086 -5.393
500 HD12 LEU 60 HD12 LEU 60 2.908 4.255 -6.709
501 HD13 LEU 60 HD13 LEU 60 3.770 2.734 -6.935
502 HD21 LEU 60 HD21 LEU 60 0.371 4.211 -6.508
503 HD22 LEU 60 HD22 LEU 60 0.528 3.037 -5.201
504 HD23 LEU 60 HD23 LEU 60 -0.465 2.663 -6.611
505 H LYS 61 H LYS 61 1.246 0.976 -11.092
506 HA LYS 61 HA LYS 61 1.177 2.901 -13.097
507 HB2 LYS 61 HB2 LYS 61 2.398 0.712 -13.048
508 HB3 LYS 61 HB3 LYS 61 0.870 -0.092 -13.366
509 HG2 LYS 61 HG2 LYS 61 0.716 1.122 -15.496
510 HG3 LYS 61 HG3 LYS 61 2.302 1.830 -15.173
511 HD2 LYS 61 HD2 LYS 61 1.598 -1.044 -15.676
512 HD3 LYS 61 HD3 LYS 61 2.750 -0.020 -16.519
513 HE2 LYS 61 HE2 LYS 61 4.131 0.059 -14.473
514 HE3 LYS 61 HE3 LYS 61 3.011 -1.064 -13.714
515 HZ1 LYS 61 HZ1 LYS 61 4.847 -2.298 -14.521
516 HZ2 LYS 61 HZ2 LYS 61 4.759 -1.585 -16.055
517 HZ3 LYS 61 HZ3 LYS 61 3.539 -2.646 -15.542
518 H ALA 62 H ALA 62 -1.077 0.229 -12.483
519 HA ALA 62 HA ALA 62 -2.960 0.878 -14.437
520 HB1 ALA 62 HB1 ALA 62 -4.517 -0.519 -13.205
521 HB2 ALA 62 HB2 ALA 62 -3.475 -0.458 -11.783
522 HB3 ALA 62 HB3 ALA 62 -2.918 -1.265 -13.249
523 H VAL 63 H VAL 63 -2.794 1.939 -11.033
524 HA VAL 63 HA VAL 63 -5.317 3.277 -11.186
525 HB VAL 63 HB VAL 63 -4.859 4.159 -8.973
526 HG11 VAL 63 HG11 VAL 63 -5.694 1.887 -9.169
527 HG12 VAL 63 HG12 VAL 63 -4.633 2.051 -7.769
528 HG13 VAL 63 HG13 VAL 63 -4.042 1.275 -9.238
529 HG21 VAL 63 HG21 VAL 63 -2.777 3.649 -7.790
530 HG22 VAL 63 HG22 VAL 63 -2.501 4.689 -9.188
531 HG23 VAL 63 HG23 VAL 63 -2.107 2.972 -9.273
532 H MET 64 H MET 64 -2.061 4.237 -11.925
533 HA MET 64 HA MET 64 -2.623 7.051 -11.770
534 HB2 MET 64 HB2 MET 64 -0.445 7.423 -12.688
535 HB3 MET 64 HB3 MET 64 -0.310 6.099 -11.548
536 HG2 MET 64 HG2 MET 64 -0.231 4.507 -13.340
537 HG3 MET 64 HG3 MET 64 -0.524 5.776 -14.526
538 HE1 MET 64 HE1 MET 64 1.976 4.280 -11.918
539 HE2 MET 64 HE2 MET 64 1.837 5.939 -11.336
540 HE3 MET 64 HE3 MET 64 3.353 5.375 -12.040
541 H LYS 65 H LYS 65 -3.282 4.584 -14.018
542 HA LYS 65 HA LYS 65 -3.620 6.423 -16.264
543 HB2 LYS 65 HB2 LYS 65 -4.483 3.547 -16.155
544 HB3 LYS 65 HB3 LYS 65 -4.157 4.523 -17.574
545 HG2 LYS 65 HG2 LYS 65 -1.808 4.473 -17.132
546 HG3 LYS 65 HG3 LYS 65 -2.083 3.638 -15.596
547 HD2 LYS 65 HD2 LYS 65 -1.474 1.997 -17.207
548 HD3 LYS 65 HD3 LYS 65 -3.185 1.808 -16.878
549 HE2 LYS 65 HE2 LYS 65 -3.725 3.070 -18.892
550 HE3 LYS 65 HE3 LYS 65 -2.011 3.272 -19.232
551 HZ1 LYS 65 HZ1 LYS 65 -2.997 1.489 -20.536
552 HZ2 LYS 65 HZ2 LYS 65 -3.448 0.675 -19.121
553 HZ3 LYS 65 HZ3 LYS 65 -1.805 0.888 -19.490
554 H ARG 66 H ARG 66 -5.636 3.815 -15.081
555 HA ARG 66 HA ARG 66 -8.053 4.898 -15.994
556 HB2 ARG 66 HB2 ARG 66 -9.166 3.165 -14.709
557 HB3 ARG 66 HB3 ARG 66 -7.740 2.517 -15.502
558 HG2 ARG 66 HG2 ARG 66 -6.503 2.676 -13.388
559 HG3 ARG 66 HG3 ARG 66 -7.955 3.291 -12.599
560 HD2 ARG 66 HD2 ARG 66 -7.708 0.605 -13.947
561 HD3 ARG 66 HD3 ARG 66 -7.602 0.886 -12.210
562 HE ARG 66 HE ARG 66 -10.019 1.970 -13.135
563 HH11 ARG 66 HH11 ARG 66 -8.487 -1.149 -12.733
564 HH12 ARG 66 HH12 ARG 66 -9.977 -2.004 -12.478
565 HH21 ARG 66 HH21 ARG 66 -11.987 0.869 -12.819
566 HH22 ARG 66 HH22 ARG 66 -11.990 -0.851 -12.539
567 H GLY 67 H GLY 67 -6.359 5.488 -13.030
568 HA2 GLY 67 HA2 GLY 67 -8.696 6.953 -11.997
569 HA3 GLY 67 HA3 GLY 67 -7.334 6.412 -11.024
570 H ALA 68 H ALA 68 -5.562 7.661 -10.834
571 HA ALA 68 HA ALA 68 -4.967 9.874 -12.516
572 HB1 ALA 68 HB1 ALA 68 -5.382 11.674 -10.916
573 HB2 ALA 68 HB2 ALA 68 -6.098 10.523 -9.788
574 HB3 ALA 68 HB3 ALA 68 -6.884 10.852 -11.333
575 HA PRO 69 HA PRO 69 -0.976 9.099 -10.750
576 HB2 PRO 69 HB2 PRO 69 -0.011 11.713 -10.846
577 HB3 PRO 69 HB3 PRO 69 0.086 10.530 -12.152
578 HG2 PRO 69 HG2 PRO 69 -1.853 12.753 -11.744
579 HG3 PRO 69 HG3 PRO 69 -1.150 12.133 -13.249
580 HD2 PRO 69 HD2 PRO 69 -3.676 11.555 -12.532
581 HD3 PRO 69 HD3 PRO 69 -2.652 10.373 -13.377
582 H SER 70 H SER 70 -2.914 11.797 -9.565
583 HA SER 70 HA SER 70 -1.542 12.297 -7.175
584 HB2 SER 70 HB2 SER 70 -3.777 13.231 -6.415
585 HB3 SER 70 HB3 SER 70 -3.164 13.886 -7.935
586 HG SER 70 HG SER 70 -5.449 12.510 -7.449
587 H ILE 71 H ILE 71 -4.060 9.964 -7.988
588 HA ILE 71 HA ILE 71 -4.534 9.045 -5.347
589 HB ILE 71 HB ILE 71 -4.916 7.554 -7.953
590 HG12 ILE 71 HG12 ILE 71 -6.871 9.228 -6.358
591 HG13 ILE 71 HG13 ILE 71 -6.132 9.701 -7.884
592 HG21 ILE 71 HG21 ILE 71 -4.921 6.058 -6.034
593 HG22 ILE 71 HG22 ILE 71 -6.548 6.213 -6.697
594 HG23 ILE 71 HG23 ILE 71 -6.111 7.075 -5.223
595 HD11 ILE 71 HD11 ILE 71 -8.401 8.927 -8.218
596 HD12 ILE 71 HD12 ILE 71 -8.003 7.383 -7.465
597 HD13 ILE 71 HD13 ILE 71 -7.253 7.835 -8.996
598 H ALA 72 H ALA 72 -2.357 8.039 -7.931
599 HA ALA 72 HA ALA 72 -1.315 5.730 -6.726
600 HB1 ALA 72 HB1 ALA 72 -0.987 6.258 -9.088
601 HB2 ALA 72 HB2 ALA 72 0.553 5.970 -8.281
602 HB3 ALA 72 HB3 ALA 72 0.045 7.618 -8.650
603 H ASN 73 H ASN 73 -0.285 9.126 -6.532
604 HA ASN 73 HA ASN 73 2.022 8.550 -4.923
605 HB2 ASN 73 HB2 ASN 73 0.571 11.126 -5.545
606 HB3 ASN 73 HB3 ASN 73 1.991 11.057 -4.511
607 HD21 ASN 73 HD21 ASN 73 1.477 9.105 -7.388
608 HD22 ASN 73 HD22 ASN 73 2.737 9.826 -8.313
609 H ASP 74 H ASP 74 -1.241 9.662 -4.322
610 HA ASP 74 HA ASP 74 -0.949 10.291 -1.594
611 HB2 ASP 74 HB2 ASP 74 -2.847 11.006 -3.055
612 HB3 ASP 74 HB3 ASP 74 -3.469 9.361 -2.980
613 H THR 75 H THR 75 -2.009 7.305 -3.192
614 HA THR 75 HA THR 75 -2.462 5.860 -0.793
615 HB THR 75 HB THR 75 -1.758 4.717 -3.504
616 HG1 THR 75 HG1 THR 75 -3.532 5.848 -3.979
617 HG21 THR 75 HG21 THR 75 -3.358 3.582 -1.205
618 HG22 THR 75 HG22 THR 75 -1.733 3.084 -1.675
619 HG23 THR 75 HG23 THR 75 -3.092 2.799 -2.763
620 H LEU 76 H LEU 76 0.342 6.422 -2.808
621 HA LEU 76 HA LEU 76 2.069 4.452 -1.791
622 HB2 LEU 76 HB2 LEU 76 2.371 5.920 -3.841
623 HB3 LEU 76 HB3 LEU 76 2.850 7.203 -2.753
624 HG LEU 76 HG LEU 76 4.709 5.962 -3.907
625 HD11 LEU 76 HD11 LEU 76 5.154 7.337 -1.973
626 HD12 LEU 76 HD12 LEU 76 6.153 5.884 -1.933
627 HD13 LEU 76 HD13 LEU 76 4.729 6.003 -0.899
628 HD21 LEU 76 HD21 LEU 76 3.824 3.717 -3.749
629 HD22 LEU 76 HD22 LEU 76 3.901 3.786 -1.988
630 HD23 LEU 76 HD23 LEU 76 5.387 3.811 -2.939
631 H ARG 77 H ARG 77 1.340 7.730 -0.763
632 HA ARG 77 HA ARG 77 3.126 8.213 1.250
633 HB2 ARG 77 HB2 ARG 77 0.156 8.759 1.293
634 HB3 ARG 77 HB3 ARG 77 1.317 9.478 2.396
635 HG2 ARG 77 HG2 ARG 77 2.386 10.648 0.593
636 HG3 ARG 77 HG3 ARG 77 1.368 9.826 -0.593
637 HD2 ARG 77 HD2 ARG 77 -0.595 10.905 0.249
638 HD3 ARG 77 HD3 ARG 77 0.296 11.576 1.613
639 HE ARG 77 HE ARG 77 1.347 12.417 -0.919
640 HH11 ARG 77 HH11 ARG 77 -1.213 13.015 1.399
641 HH12 ARG 77 HH12 ARG 77 -1.324 14.711 1.022
642 HH21 ARG 77 HH21 ARG 77 1.177 14.632 -1.436
643 HH22 ARG 77 HH22 ARG 77 0.027 15.624 -0.592
644 H TRP 78 H TRP 78 0.167 6.283 1.490
645 HA TRP 78 HA TRP 78 0.535 5.692 4.260
646 HB2 TRP 78 HB2 TRP 78 -1.269 4.369 2.219
647 HB3 TRP 78 HB3 TRP 78 -1.369 4.168 3.966
648 HD1 TRP 78 HD1 TRP 78 -2.694 6.258 1.211
649 HE1 TRP 78 HE1 TRP 78 -4.019 8.262 2.152
650 HE3 TRP 78 HE3 TRP 78 -1.245 5.956 6.108
651 HZ2 TRP 78 HZ2 TRP 78 -4.394 9.536 4.644
652 HZ3 TRP 78 HZ3 TRP 78 -2.129 7.607 7.705
653 HH2 TRP 78 HH2 TRP 78 -3.671 9.359 6.986
654 H LEU 79 H LEU 79 1.186 4.013 1.226
655 HA LEU 79 HA LEU 79 1.915 1.515 2.249
656 HB2 LEU 79 HB2 LEU 79 3.024 2.953 -0.163
657 HB3 LEU 79 HB3 LEU 79 3.201 1.241 0.163
658 HG LEU 79 HG LEU 79 0.568 2.637 -0.317
659 HD11 LEU 79 HD11 LEU 79 0.575 1.489 -2.468
660 HD12 LEU 79 HD12 LEU 79 2.187 0.857 -2.133
661 HD13 LEU 79 HD13 LEU 79 1.942 2.593 -2.332
662 HD21 LEU 79 HD21 LEU 79 -0.323 0.364 -0.489
663 HD22 LEU 79 HD22 LEU 79 0.350 0.683 1.110
664 HD23 LEU 79 HD23 LEU 79 1.256 -0.284 -0.054
665 H LYS 80 H LYS 80 3.852 4.408 1.667
666 HA LYS 80 HA LYS 80 6.390 3.586 2.249
667 HB2 LYS 80 HB2 LYS 80 5.711 5.846 1.519
668 HB3 LYS 80 HB3 LYS 80 5.043 6.148 3.116
669 HG2 LYS 80 HG2 LYS 80 7.121 7.211 3.094
670 HG3 LYS 80 HG3 LYS 80 7.369 5.724 4.013
671 HD2 LYS 80 HD2 LYS 80 9.187 6.106 2.444
672 HD3 LYS 80 HD3 LYS 80 8.294 4.649 2.021
673 HE2 LYS 80 HE2 LYS 80 7.214 5.708 0.223
674 HE3 LYS 80 HE3 LYS 80 7.671 7.310 0.793
675 HZ1 LYS 80 HZ1 LYS 80 9.559 5.259 -0.239
676 HZ2 LYS 80 HZ2 LYS 80 9.959 6.841 0.228
677 HZ3 LYS 80 HZ3 LYS 80 8.979 6.576 -1.127
678 H ARG 81 H ARG 81 4.159 5.035 4.562
679 HA ARG 81 HA ARG 81 5.734 4.524 6.846
680 HB2 ARG 81 HB2 ARG 81 2.765 5.045 6.681
681 HB3 ARG 81 HB3 ARG 81 3.762 5.211 8.119
682 HG2 ARG 81 HG2 ARG 81 4.994 7.023 7.094
683 HG3 ARG 81 HG3 ARG 81 4.076 6.827 5.599
684 HD2 ARG 81 HD2 ARG 81 2.017 7.380 6.792
685 HD3 ARG 81 HD3 ARG 81 2.930 7.560 8.286
686 HE ARG 81 HE ARG 81 3.856 9.238 6.129
687 HH11 ARG 81 HH11 ARG 81 1.641 8.982 8.832
688 HH12 ARG 81 HH12 ARG 81 1.460 10.695 9.005
689 HH21 ARG 81 HH21 ARG 81 3.618 11.480 6.352
690 HH22 ARG 81 HH22 ARG 81 2.580 12.130 7.590
691 H MET 82 H MET 82 3.002 2.796 5.423
692 HA MET 82 HA MET 82 2.523 0.995 7.497
693 HB2 MET 82 HB2 MET 82 0.950 1.300 5.682
694 HB3 MET 82 HB3 MET 82 2.108 0.662 4.526
695 HG2 MET 82 HG2 MET 82 1.467 -1.138 6.751
696 HG3 MET 82 HG3 MET 82 0.119 -0.768 5.677
697 HE1 MET 82 HE1 MET 82 1.491 -1.924 2.206
698 HE2 MET 82 HE2 MET 82 1.502 -0.308 2.913
699 HE3 MET 82 HE3 MET 82 0.079 -1.336 3.084
700 H PHE 83 H PHE 83 4.699 0.665 4.700
701 HA PHE 83 HA PHE 83 5.551 -1.954 5.430
702 HB2 PHE 83 HB2 PHE 83 6.611 0.095 3.507
703 HB3 PHE 83 HB3 PHE 83 7.494 -1.395 3.826
704 HD1 PHE 83 HD2 PHE 83 5.938 -3.566 3.709
705 HD2 PHE 83 HD1 PHE 83 5.208 0.109 1.693
706 HE1 PHE 83 HE2 PHE 83 4.550 -4.752 2.060
707 HE2 PHE 83 HE1 PHE 83 3.821 -1.070 0.038
708 HZ PHE 83 HZ PHE 83 3.492 -3.505 0.220
709 H ASN 84 H ASN 84 6.526 1.229 6.389
710 HA ASN 84 HA ASN 84 9.096 0.585 7.402
711 HB2 ASN 84 HB2 ASN 84 8.367 2.910 7.025
712 HB3 ASN 84 HB3 ASN 84 7.168 2.741 8.304
713 HD21 ASN 84 HD21 ASN 84 7.976 4.300 9.628
714 HD22 ASN 84 HD22 ASN 84 9.495 4.171 10.439
715 H TYR 85 H TYR 85 5.854 0.401 8.704
716 HA TYR 85 HA TYR 85 6.490 -0.184 11.383
717 HB2 TYR 85 HB2 TYR 85 4.246 0.480 10.658
718 HB3 TYR 85 HB3 TYR 85 4.097 -0.990 9.709
719 HD1 TYR 85 HD2 TYR 85 5.394 -0.647 13.185
720 HD2 TYR 85 HD1 TYR 85 2.255 -2.036 10.673
721 HE1 TYR 85 HE2 TYR 85 4.370 -1.792 15.105
722 HE2 TYR 85 HE1 TYR 85 1.224 -3.182 12.585
723 HH TYR 85 HH TYR 85 1.612 -3.940 14.697
724 H ALA 86 H ALA 86 6.282 -2.184 8.501
725 HA ALA 86 HA ALA 86 6.565 -4.683 9.818
726 HB1 ALA 86 HB1 ALA 86 7.106 -5.577 7.629
727 HB2 ALA 86 HB2 ALA 86 7.337 -3.946 6.999
728 HB3 ALA 86 HB3 ALA 86 5.735 -4.474 7.515
729 H ILE 87 H ILE 87 8.819 -2.272 8.623
730 HA ILE 87 HA ILE 87 11.183 -3.815 8.862
731 HB ILE 87 HB ILE 87 10.834 -0.811 8.956
732 HG12 ILE 87 HG12 ILE 87 11.660 -2.630 6.682
733 HG13 ILE 87 HG13 ILE 87 10.056 -1.928 6.868
734 HG21 ILE 87 HG21 ILE 87 13.220 -0.708 8.397
735 HG22 ILE 87 HG22 ILE 87 13.324 -2.463 8.535
736 HG23 ILE 87 HG23 ILE 87 12.951 -1.487 9.956
737 HD11 ILE 87 HD11 ILE 87 11.386 -0.699 5.251
738 HD12 ILE 87 HD12 ILE 87 12.620 -0.399 6.476
739 HD13 ILE 87 HD13 ILE 87 11.013 0.305 6.653
740 H LYS 88 H LYS 88 9.595 -1.504 11.059
741 HA LYS 88 HA LYS 88 11.568 -1.715 13.085
742 HB2 LYS 88 HB2 LYS 88 9.929 -0.601 14.549
743 HB3 LYS 88 HB3 LYS 88 10.130 0.223 13.010
744 HG2 LYS 88 HG2 LYS 88 8.060 -0.757 12.203
745 HG3 LYS 88 HG3 LYS 88 7.865 -1.617 13.732
746 HD2 LYS 88 HD2 LYS 88 8.002 1.382 13.438
747 HD3 LYS 88 HD3 LYS 88 6.514 0.448 13.601
748 HE2 LYS 88 HE2 LYS 88 7.191 -0.329 15.783
749 HE3 LYS 88 HE3 LYS 88 8.754 0.473 15.620
750 HZ1 LYS 88 HZ1 LYS 88 7.337 1.804 16.972
751 HZ2 LYS 88 HZ2 LYS 88 6.092 1.772 15.822
752 HZ3 LYS 88 HZ3 LYS 88 7.534 2.603 15.488
753 H ARG 89 H ARG 89 8.890 -3.705 12.217
754 HA ARG 89 HA ARG 89 9.093 -5.227 14.698
755 HB2 ARG 89 HB2 ARG 89 7.195 -5.148 12.426
756 HB3 ARG 89 HB3 ARG 89 7.399 -6.697 13.236
757 HG2 ARG 89 HG2 ARG 89 6.681 -4.112 14.598
758 HG3 ARG 89 HG3 ARG 89 5.552 -5.394 14.159
759 HD2 ARG 89 HD2 ARG 89 6.688 -6.955 15.611
760 HD3 ARG 89 HD3 ARG 89 7.930 -5.760 15.972
761 HE ARG 89 HE ARG 89 5.476 -4.660 16.714
762 HH11 ARG 89 HH11 ARG 89 7.501 -7.383 17.621
763 HH12 ARG 89 HH12 ARG 89 7.011 -7.349 19.285
764 HH21 ARG 89 HH21 ARG 89 4.840 -4.629 18.912
765 HH22 ARG 89 HH22 ARG 89 5.506 -5.799 20.014
766 H HIS 90 H HIS 90 10.693 -5.001 11.887
767 HA HIS 90 HA HIS 90 12.480 -6.122 11.079
768 HB2 HIS 90 HB2 HIS 90 12.042 -8.029 13.383
769 HB3 HIS 90 HB3 HIS 90 13.479 -7.958 12.367
770 HD1 HIS 90 HD1 HIS 90 12.751 -7.159 15.595
771 HD2 HIS 90 HD2 HIS 90 14.188 -4.835 12.458
772 HE1 HIS 90 HE1 HIS 90 13.870 -5.178 16.671
773 HE2 HIS 90 HE2 HIS 90 14.498 -3.671 14.749
774 H ILE 91 H ILE 91 9.611 -6.829 10.461
775 HA ILE 91 HA ILE 91 9.621 -9.539 9.568
776 HB ILE 91 HB ILE 91 8.006 -7.170 8.586
777 HG12 ILE 91 HG12 ILE 91 7.278 -9.388 10.515
778 HG13 ILE 91 HG13 ILE 91 7.652 -7.728 10.963
779 HG21 ILE 91 HG21 ILE 91 6.494 -8.802 7.596
780 HG22 ILE 91 HG22 ILE 91 7.554 -10.113 8.112
781 HG23 ILE 91 HG23 ILE 91 8.112 -8.945 6.912
782 HD11 ILE 91 HD11 ILE 91 5.700 -6.947 9.741
783 HD12 ILE 91 HD12 ILE 91 5.257 -8.141 10.960
784 HD13 ILE 91 HD13 ILE 91 5.333 -8.603 9.261
785 H ILE 92 H ILE 92 10.495 -6.437 8.206
786 HA ILE 92 HA ILE 92 12.075 -7.806 6.154
787 HB ILE 92 HB ILE 92 11.565 -5.957 4.559
788 HG12 ILE 92 HG12 ILE 92 9.360 -5.305 6.529
789 HG13 ILE 92 HG13 ILE 92 10.772 -4.304 6.204
790 HG21 ILE 92 HG21 ILE 92 9.378 -6.818 3.869
791 HG22 ILE 92 HG22 ILE 92 9.204 -7.610 5.435
792 HG23 ILE 92 HG23 ILE 92 10.481 -8.113 4.329
793 HD11 ILE 92 HD11 ILE 92 10.018 -3.981 3.909
794 HD12 ILE 92 HD12 ILE 92 8.797 -3.459 5.071
795 HD13 ILE 92 HD13 ILE 92 8.610 -4.996 4.226
796 H GLU 93 H GLU 93 13.785 -6.331 5.277
797 HA GLU 93 HA GLU 93 14.828 -4.627 7.436
798 HB2 GLU 93 HB2 GLU 93 16.249 -5.750 5.011
799 HB3 GLU 93 HB3 GLU 93 16.998 -4.894 6.352
800 HG2 GLU 93 HG2 GLU 93 16.471 -6.684 7.861
801 HG3 GLU 93 HG3 GLU 93 15.551 -7.517 6.606
802 H TYR 94 H TYR 94 14.332 -4.762 3.947
803 HA TYR 94 HA TYR 94 14.164 -1.824 3.916
804 HB2 TYR 94 HB2 TYR 94 15.299 -3.594 1.734
805 HB3 TYR 94 HB3 TYR 94 15.090 -1.850 1.627
806 HD1 TYR 94 HD2 TYR 94 16.293 -0.486 3.556
807 HD2 TYR 94 HD1 TYR 94 17.360 -4.420 2.341
808 HE1 TYR 94 HE2 TYR 94 18.538 -0.162 4.505
809 HE2 TYR 94 HE1 TYR 94 19.609 -4.110 3.284
810 HH TYR 94 HH TYR 94 21.136 -2.172 3.814
811 H ASN 95 H ASN 95 12.408 -0.990 2.860
812 HA ASN 95 HA ASN 95 10.330 -2.943 2.287
813 HB2 ASN 95 HB2 ASN 95 8.770 -1.065 2.462
814 HB3 ASN 95 HB3 ASN 95 9.819 -1.137 3.871
815 HD21 ASN 95 HD21 ASN 95 8.294 1.087 2.826
816 HD22 ASN 95 HD22 ASN 95 9.429 2.347 2.508
817 HA PRO 96 HA PRO 96 10.416 -2.509 -2.124
818 HB2 PRO 96 HB2 PRO 96 7.695 -2.671 -2.596
819 HB3 PRO 96 HB3 PRO 96 8.759 -4.066 -2.367
820 HG2 PRO 96 HG2 PRO 96 6.956 -2.704 -0.405
821 HG3 PRO 96 HG3 PRO 96 7.271 -4.436 -0.628
822 HD2 PRO 96 HD2 PRO 96 8.396 -3.060 1.376
823 HD3 PRO 96 HD3 PRO 96 9.278 -4.348 0.531
824 H ALA 97 H ALA 97 8.498 -0.467 -0.082
825 HA ALA 97 HA ALA 97 7.881 1.435 -2.175
826 HB1 ALA 97 HB1 ALA 97 6.256 0.976 -0.399
827 HB2 ALA 97 HB2 ALA 97 6.726 2.675 -0.431
828 HB3 ALA 97 HB3 ALA 97 7.393 1.600 0.797
829 H ALA 98 H ALA 98 10.712 0.802 -1.131
830 HA ALA 98 HA ALA 98 11.640 3.293 -0.063
831 HB1 ALA 98 HB1 ALA 98 12.816 1.183 0.366
832 HB2 ALA 98 HB2 ALA 98 13.871 2.383 -0.380
833 HB3 ALA 98 HB3 ALA 98 13.214 1.064 -1.349
834 H ALA 99 H ALA 99 11.699 1.754 -3.259
835 HA ALA 99 HA ALA 99 13.040 3.963 -4.503
836 HB1 ALA 99 HB1 ALA 99 13.307 1.690 -5.347
837 HB2 ALA 99 HB2 ALA 99 12.641 2.749 -6.592
838 HB3 ALA 99 HB3 ALA 99 11.589 1.623 -5.735
839 H PHE 100 H PHE 100 9.755 3.044 -3.920
840 HA PHE 100 HA PHE 100 8.703 4.990 -5.797
841 HB2 PHE 100 HB2 PHE 100 7.286 3.169 -3.838
842 HB3 PHE 100 HB3 PHE 100 6.495 4.187 -5.040
843 HD1 PHE 100 HD1 PHE 100 6.720 3.681 -7.432
844 HD2 PHE 100 HD2 PHE 100 8.326 1.119 -4.442
845 HE1 PHE 100 HE1 PHE 100 6.939 1.885 -9.096
846 HE2 PHE 100 HE2 PHE 100 8.540 -0.686 -6.098
847 HZ PHE 100 HZ PHE 100 7.848 -0.303 -8.430
848 H ASP 101 H ASP 101 8.499 7.029 -5.279
849 HA ASP 101 HA ASP 101 7.850 7.779 -2.526
850 HB2 ASP 101 HB2 ASP 101 10.348 7.746 -2.775
851 HB3 ASP 101 HB3 ASP 101 10.191 8.976 -4.025
852 HA PRO 102 HA PRO 102 5.244 10.519 -4.819
853 HB2 PRO 102 HB2 PRO 102 4.356 12.077 -2.808
854 HB3 PRO 102 HB3 PRO 102 3.859 10.390 -2.981
855 HG2 PRO 102 HG2 PRO 102 5.955 11.570 -1.196
856 HG3 PRO 102 HG3 PRO 102 4.718 10.356 -0.815
857 HD2 PRO 102 HD2 PRO 102 7.303 9.715 -1.368
858 HD3 PRO 102 HD3 PRO 102 5.941 8.641 -1.747
859 H GLY 103 H GLY 103 8.155 11.483 -3.395
860 HA2 GLY 103 HA2 GLY 103 9.416 13.134 -4.679
861 HA3 GLY 103 HA3 GLY 103 7.941 14.085 -4.773
862 H ASP 104 H ASP 104 7.039 14.800 -2.642
863 HA ASP 104 HA ASP 104 9.053 15.118 -0.557
864 HB2 ASP 104 HB2 ASP 104 9.430 17.106 -1.835
865 HB3 ASP 104 HB3 ASP 104 7.700 17.421 -1.967
866 H ALA 105 H ALA 105 8.183 14.614 1.289
867 HA ALA 105 HA ALA 105 5.429 15.491 1.863
868 HB1 ALA 105 HB1 ALA 105 5.447 13.063 1.506
869 HB2 ALA 105 HB2 ALA 105 5.083 13.461 3.186
870 HB3 ALA 105 HB3 ALA 105 6.691 12.889 2.742
871 H GLY 106 H GLY 106 5.065 15.607 4.301
872 HA2 GLY 106 HA2 GLY 106 7.073 17.273 5.426
873 HA3 GLY 106 HA3 GLY 106 5.633 16.690 6.248
874 H GLY 107 H GLY 107 8.269 16.956 7.358
875 HA2 GLY 107 HA2 GLY 107 8.931 14.111 7.844
876 HA3 GLY 107 HA3 GLY 107 10.128 15.403 7.849
877 H LYS 108 H LYS 108 7.011 15.970 9.173
878 HA LYS 108 HA LYS 108 8.134 16.548 11.755
879 HB2 LYS 108 HB2 LYS 108 5.371 16.759 10.594
880 HB3 LYS 108 HB3 LYS 108 5.685 17.054 12.298
881 HG2 LYS 108 HG2 LYS 108 7.280 18.817 11.666
882 HG3 LYS 108 HG3 LYS 108 6.860 18.552 9.972
883 HD2 LYS 108 HD2 LYS 108 4.874 19.291 12.112
884 HD3 LYS 108 HD3 LYS 108 5.665 20.453 11.053
885 HE2 LYS 108 HE2 LYS 108 4.724 19.221 9.103
886 HE3 LYS 108 HE3 LYS 108 3.836 18.202 10.237
887 HZ1 LYS 108 HZ1 LYS 108 2.427 19.956 9.428
888 HZ2 LYS 108 HZ2 LYS 108 3.541 21.142 9.912
889 HZ3 LYS 108 HZ3 LYS 108 2.734 20.209 11.077
890 H LEU 109 H LEU 109 5.943 15.925 13.365
891 HA LEU 109 HA LEU 109 6.264 12.998 13.570
892 HB2 LEU 109 HB2 LEU 109 5.791 14.950 15.823
893 HB3 LEU 109 HB3 LEU 109 6.127 13.236 15.974
894 HG LEU 109 HG LEU 109 8.058 15.336 14.981
895 HD11 LEU 109 HD11 LEU 109 7.651 15.491 17.365
896 HD12 LEU 109 HD12 LEU 109 9.264 14.845 17.058
897 HD13 LEU 109 HD13 LEU 109 7.960 13.764 17.549
898 HD21 LEU 109 HD21 LEU 109 8.428 13.205 13.868
899 HD22 LEU 109 HD22 LEU 109 8.440 12.377 15.425
900 HD23 LEU 109 HD23 LEU 109 9.715 13.530 15.030
901 H GLU 110 H GLU 110 4.442 11.766 13.844
902 HA GLU 110 HA GLU 110 1.891 12.934 13.416
903 HB2 GLU 110 HB2 GLU 110 1.166 10.528 14.275
904 HB3 GLU 110 HB3 GLU 110 1.836 10.774 12.674
905 HG2 GLU 110 HG2 GLU 110 2.891 8.860 13.544
906 HG3 GLU 110 HG3 GLU 110 4.079 10.157 13.636
907 H HIS 111 H HIS 111 3.595 11.782 16.255
908 HA HIS 111 HA HIS 111 3.418 12.233 18.456
909 HB2 HIS 111 HB2 HIS 111 3.450 14.580 17.622
910 HB3 HIS 111 HB3 HIS 111 1.690 14.567 17.613
911 HD1 HIS 111 HD1 HIS 111 0.954 15.975 19.520
912 HD2 HIS 111 HD2 HIS 111 4.170 13.523 20.519
913 HE1 HIS 111 HE1 HIS 111 1.377 16.362 21.976
914 HE2 HIS 111 HE2 HIS 111 3.355 14.904 22.550
915 H HIS 112 H HIS 112 2.274 10.323 18.860
916 HA HIS 112 HA HIS 112 -0.626 10.615 19.189
917 HB2 HIS 112 HB2 HIS 112 -0.672 8.168 19.540
918 HB3 HIS 112 HB3 HIS 112 0.010 8.617 17.985
919 HD1 HIS 112 HD1 HIS 112 2.494 8.091 17.578
920 HD2 HIS 112 HD2 HIS 112 1.079 6.874 21.299
921 HE1 HIS 112 HE1 HIS 112 4.230 6.513 18.484
922 HE2 HIS 112 HE2 HIS 112 3.221 5.596 20.605
923 H HIS 113 H HIS 113 -1.606 9.716 21.183
924 HA HIS 113 HA HIS 113 -0.103 10.811 23.438
925 HB2 HIS 113 HB2 HIS 113 -2.993 10.490 22.795
926 HB3 HIS 113 HB3 HIS 113 -2.518 10.527 24.490
927 HD1 HIS 113 HD1 HIS 113 -2.268 12.757 25.499
928 HD2 HIS 113 HD2 HIS 113 -2.092 12.904 21.348
929 HE1 HIS 113 HE1 HIS 113 -2.161 15.198 24.912
930 HE2 HIS 113 HE2 HIS 113 -1.827 15.249 22.416
931 H HIS 114 H HIS 114 -1.355 9.722 25.561
932 HA HIS 114 HA HIS 114 0.045 7.289 25.917
933 HB2 HIS 114 HB2 HIS 114 -0.487 8.951 27.711
934 HB3 HIS 114 HB3 HIS 114 -2.172 8.459 27.618
935 HD1 HIS 114 HD1 HIS 114 0.935 7.740 29.335
936 HD2 HIS 114 HD2 HIS 114 -2.545 5.645 28.423
937 HE1 HIS 114 HE1 HIS 114 0.893 5.773 30.903
938 HE2 HIS 114 HE2 HIS 114 -1.283 4.591 30.424
939 H HIS 115 H HIS 115 -0.657 5.805 24.382
940 HA HIS 115 HA HIS 115 -1.878 4.089 23.527
941 HB2 HIS 115 HB2 HIS 115 -1.799 3.415 25.934
942 HB3 HIS 115 HB3 HIS 115 -3.347 4.212 26.173
943 HD1 HIS 115 HD1 HIS 115 -4.507 2.033 26.856
944 HD2 HIS 115 HD2 HIS 115 -2.823 1.901 23.055
945 HE1 HIS 115 HE1 HIS 115 -5.449 -0.028 25.769
946 HE2 HIS 115 HE2 HIS 115 -4.562 0.014 23.410
947 H HIS 116 H HIS 116 -2.755 6.842 23.085
948 HA HIS 116 HA HIS 116 -5.404 6.268 22.064
949 HB2 HIS 116 HB2 HIS 116 -5.800 7.116 24.379
950 HB3 HIS 116 HB3 HIS 116 -4.968 8.603 23.946
951 HD1 HIS 116 HD1 HIS 116 -7.158 9.922 24.495
952 HD2 HIS 116 HD2 HIS 116 -7.510 7.205 21.358
953 HE1 HIS 116 HE1 HIS 116 -9.305 10.512 23.319
954 HE2 HIS 116 HE2 HIS 116 -9.548 8.804 21.481
Start of MODEL 4
1 H1 MET 1 H1 MET 1 -4.572 -15.211 11.306
2 H2 MET 1 H2 MET 1 -4.171 -16.175 12.640
3 H3 MET 1 H3 MET 1 -5.749 -16.201 12.025
4 HA MET 1 HA MET 1 -4.426 -18.163 11.418
5 HB2 MET 1 HB2 MET 1 -6.353 -17.413 10.070
6 HB3 MET 1 HB3 MET 1 -5.282 -16.394 9.119
7 HG2 MET 1 HG2 MET 1 -4.074 -18.395 8.368
8 HG3 MET 1 HG3 MET 1 -5.188 -19.396 9.295
9 HE1 MET 1 HE1 MET 1 -8.582 -18.770 7.455
10 HE2 MET 1 HE2 MET 1 -7.953 -17.898 8.851
11 HE3 MET 1 HE3 MET 1 -7.767 -19.649 8.749
12 H ALA 2 H ALA 2 -3.378 -15.251 9.614
13 HA ALA 2 HA ALA 2 -1.057 -16.624 8.611
14 HB1 ALA 2 HB1 ALA 2 -2.236 -14.978 7.248
15 HB2 ALA 2 HB2 ALA 2 -0.551 -14.516 7.492
16 HB3 ALA 2 HB3 ALA 2 -1.827 -13.718 8.411
17 H GLU 3 H GLU 3 -1.728 -15.115 11.512
18 HA GLU 3 HA GLU 3 0.793 -13.841 11.982
19 HB2 GLU 3 HB2 GLU 3 -1.189 -14.743 14.073
20 HB3 GLU 3 HB3 GLU 3 0.026 -13.485 14.227
21 HG2 GLU 3 HG2 GLU 3 -1.813 -12.201 13.912
22 HG3 GLU 3 HG3 GLU 3 -1.324 -12.418 12.232
23 H LYS 4 H LYS 4 0.859 -16.695 11.182
24 HA LYS 4 HA LYS 4 1.617 -18.246 13.462
25 HB2 LYS 4 HB2 LYS 4 2.349 -19.911 11.792
26 HB3 LYS 4 HB3 LYS 4 0.723 -19.328 11.471
27 HG2 LYS 4 HG2 LYS 4 1.597 -17.834 9.743
28 HG3 LYS 4 HG3 LYS 4 3.227 -18.428 10.061
29 HD2 LYS 4 HD2 LYS 4 2.487 -20.700 9.438
30 HD3 LYS 4 HD3 LYS 4 0.889 -20.052 9.056
31 HE2 LYS 4 HE2 LYS 4 1.879 -18.608 7.349
32 HE3 LYS 4 HE3 LYS 4 3.479 -19.242 7.736
33 HZ1 LYS 4 HZ1 LYS 4 2.711 -21.443 7.055
34 HZ2 LYS 4 HZ2 LYS 4 2.576 -20.321 5.790
35 HZ3 LYS 4 HZ3 LYS 4 1.194 -20.803 6.647
36 H ASN 5 H ASN 5 3.232 -16.182 11.186
37 HA ASN 5 HA ASN 5 5.563 -15.940 12.783
38 HB2 ASN 5 HB2 ASN 5 6.132 -18.124 11.844
39 HB3 ASN 5 HB3 ASN 5 5.840 -17.528 10.215
40 HD21 ASN 5 HD21 ASN 5 7.985 -17.439 12.959
41 HD22 ASN 5 HD22 ASN 5 9.336 -16.754 12.126
42 H ALA 6 H ALA 6 4.974 -15.916 9.277
43 HA ALA 6 HA ALA 6 5.311 -12.993 9.330
44 HB1 ALA 6 HB1 ALA 6 7.269 -14.072 8.323
45 HB2 ALA 6 HB2 ALA 6 6.374 -13.121 7.138
46 HB3 ALA 6 HB3 ALA 6 6.222 -14.877 7.153
47 H TYR 7 H TYR 7 3.378 -12.150 9.012
48 HA TYR 7 HA TYR 7 1.292 -13.596 7.665
49 HB2 TYR 7 HB2 TYR 7 -0.053 -11.514 8.192
50 HB3 TYR 7 HB3 TYR 7 0.595 -12.389 9.573
51 HD1 TYR 7 HD1 TYR 7 0.825 -9.323 7.573
52 HD2 TYR 7 HD2 TYR 7 2.308 -11.410 10.970
53 HE1 TYR 7 HE1 TYR 7 1.855 -7.247 8.394
54 HE2 TYR 7 HE2 TYR 7 3.343 -9.342 11.797
55 HH TYR 7 HH TYR 7 2.598 -6.293 10.558
56 H THR 8 H THR 8 -0.158 -11.656 6.391
57 HA THR 8 HA THR 8 1.521 -11.257 4.016
58 HB THR 8 HB THR 8 -0.602 -11.288 2.741
59 HG1 THR 8 HG1 THR 8 -2.417 -12.245 4.137
60 HG21 THR 8 HG21 THR 8 -1.080 -13.680 3.021
61 HG22 THR 8 HG22 THR 8 -0.212 -13.672 4.555
62 HG23 THR 8 HG23 THR 8 0.656 -13.366 3.051
63 H VAL 9 H VAL 9 1.127 -9.371 2.699
64 HA VAL 9 HA VAL 9 1.128 -6.958 4.071
65 HB VAL 9 HB VAL 9 2.066 -7.199 1.831
66 HG11 VAL 9 HG11 VAL 9 0.436 -8.667 0.823
67 HG12 VAL 9 HG12 VAL 9 0.615 -7.210 -0.155
68 HG13 VAL 9 HG13 VAL 9 -0.790 -7.402 0.896
69 HG21 VAL 9 HG21 VAL 9 -0.112 -5.119 1.936
70 HG22 VAL 9 HG22 VAL 9 1.279 -5.100 0.851
71 HG23 VAL 9 HG23 VAL 9 1.517 -4.959 2.593
72 H ALA 10 H ALA 10 -1.559 -8.794 2.785
73 HA ALA 10 HA ALA 10 -3.517 -6.772 2.815
74 HB1 ALA 10 HB1 ALA 10 -5.146 -8.602 2.847
75 HB2 ALA 10 HB2 ALA 10 -3.850 -9.741 3.207
76 HB3 ALA 10 HB3 ALA 10 -3.865 -8.883 1.668
77 H GLN 11 H GLN 11 -2.374 -9.005 5.307
78 HA GLN 11 HA GLN 11 -4.318 -8.167 7.240
79 HB2 GLN 11 HB2 GLN 11 -3.248 -10.402 7.353
80 HB3 GLN 11 HB3 GLN 11 -1.703 -9.626 7.680
81 HG2 GLN 11 HG2 GLN 11 -2.504 -8.753 9.760
82 HG3 GLN 11 HG3 GLN 11 -4.138 -9.312 9.417
83 HE21 GLN 11 HE21 GLN 11 -4.630 -11.472 9.643
84 HE22 GLN 11 HE22 GLN 11 -3.593 -12.579 10.483
85 H LEU 12 H LEU 12 -1.004 -7.329 6.442
86 HA LEU 12 HA LEU 12 -0.404 -5.735 8.666
87 HB2 LEU 12 HB2 LEU 12 1.271 -6.491 7.052
88 HB3 LEU 12 HB3 LEU 12 0.556 -5.478 5.813
89 HG LEU 12 HG LEU 12 1.200 -3.470 7.064
90 HD11 LEU 12 HD11 LEU 12 2.504 -5.386 8.993
91 HD12 LEU 12 HD12 LEU 12 1.081 -4.401 9.326
92 HD13 LEU 12 HD13 LEU 12 2.638 -3.628 9.023
93 HD21 LEU 12 HD21 LEU 12 3.472 -5.404 6.649
94 HD22 LEU 12 HD22 LEU 12 3.608 -3.647 6.724
95 HD23 LEU 12 HD23 LEU 12 2.721 -4.409 5.404
96 H ALA 13 H ALA 13 -1.982 -4.951 5.604
97 HA ALA 13 HA ALA 13 -2.235 -2.171 6.036
98 HB1 ALA 13 HB1 ALA 13 -3.862 -2.230 4.230
99 HB2 ALA 13 HB2 ALA 13 -3.968 -3.986 4.362
100 HB3 ALA 13 HB3 ALA 13 -2.464 -3.230 3.835
101 H ASP 14 H ASP 14 -4.283 -4.917 6.860
102 HA ASP 14 HA ASP 14 -6.501 -3.355 7.736
103 HB2 ASP 14 HB2 ASP 14 -6.521 -5.808 7.021
104 HB3 ASP 14 HB3 ASP 14 -5.859 -6.174 8.612
105 H GLU 15 H GLU 15 -3.758 -4.887 9.326
106 HA GLU 15 HA GLU 15 -4.358 -4.254 12.004
107 HB2 GLU 15 HB2 GLU 15 -2.561 -5.819 11.154
108 HB3 GLU 15 HB3 GLU 15 -1.615 -4.401 10.726
109 HG2 GLU 15 HG2 GLU 15 -0.719 -4.943 12.752
110 HG3 GLU 15 HG3 GLU 15 -1.945 -3.771 13.230
111 H TYR 16 H TYR 16 -2.743 -2.491 9.443
112 HA TYR 16 HA TYR 16 -1.743 -0.298 10.861
113 HB2 TYR 16 HB2 TYR 16 -1.226 -0.983 8.496
114 HB3 TYR 16 HB3 TYR 16 -2.785 -0.329 8.019
115 HD1 TYR 16 HD2 TYR 16 0.550 0.538 9.340
116 HD2 TYR 16 HD1 TYR 16 -3.071 2.002 7.654
117 HE1 TYR 16 HE2 TYR 16 1.616 2.723 8.967
118 HE2 TYR 16 HE1 TYR 16 -2.016 4.189 7.271
119 HH TYR 16 HH TYR 16 1.305 4.679 7.441
120 H PHE 17 H PHE 17 -4.890 -0.905 9.415
121 HA PHE 17 HA PHE 17 -6.105 1.575 9.574
122 HB2 PHE 17 HB2 PHE 17 -7.057 -0.463 8.507
123 HB3 PHE 17 HB3 PHE 17 -7.372 -1.127 10.101
124 HD1 PHE 17 HD2 PHE 17 -9.083 -0.013 11.568
125 HD2 PHE 17 HD1 PHE 17 -8.532 1.037 7.478
126 HE1 PHE 17 HE2 PHE 17 -11.304 1.042 11.538
127 HE2 PHE 17 HE1 PHE 17 -10.756 2.087 7.443
128 HZ PHE 17 HZ PHE 17 -12.148 2.090 9.475
129 H GLU 18 H GLU 18 -5.853 -0.929 12.049
130 HA GLU 18 HA GLU 18 -7.562 0.246 13.943
131 HB2 GLU 18 HB2 GLU 18 -7.161 -2.066 14.101
132 HB3 GLU 18 HB3 GLU 18 -5.421 -1.860 14.061
133 HG2 GLU 18 HG2 GLU 18 -6.140 -2.558 16.247
134 HG3 GLU 18 HG3 GLU 18 -5.475 -0.932 16.316
135 H ARG 19 H ARG 19 -4.252 0.978 13.170
136 HA ARG 19 HA ARG 19 -3.916 2.262 15.788
137 HB2 ARG 19 HB2 ARG 19 -1.939 1.350 13.726
138 HB3 ARG 19 HB3 ARG 19 -1.479 2.532 14.944
139 HG2 ARG 19 HG2 ARG 19 -0.823 0.363 15.705
140 HG3 ARG 19 HG3 ARG 19 -2.171 0.913 16.700
141 HD2 ARG 19 HD2 ARG 19 -3.685 -0.402 15.195
142 HD3 ARG 19 HD3 ARG 19 -2.244 -1.077 14.443
143 HE ARG 19 HE ARG 19 -2.208 -1.424 17.268
144 HH11 ARG 19 HH11 ARG 19 -3.617 -2.631 14.324
145 HH12 ARG 19 HH12 ARG 19 -3.882 -4.237 14.936
146 HH21 ARG 19 HH21 ARG 19 -2.572 -3.535 18.125
147 HH22 ARG 19 HH22 ARG 19 -3.322 -4.739 17.108
148 H MET 20 H MET 20 -3.728 3.008 12.320
149 HA MET 20 HA MET 20 -3.051 5.772 12.974
150 HB2 MET 20 HB2 MET 20 -3.190 4.325 10.330
151 HB3 MET 20 HB3 MET 20 -2.784 6.025 10.500
152 HG2 MET 20 HG2 MET 20 -1.229 3.848 11.860
153 HG3 MET 20 HG3 MET 20 -0.862 4.407 10.232
154 HE1 MET 20 HE1 MET 20 -0.496 5.029 14.028
155 HE2 MET 20 HE2 MET 20 -1.810 6.159 13.703
156 HE3 MET 20 HE3 MET 20 -0.211 6.764 14.142
157 H ILE 21 H ILE 21 -5.777 3.919 11.916
158 HA ILE 21 HA ILE 21 -7.181 6.371 11.084
159 HB ILE 21 HB ILE 21 -8.028 3.518 10.540
160 HG12 ILE 21 HG12 ILE 21 -6.440 5.411 8.788
161 HG13 ILE 21 HG13 ILE 21 -5.787 3.990 9.596
162 HG21 ILE 21 HG21 ILE 21 -9.377 4.540 8.771
163 HG22 ILE 21 HG22 ILE 21 -8.783 6.135 9.231
164 HG23 ILE 21 HG23 ILE 21 -9.794 5.217 10.346
165 HD11 ILE 21 HD11 ILE 21 -7.244 2.569 8.258
166 HD12 ILE 21 HD12 ILE 21 -6.192 3.564 7.252
167 HD13 ILE 21 HD13 ILE 21 -7.890 3.996 7.449
168 H ALA 22 H ALA 22 -6.699 4.858 13.813
169 HA ALA 22 HA ALA 22 -9.487 4.993 14.721
170 HB1 ALA 22 HB1 ALA 22 -8.322 2.927 15.286
171 HB2 ALA 22 HB2 ALA 22 -8.729 3.840 16.740
172 HB3 ALA 22 HB3 ALA 22 -7.076 3.851 16.127
173 H GLY 23 H GLY 23 -9.169 7.368 14.384
174 HA2 GLY 23 HA2 GLY 23 -9.326 8.892 16.543
175 HA3 GLY 23 HA3 GLY 23 -7.582 8.699 16.436
176 H ARG 24 H ARG 24 -10.325 10.346 15.289
177 HA ARG 24 HA ARG 24 -10.673 12.078 13.886
178 HB2 ARG 24 HB2 ARG 24 -8.307 12.642 15.094
179 HB3 ARG 24 HB3 ARG 24 -7.825 12.664 13.407
180 HG2 ARG 24 HG2 ARG 24 -10.094 14.269 14.554
181 HG3 ARG 24 HG3 ARG 24 -8.465 14.873 14.296
182 HD2 ARG 24 HD2 ARG 24 -8.708 14.374 11.882
183 HD3 ARG 24 HD3 ARG 24 -10.375 13.889 12.190
184 HE ARG 24 HE ARG 24 -9.601 16.573 13.021
185 HH11 ARG 24 HH11 ARG 24 -11.110 14.570 10.586
186 HH12 ARG 24 HH12 ARG 24 -12.122 15.848 9.971
187 HH21 ARG 24 HH21 ARG 24 -10.880 18.277 12.199
188 HH22 ARG 24 HH22 ARG 24 -11.989 17.970 10.885
189 H TRP 25 H TRP 25 -11.362 10.448 12.383
190 HA TRP 25 HA TRP 25 -9.651 10.386 10.006
191 HB2 TRP 25 HB2 TRP 25 -10.298 8.092 9.523
192 HB3 TRP 25 HB3 TRP 25 -9.548 8.182 11.103
193 HD1 TRP 25 HD1 TRP 25 -12.506 6.857 9.376
194 HE1 TRP 25 HE1 TRP 25 -14.228 5.939 11.064
195 HE3 TRP 25 HE3 TRP 25 -10.570 8.832 13.671
196 HZ2 TRP 25 HZ2 TRP 25 -14.703 6.059 13.836
197 HZ3 TRP 25 HZ3 TRP 25 -11.721 8.388 15.797
198 HH2 TRP 25 HH2 TRP 25 -13.744 7.031 15.873
199 H LYS 26 H LYS 26 -12.987 9.868 11.168
200 HA LYS 26 HA LYS 26 -14.919 10.872 10.581
201 HB2 LYS 26 HB2 LYS 26 -13.098 12.693 9.022
202 HB3 LYS 26 HB3 LYS 26 -14.828 12.951 9.192
203 HG2 LYS 26 HG2 LYS 26 -13.092 12.653 11.611
204 HG3 LYS 26 HG3 LYS 26 -13.200 14.193 10.762
205 HD2 LYS 26 HD2 LYS 26 -14.772 14.147 12.610
206 HD3 LYS 26 HD3 LYS 26 -15.637 14.188 11.078
207 HE2 LYS 26 HE2 LYS 26 -16.099 11.819 11.227
208 HE3 LYS 26 HE3 LYS 26 -15.130 11.693 12.694
209 HZ1 LYS 26 HZ1 LYS 26 -16.711 12.824 13.931
210 HZ2 LYS 26 HZ2 LYS 26 -17.668 11.874 12.902
211 HZ3 LYS 26 HZ3 LYS 26 -17.442 13.518 12.572
212 H HIS 27 H HIS 27 -12.971 9.479 8.154
213 HA HIS 27 HA HIS 27 -15.396 8.805 6.722
214 HB2 HIS 27 HB2 HIS 27 -14.306 9.197 4.483
215 HB3 HIS 27 HB3 HIS 27 -14.785 10.635 5.364
216 HD1 HIS 27 HD1 HIS 27 -13.134 11.909 3.767
217 HD2 HIS 27 HD2 HIS 27 -11.309 9.224 6.376
218 HE1 HIS 27 HE1 HIS 27 -10.689 12.497 3.751
219 HE2 HIS 27 HE2 HIS 27 -9.582 10.770 5.206
220 HA PRO 28 HA PRO 28 -12.729 5.225 7.595
221 HB2 PRO 28 HB2 PRO 28 -15.290 3.816 7.773
222 HB3 PRO 28 HB3 PRO 28 -14.034 4.009 8.998
223 HG2 PRO 28 HG2 PRO 28 -16.434 5.247 9.170
224 HG3 PRO 28 HG3 PRO 28 -14.944 5.951 9.819
225 HD2 PRO 28 HD2 PRO 28 -16.396 6.579 7.282
226 HD3 PRO 28 HD3 PRO 28 -15.595 7.677 8.426
227 H ASN 29 H ASN 29 -15.672 5.260 5.608
228 HA ASN 29 HA ASN 29 -14.998 2.966 4.088
229 HB2 ASN 29 HB2 ASN 29 -16.835 3.633 2.598
230 HB3 ASN 29 HB3 ASN 29 -17.315 3.707 4.288
231 HD21 ASN 29 HD21 ASN 29 -18.360 5.049 1.882
232 HD22 ASN 29 HD22 ASN 29 -18.337 6.739 2.259
233 H ILE 30 H ILE 30 -14.277 6.362 3.740
234 HA ILE 30 HA ILE 30 -13.494 6.274 1.021
235 HB ILE 30 HB ILE 30 -12.645 8.184 3.202
236 HG12 ILE 30 HG12 ILE 30 -15.047 8.214 2.808
237 HG13 ILE 30 HG13 ILE 30 -14.321 9.684 2.173
238 HG21 ILE 30 HG21 ILE 30 -11.974 9.691 1.398
239 HG22 ILE 30 HG22 ILE 30 -12.359 8.444 0.211
240 HG23 ILE 30 HG23 ILE 30 -11.046 8.191 1.360
241 HD11 ILE 30 HD11 ILE 30 -14.420 8.754 -0.083
242 HD12 ILE 30 HD12 ILE 30 -16.014 8.821 0.672
243 HD13 ILE 30 HD13 ILE 30 -15.155 7.285 0.559
244 H VAL 31 H VAL 31 -11.590 6.158 4.038
245 HA VAL 31 HA VAL 31 -9.150 5.671 2.644
246 HB VAL 31 HB VAL 31 -9.224 6.724 4.888
247 HG11 VAL 31 HG11 VAL 31 -9.852 3.950 5.870
248 HG12 VAL 31 HG12 VAL 31 -10.937 5.339 5.917
249 HG13 VAL 31 HG13 VAL 31 -9.459 5.340 6.879
250 HG21 VAL 31 HG21 VAL 31 -7.253 5.575 5.783
251 HG22 VAL 31 HG22 VAL 31 -7.150 5.790 4.036
252 HG23 VAL 31 HG23 VAL 31 -7.567 4.214 4.707
253 H ARG 32 H ARG 32 -11.661 3.637 3.996
254 HA ARG 32 HA ARG 32 -10.285 1.181 3.865
255 HB2 ARG 32 HB2 ARG 32 -13.071 2.040 4.139
256 HB3 ARG 32 HB3 ARG 32 -12.889 0.510 3.291
257 HG2 ARG 32 HG2 ARG 32 -11.773 1.152 6.012
258 HG3 ARG 32 HG3 ARG 32 -13.215 0.187 5.684
259 HD2 ARG 32 HD2 ARG 32 -11.816 -1.401 4.406
260 HD3 ARG 32 HD3 ARG 32 -10.392 -0.459 4.842
261 HE ARG 32 HE ARG 32 -11.843 -1.236 7.154
262 HH11 ARG 32 HH11 ARG 32 -9.704 -2.536 4.689
263 HH12 ARG 32 HH12 ARG 32 -9.063 -3.764 5.726
264 HH21 ARG 32 HH21 ARG 32 -10.984 -2.869 8.512
265 HH22 ARG 32 HH22 ARG 32 -9.773 -3.962 7.888
266 H SER 33 H SER 33 -12.229 2.938 1.483
267 HA SER 33 HA SER 33 -12.065 1.044 -0.575
268 HB2 SER 33 HB2 SER 33 -12.196 4.063 -0.829
269 HB3 SER 33 HB3 SER 33 -12.597 2.897 -2.093
270 HG SER 33 HG SER 33 -13.955 3.435 0.328
271 H ARG 34 H ARG 34 -9.858 3.584 0.465
272 HA ARG 34 HA ARG 34 -7.975 3.333 -1.609
273 HB2 ARG 34 HB2 ARG 34 -7.627 4.161 1.278
274 HB3 ARG 34 HB3 ARG 34 -6.359 4.281 0.063
275 HG2 ARG 34 HG2 ARG 34 -9.021 5.684 -0.019
276 HG3 ARG 34 HG3 ARG 34 -7.466 6.418 0.387
277 HD2 ARG 34 HD2 ARG 34 -6.627 6.020 -1.808
278 HD3 ARG 34 HD3 ARG 34 -8.029 5.041 -2.230
279 HE ARG 34 HE ARG 34 -8.312 7.904 -1.612
280 HH11 ARG 34 HH11 ARG 34 -8.636 5.200 -3.819
281 HH12 ARG 34 HH12 ARG 34 -9.685 6.059 -4.915
282 HH21 ARG 34 HH21 ARG 34 -9.684 9.043 -3.048
283 HH22 ARG 34 HH22 ARG 34 -10.296 8.242 -4.471
284 H ILE 35 H ILE 35 -8.001 1.888 1.642
285 HA ILE 35 HA ILE 35 -5.692 0.335 1.326
286 HB ILE 35 HB ILE 35 -8.091 -0.191 3.088
287 HG12 ILE 35 HG12 ILE 35 -5.441 1.146 3.687
288 HG13 ILE 35 HG13 ILE 35 -6.975 1.983 3.464
289 HG21 ILE 35 HG21 ILE 35 -5.310 -1.356 3.195
290 HG22 ILE 35 HG22 ILE 35 -6.801 -2.221 2.822
291 HG23 ILE 35 HG23 ILE 35 -6.545 -1.561 4.437
292 HD11 ILE 35 HD11 ILE 35 -7.873 0.843 5.428
293 HD12 ILE 35 HD12 ILE 35 -6.425 1.774 5.812
294 HD13 ILE 35 HD13 ILE 35 -6.331 0.019 5.651
295 H GLU 36 H GLU 36 -9.092 -0.486 0.703
296 HA GLU 36 HA GLU 36 -8.467 -3.248 0.195
297 HB2 GLU 36 HB2 GLU 36 -11.029 -1.689 -0.145
298 HB3 GLU 36 HB3 GLU 36 -10.888 -3.427 -0.359
299 HG2 GLU 36 HG2 GLU 36 -10.424 -1.883 2.178
300 HG3 GLU 36 HG3 GLU 36 -11.789 -2.940 1.817
301 H LYS 37 H LYS 37 -8.840 -0.405 -1.781
302 HA LYS 37 HA LYS 37 -8.924 -2.118 -4.167
303 HB2 LYS 37 HB2 LYS 37 -10.878 -0.831 -4.158
304 HB3 LYS 37 HB3 LYS 37 -10.035 0.613 -3.623
305 HG2 LYS 37 HG2 LYS 37 -9.203 -0.448 -6.238
306 HG3 LYS 37 HG3 LYS 37 -10.850 0.188 -6.145
307 HD2 LYS 37 HD2 LYS 37 -10.025 2.292 -5.284
308 HD3 LYS 37 HD3 LYS 37 -8.379 1.659 -5.238
309 HE2 LYS 37 HE2 LYS 37 -8.383 1.431 -7.652
310 HE3 LYS 37 HE3 LYS 37 -10.049 1.998 -7.711
311 HZ1 LYS 37 HZ1 LYS 37 -9.372 4.133 -6.917
312 HZ2 LYS 37 HZ2 LYS 37 -8.379 3.724 -8.231
313 HZ3 LYS 37 HZ3 LYS 37 -7.783 3.595 -6.647
314 H ASP 38 H ASP 38 -7.438 0.879 -2.932
315 HA ASP 38 HA ASP 38 -5.677 1.042 -5.217
316 HB2 ASP 38 HB2 ASP 38 -5.823 2.695 -2.691
317 HB3 ASP 38 HB3 ASP 38 -4.730 3.025 -4.031
318 H ILE 39 H ILE 39 -5.143 0.767 -1.704
319 HA ILE 39 HA ILE 39 -2.369 0.323 -1.888
320 HB ILE 39 HB ILE 39 -4.369 -0.189 0.297
321 HG12 ILE 39 HG12 ILE 39 -2.909 1.481 1.494
322 HG13 ILE 39 HG13 ILE 39 -2.018 1.685 -0.006
323 HG21 ILE 39 HG21 ILE 39 -2.558 -0.836 1.809
324 HG22 ILE 39 HG22 ILE 39 -1.436 -0.850 0.448
325 HG23 ILE 39 HG23 ILE 39 -2.772 -2.000 0.500
326 HD11 ILE 39 HD11 ILE 39 -4.929 2.297 0.428
327 HD12 ILE 39 HD12 ILE 39 -4.061 2.473 -1.096
328 HD13 ILE 39 HD13 ILE 39 -3.615 3.466 0.292
329 H LYS 40 H LYS 40 -5.043 -1.986 -1.451
330 HA LYS 40 HA LYS 40 -3.212 -4.138 -2.221
331 HB2 LYS 40 HB2 LYS 40 -4.122 -4.445 -0.043
332 HB3 LYS 40 HB3 LYS 40 -5.736 -4.020 -0.578
333 HG2 LYS 40 HG2 LYS 40 -5.737 -6.105 -1.945
334 HG3 LYS 40 HG3 LYS 40 -4.214 -6.537 -1.160
335 HD2 LYS 40 HD2 LYS 40 -6.207 -7.513 -0.076
336 HD3 LYS 40 HD3 LYS 40 -5.252 -6.511 1.005
337 HE2 LYS 40 HE2 LYS 40 -6.834 -4.644 0.550
338 HE3 LYS 40 HE3 LYS 40 -7.817 -5.760 -0.396
339 HZ1 LYS 40 HZ1 LYS 40 -7.223 -5.936 2.503
340 HZ2 LYS 40 HZ2 LYS 40 -8.032 -7.138 1.629
341 HZ3 LYS 40 HZ3 LYS 40 -8.723 -5.595 1.792
342 HA PRO 41 HA PRO 41 -6.151 -3.763 -5.726
343 HB2 PRO 41 HB2 PRO 41 -4.304 -3.529 -7.710
344 HB3 PRO 41 HB3 PRO 41 -4.907 -2.165 -6.768
345 HG2 PRO 41 HG2 PRO 41 -2.273 -3.430 -6.715
346 HG3 PRO 41 HG3 PRO 41 -2.773 -1.857 -6.078
347 HD2 PRO 41 HD2 PRO 41 -2.375 -4.343 -4.656
348 HD3 PRO 41 HD3 PRO 41 -2.747 -2.739 -3.998
349 H ALA 42 H ALA 42 -3.054 -5.486 -6.234
350 HA ALA 42 HA ALA 42 -4.594 -7.857 -7.010
351 HB1 ALA 42 HB1 ALA 42 -2.270 -6.728 -8.557
352 HB2 ALA 42 HB2 ALA 42 -3.958 -6.745 -9.069
353 HB3 ALA 42 HB3 ALA 42 -3.077 -8.260 -8.890
354 H ILE 43 H ILE 43 -1.730 -6.494 -5.638
355 HA ILE 43 HA ILE 43 -0.438 -9.051 -5.230
356 HB ILE 43 HB ILE 43 1.148 -7.569 -3.830
357 HG12 ILE 43 HG12 ILE 43 -0.232 -5.392 -5.402
358 HG13 ILE 43 HG13 ILE 43 -0.588 -5.712 -3.712
359 HG21 ILE 43 HG21 ILE 43 2.289 -6.801 -5.859
360 HG22 ILE 43 HG22 ILE 43 0.828 -7.112 -6.794
361 HG23 ILE 43 HG23 ILE 43 1.689 -8.451 -6.035
362 HD11 ILE 43 HD11 ILE 43 1.723 -5.217 -3.128
363 HD12 ILE 43 HD12 ILE 43 0.976 -3.866 -3.984
364 HD13 ILE 43 HD13 ILE 43 2.096 -4.935 -4.829
365 H GLY 44 H GLY 44 -3.091 -8.515 -4.037
366 HA2 GLY 44 HA2 GLY 44 -2.819 -7.976 -1.266
367 HA3 GLY 44 HA3 GLY 44 -4.218 -8.694 -2.048
368 H SER 45 H SER 45 -2.162 -9.203 0.310
369 HA SER 45 HA SER 45 -1.745 -10.983 1.639
370 HB2 SER 45 HB2 SER 45 -3.417 -12.550 -0.339
371 HB3 SER 45 HB3 SER 45 -2.935 -13.093 1.270
372 HG SER 45 HG SER 45 -4.936 -12.245 1.549
373 H LEU 46 H LEU 46 -0.273 -10.373 -1.039
374 HA LEU 46 HA LEU 46 1.115 -12.896 -1.425
375 HB2 LEU 46 HB2 LEU 46 0.592 -11.390 -3.337
376 HB3 LEU 46 HB3 LEU 46 1.669 -10.187 -2.652
377 HG LEU 46 HG LEU 46 3.556 -11.776 -2.908
378 HD11 LEU 46 HD11 LEU 46 2.303 -13.863 -2.824
379 HD12 LEU 46 HD12 LEU 46 3.262 -13.763 -4.300
380 HD13 LEU 46 HD13 LEU 46 1.526 -13.470 -4.358
381 HD21 LEU 46 HD21 LEU 46 2.019 -11.208 -5.441
382 HD22 LEU 46 HD22 LEU 46 3.742 -11.576 -5.335
383 HD23 LEU 46 HD23 LEU 46 3.110 -10.094 -4.617
384 H LYS 47 H LYS 47 1.554 -12.621 1.011
385 HA LYS 47 HA LYS 47 2.945 -12.289 2.760
386 HB2 LYS 47 HB2 LYS 47 4.792 -12.470 0.421
387 HB3 LYS 47 HB3 LYS 47 5.436 -12.163 2.029
388 HG2 LYS 47 HG2 LYS 47 3.681 -14.497 1.318
389 HG3 LYS 47 HG3 LYS 47 5.446 -14.546 1.375
390 HD2 LYS 47 HD2 LYS 47 5.232 -13.695 3.762
391 HD3 LYS 47 HD3 LYS 47 3.515 -14.083 3.633
392 HE2 LYS 47 HE2 LYS 47 3.897 -16.342 3.510
393 HE3 LYS 47 HE3 LYS 47 5.533 -16.133 2.888
394 HZ1 LYS 47 HZ1 LYS 47 5.651 -16.890 5.139
395 HZ2 LYS 47 HZ2 LYS 47 4.610 -15.663 5.671
396 HZ3 LYS 47 HZ3 LYS 47 6.161 -15.270 5.104
397 H VAL 48 H VAL 48 4.461 -10.876 3.890
398 HA VAL 48 HA VAL 48 4.390 -8.095 3.034
399 HB VAL 48 HB VAL 48 5.856 -9.312 5.394
400 HG11 VAL 48 HG11 VAL 48 6.694 -7.113 4.720
401 HG12 VAL 48 HG12 VAL 48 5.874 -7.037 6.280
402 HG13 VAL 48 HG13 VAL 48 5.063 -6.457 4.826
403 HG21 VAL 48 HG21 VAL 48 3.980 -8.562 6.763
404 HG22 VAL 48 HG22 VAL 48 3.459 -9.742 5.559
405 HG23 VAL 48 HG23 VAL 48 3.130 -8.025 5.315
406 H GLU 49 H GLU 49 6.438 -10.858 3.052
407 HA GLU 49 HA GLU 49 8.885 -9.437 2.508
408 HB2 GLU 49 HB2 GLU 49 8.497 -12.404 2.191
409 HB3 GLU 49 HB3 GLU 49 9.958 -11.531 2.626
410 HG2 GLU 49 HG2 GLU 49 9.404 -12.386 4.655
411 HG3 GLU 49 HG3 GLU 49 8.520 -10.863 4.734
412 H ASP 50 H ASP 50 6.375 -10.911 0.624
413 HA ASP 50 HA ASP 50 8.064 -11.325 -1.689
414 HB2 ASP 50 HB2 ASP 50 5.250 -11.964 -0.992
415 HB3 ASP 50 HB3 ASP 50 5.630 -11.783 -2.699
416 H VAL 51 H VAL 51 6.048 -8.802 -0.491
417 HA VAL 51 HA VAL 51 5.542 -7.639 -3.051
418 HB VAL 51 HB VAL 51 3.993 -7.133 -1.295
419 HG11 VAL 51 HG11 VAL 51 5.401 -7.339 0.647
420 HG12 VAL 51 HG12 VAL 51 4.608 -5.762 0.659
421 HG13 VAL 51 HG13 VAL 51 6.303 -5.895 0.189
422 HG21 VAL 51 HG21 VAL 51 4.304 -5.413 -2.978
423 HG22 VAL 51 HG22 VAL 51 5.585 -4.677 -2.015
424 HG23 VAL 51 HG23 VAL 51 3.926 -4.690 -1.414
425 H LYS 52 H LYS 52 7.436 -7.454 -4.113
426 HA LYS 52 HA LYS 52 9.559 -5.806 -2.981
427 HB2 LYS 52 HB2 LYS 52 9.580 -7.125 -5.697
428 HB3 LYS 52 HB3 LYS 52 10.954 -6.642 -4.709
429 HG2 LYS 52 HG2 LYS 52 10.166 -8.377 -3.032
430 HG3 LYS 52 HG3 LYS 52 9.095 -8.962 -4.299
431 HD2 LYS 52 HD2 LYS 52 11.059 -10.303 -4.352
432 HD3 LYS 52 HD3 LYS 52 11.117 -9.237 -5.755
433 HE2 LYS 52 HE2 LYS 52 12.759 -7.862 -4.774
434 HE3 LYS 52 HE3 LYS 52 12.486 -8.545 -3.171
435 HZ1 LYS 52 HZ1 LYS 52 14.542 -9.339 -4.312
436 HZ2 LYS 52 HZ2 LYS 52 13.554 -10.120 -5.449
437 HZ3 LYS 52 HZ3 LYS 52 13.493 -10.574 -3.817
438 HA PRO 53 HA PRO 53 8.588 -2.014 -4.917
439 HB2 PRO 53 HB2 PRO 53 11.223 -2.016 -6.299
440 HB3 PRO 53 HB3 PRO 53 10.512 -0.803 -5.230
441 HG2 PRO 53 HG2 PRO 53 12.449 -2.392 -4.353
442 HG3 PRO 53 HG3 PRO 53 11.081 -1.968 -3.304
443 HD2 PRO 53 HD2 PRO 53 11.616 -4.510 -4.789
444 HD3 PRO 53 HD3 PRO 53 10.927 -4.271 -3.170
445 H ARG 54 H ARG 54 9.874 -4.491 -7.019
446 HA ARG 54 HA ARG 54 9.253 -3.397 -9.516
447 HB2 ARG 54 HB2 ARG 54 9.159 -6.300 -8.678
448 HB3 ARG 54 HB3 ARG 54 9.240 -5.712 -10.333
449 HG2 ARG 54 HG2 ARG 54 11.435 -4.751 -9.895
450 HG3 ARG 54 HG3 ARG 54 11.354 -5.320 -8.224
451 HD2 ARG 54 HD2 ARG 54 11.215 -7.622 -9.011
452 HD3 ARG 54 HD3 ARG 54 11.268 -7.062 -10.679
453 HE ARG 54 HE ARG 54 13.499 -6.618 -8.793
454 HH11 ARG 54 HH11 ARG 54 12.251 -7.638 -11.907
455 HH12 ARG 54 HH12 ARG 54 13.823 -7.969 -12.577
456 HH21 ARG 54 HH21 ARG 54 15.580 -7.018 -9.685
457 HH22 ARG 54 HH22 ARG 54 15.712 -7.619 -11.315
458 H HIS 55 H HIS 55 7.282 -5.266 -7.257
459 HA HIS 55 HA HIS 55 5.049 -5.651 -8.951
460 HB2 HIS 55 HB2 HIS 55 5.033 -5.464 -5.930
461 HB3 HIS 55 HB3 HIS 55 3.792 -6.194 -6.934
462 HD1 HIS 55 HD1 HIS 55 6.565 -7.486 -8.557
463 HD2 HIS 55 HD2 HIS 55 4.956 -8.143 -4.774
464 HE1 HIS 55 HE1 HIS 55 7.532 -9.671 -7.767
465 HE2 HIS 55 HE2 HIS 55 6.438 -10.122 -5.547
466 H ILE 56 H ILE 56 6.001 -3.112 -6.764
467 HA ILE 56 HA ILE 56 3.546 -1.798 -6.483
468 HB ILE 56 HB ILE 56 6.307 -0.568 -6.384
469 HG12 ILE 56 HG12 ILE 56 6.113 -2.504 -4.876
470 HG13 ILE 56 HG13 ILE 56 6.223 -0.996 -3.973
471 HG21 ILE 56 HG21 ILE 56 4.559 1.100 -6.517
472 HG22 ILE 56 HG22 ILE 56 5.260 1.084 -4.900
473 HG23 ILE 56 HG23 ILE 56 3.690 0.331 -5.188
474 HD11 ILE 56 HD11 ILE 56 3.707 -2.557 -4.515
475 HD12 ILE 56 HD12 ILE 56 3.806 -1.038 -3.622
476 HD13 ILE 56 HD13 ILE 56 4.589 -2.486 -2.988
477 H ASP 57 H ASP 57 6.122 -1.415 -8.886
478 HA ASP 57 HA ASP 57 5.115 0.938 -10.071
479 HB2 ASP 57 HB2 ASP 57 7.429 0.117 -10.410
480 HB3 ASP 57 HB3 ASP 57 6.798 -1.224 -11.360
481 H ASP 58 H ASP 58 4.549 -2.482 -10.698
482 HA ASP 58 HA ASP 58 3.054 -2.030 -13.088
483 HB2 ASP 58 HB2 ASP 58 4.234 -4.168 -12.625
484 HB3 ASP 58 HB3 ASP 58 3.074 -4.498 -11.341
485 H VAL 59 H VAL 59 2.181 -2.645 -9.696
486 HA VAL 59 HA VAL 59 -0.610 -2.755 -10.228
487 HB VAL 59 HB VAL 59 -0.959 -2.555 -7.811
488 HG11 VAL 59 HG11 VAL 59 1.268 -4.444 -8.553
489 HG12 VAL 59 HG12 VAL 59 -0.458 -4.728 -8.778
490 HG13 VAL 59 HG13 VAL 59 0.209 -4.598 -7.151
491 HG21 VAL 59 HG21 VAL 59 0.812 -0.961 -7.280
492 HG22 VAL 59 HG22 VAL 59 2.027 -2.190 -7.630
493 HG23 VAL 59 HG23 VAL 59 0.923 -2.404 -6.271
494 H LEU 60 H LEU 60 1.579 -0.124 -9.316
495 HA LEU 60 HA LEU 60 -0.446 1.835 -8.963
496 HB2 LEU 60 HB2 LEU 60 2.441 2.122 -9.804
497 HB3 LEU 60 HB3 LEU 60 1.390 3.477 -9.447
498 HG LEU 60 HG LEU 60 2.310 1.351 -7.510
499 HD11 LEU 60 HD11 LEU 60 2.897 4.304 -7.687
500 HD12 LEU 60 HD12 LEU 60 4.009 2.998 -8.094
501 HD13 LEU 60 HD13 LEU 60 3.467 3.205 -6.428
502 HD21 LEU 60 HD21 LEU 60 0.014 2.019 -7.018
503 HD22 LEU 60 HD22 LEU 60 0.492 3.716 -7.045
504 HD23 LEU 60 HD23 LEU 60 1.131 2.641 -5.802
505 H LYS 61 H LYS 61 1.413 0.748 -11.766
506 HA LYS 61 HA LYS 61 0.513 2.604 -13.631
507 HB2 LYS 61 HB2 LYS 61 2.361 1.166 -14.115
508 HB3 LYS 61 HB3 LYS 61 1.397 -0.275 -13.852
509 HG2 LYS 61 HG2 LYS 61 0.641 1.589 -16.042
510 HG3 LYS 61 HG3 LYS 61 2.025 0.516 -16.256
511 HD2 LYS 61 HD2 LYS 61 -0.823 -0.264 -15.649
512 HD3 LYS 61 HD3 LYS 61 0.079 -0.567 -17.125
513 HE2 LYS 61 HE2 LYS 61 0.698 -1.726 -14.416
514 HE3 LYS 61 HE3 LYS 61 -0.083 -2.578 -15.744
515 HZ1 LYS 61 HZ1 LYS 61 1.925 -2.358 -17.045
516 HZ2 LYS 61 HZ2 LYS 61 2.276 -3.104 -15.561
517 HZ3 LYS 61 HZ3 LYS 61 2.678 -1.474 -15.808
518 H ALA 62 H ALA 62 -0.932 -0.363 -12.422
519 HA ALA 62 HA ALA 62 -3.109 -0.406 -14.251
520 HB1 ALA 62 HB1 ALA 62 -4.056 -2.100 -12.787
521 HB2 ALA 62 HB2 ALA 62 -2.875 -1.706 -11.538
522 HB3 ALA 62 HB3 ALA 62 -2.344 -2.411 -13.065
523 H VAL 63 H VAL 63 -2.780 0.748 -10.883
524 HA VAL 63 HA VAL 63 -5.511 1.551 -10.721
525 HB VAL 63 HB VAL 63 -4.916 2.698 -8.643
526 HG11 VAL 63 HG11 VAL 63 -5.365 0.330 -8.542
527 HG12 VAL 63 HG12 VAL 63 -4.085 0.741 -7.399
528 HG13 VAL 63 HG13 VAL 63 -3.682 -0.034 -8.930
529 HG21 VAL 63 HG21 VAL 63 -2.078 1.988 -9.342
530 HG22 VAL 63 HG22 VAL 63 -2.618 2.622 -7.786
531 HG23 VAL 63 HG23 VAL 63 -2.764 3.610 -9.240
532 H MET 64 H MET 64 -2.682 3.043 -12.007
533 HA MET 64 HA MET 64 -3.728 5.715 -12.000
534 HB2 MET 64 HB2 MET 64 -1.449 4.435 -13.501
535 HB3 MET 64 HB3 MET 64 -1.898 6.120 -13.709
536 HG2 MET 64 HG2 MET 64 -1.461 6.519 -11.333
537 HG3 MET 64 HG3 MET 64 -0.992 4.829 -11.146
538 HE1 MET 64 HE1 MET 64 2.478 6.590 -10.877
539 HE2 MET 64 HE2 MET 64 1.373 5.424 -10.151
540 HE3 MET 64 HE3 MET 64 0.936 7.133 -10.210
541 H LYS 65 H LYS 65 -3.448 3.145 -14.458
542 HA LYS 65 HA LYS 65 -4.361 4.709 -16.595
543 HB2 LYS 65 HB2 LYS 65 -4.622 2.633 -17.822
544 HB3 LYS 65 HB3 LYS 65 -3.137 2.627 -16.897
545 HG2 LYS 65 HG2 LYS 65 -3.849 0.508 -16.512
546 HG3 LYS 65 HG3 LYS 65 -4.600 1.332 -15.147
547 HD2 LYS 65 HD2 LYS 65 -6.169 -0.194 -16.237
548 HD3 LYS 65 HD3 LYS 65 -6.702 1.482 -16.377
549 HE2 LYS 65 HE2 LYS 65 -5.794 1.568 -18.655
550 HE3 LYS 65 HE3 LYS 65 -5.281 -0.113 -18.509
551 HZ1 LYS 65 HZ1 LYS 65 -7.400 0.176 -19.707
552 HZ2 LYS 65 HZ2 LYS 65 -8.102 0.802 -18.295
553 HZ3 LYS 65 HZ3 LYS 65 -7.551 -0.800 -18.331
554 H ARG 66 H ARG 66 -6.124 2.689 -14.328
555 HA ARG 66 HA ARG 66 -8.621 3.558 -15.594
556 HB2 ARG 66 HB2 ARG 66 -9.702 1.834 -14.096
557 HB3 ARG 66 HB3 ARG 66 -8.642 1.216 -15.350
558 HG2 ARG 66 HG2 ARG 66 -7.968 -0.073 -13.619
559 HG3 ARG 66 HG3 ARG 66 -6.870 1.286 -13.395
560 HD2 ARG 66 HD2 ARG 66 -8.243 2.188 -11.652
561 HD3 ARG 66 HD3 ARG 66 -9.514 1.008 -11.975
562 HE ARG 66 HE ARG 66 -6.885 0.010 -11.177
563 HH11 ARG 66 HH11 ARG 66 -10.210 0.680 -10.280
564 HH12 ARG 66 HH12 ARG 66 -10.207 -0.452 -8.964
565 HH21 ARG 66 HH21 ARG 66 -6.869 -1.435 -9.425
566 HH22 ARG 66 HH22 ARG 66 -8.297 -1.625 -8.439
567 H GLY 67 H GLY 67 -6.722 4.979 -13.609
568 HA2 GLY 67 HA2 GLY 67 -8.917 6.193 -12.116
569 HA3 GLY 67 HA3 GLY 67 -7.588 5.534 -11.174
570 H ALA 68 H ALA 68 -6.076 6.936 -10.631
571 HA ALA 68 HA ALA 68 -5.194 8.976 -12.490
572 HB1 ALA 68 HB1 ALA 68 -6.380 9.747 -9.819
573 HB2 ALA 68 HB2 ALA 68 -7.106 10.064 -11.395
574 HB3 ALA 68 HB3 ALA 68 -5.582 10.837 -10.954
575 HA PRO 69 HA PRO 69 -1.385 8.056 -10.519
576 HB2 PRO 69 HB2 PRO 69 -0.477 10.748 -11.256
577 HB3 PRO 69 HB3 PRO 69 0.093 9.178 -11.815
578 HG2 PRO 69 HG2 PRO 69 -1.301 10.841 -13.406
579 HG3 PRO 69 HG3 PRO 69 -1.423 9.077 -13.533
580 HD2 PRO 69 HD2 PRO 69 -3.293 11.020 -12.241
581 HD3 PRO 69 HD3 PRO 69 -3.657 9.577 -13.212
582 H SER 70 H SER 70 -3.107 11.022 -9.827
583 HA SER 70 HA SER 70 -1.571 11.852 -7.596
584 HB2 SER 70 HB2 SER 70 -4.477 12.440 -8.217
585 HB3 SER 70 HB3 SER 70 -3.434 13.357 -7.128
586 HG SER 70 HG SER 70 -2.556 14.333 -8.776
587 H ILE 71 H ILE 71 -4.011 9.434 -8.011
588 HA ILE 71 HA ILE 71 -4.576 9.141 -5.207
589 HB ILE 71 HB ILE 71 -5.027 7.137 -7.431
590 HG12 ILE 71 HG12 ILE 71 -6.928 9.186 -6.263
591 HG13 ILE 71 HG13 ILE 71 -6.178 9.292 -7.851
592 HG21 ILE 71 HG21 ILE 71 -6.698 6.195 -5.890
593 HG22 ILE 71 HG22 ILE 71 -6.208 7.366 -4.665
594 HG23 ILE 71 HG23 ILE 71 -5.069 6.139 -5.216
595 HD11 ILE 71 HD11 ILE 71 -8.478 8.524 -8.000
596 HD12 ILE 71 HD12 ILE 71 -8.100 7.157 -6.950
597 HD13 ILE 71 HD13 ILE 71 -7.359 7.274 -8.545
598 H ALA 72 H ALA 72 -2.435 7.671 -7.568
599 HA ALA 72 HA ALA 72 -1.722 5.397 -6.081
600 HB1 ALA 72 HB1 ALA 72 0.043 5.096 -7.719
601 HB2 ALA 72 HB2 ALA 72 -0.194 6.747 -8.296
602 HB3 ALA 72 HB3 ALA 72 -1.473 5.549 -8.500
603 H ASN 73 H ASN 73 -0.179 8.592 -6.315
604 HA ASN 73 HA ASN 73 2.121 7.762 -4.831
605 HB2 ASN 73 HB2 ASN 73 2.763 10.106 -4.759
606 HB3 ASN 73 HB3 ASN 73 2.248 9.666 -6.380
607 HD21 ASN 73 HD21 ASN 73 2.410 12.281 -5.143
608 HD22 ASN 73 HD22 ASN 73 0.821 12.953 -5.239
609 H ASP 74 H ASP 74 -1.023 8.967 -3.988
610 HA ASP 74 HA ASP 74 -0.397 9.523 -1.248
611 HB2 ASP 74 HB2 ASP 74 -2.413 10.449 -2.408
612 HB3 ASP 74 HB3 ASP 74 -3.094 8.826 -2.444
613 H THR 75 H THR 75 -1.563 6.746 -3.070
614 HA THR 75 HA THR 75 -1.916 4.921 -0.993
615 HB THR 75 HB THR 75 -0.823 4.415 -3.772
616 HG1 THR 75 HG1 THR 75 -3.144 3.830 -4.063
617 HG21 THR 75 HG21 THR 75 -1.720 2.139 -3.480
618 HG22 THR 75 HG22 THR 75 -2.134 2.523 -1.811
619 HG23 THR 75 HG23 THR 75 -0.445 2.495 -2.316
620 H LEU 76 H LEU 76 0.991 5.930 -2.716
621 HA LEU 76 HA LEU 76 2.763 4.021 -1.689
622 HB2 LEU 76 HB2 LEU 76 3.221 6.803 -2.738
623 HB3 LEU 76 HB3 LEU 76 4.529 5.727 -2.286
624 HG LEU 76 HG LEU 76 2.485 5.172 -4.435
625 HD11 LEU 76 HD11 LEU 76 5.394 5.941 -4.651
626 HD12 LEU 76 HD12 LEU 76 4.022 6.982 -5.031
627 HD13 LEU 76 HD13 LEU 76 4.319 5.534 -5.990
628 HD21 LEU 76 HD21 LEU 76 3.945 3.287 -4.997
629 HD22 LEU 76 HD22 LEU 76 3.295 3.142 -3.363
630 HD23 LEU 76 HD23 LEU 76 4.961 3.664 -3.606
631 H ARG 77 H ARG 77 1.815 7.192 -0.396
632 HA ARG 77 HA ARG 77 3.880 7.248 1.550
633 HB2 ARG 77 HB2 ARG 77 2.642 9.082 2.607
634 HB3 ARG 77 HB3 ARG 77 2.842 9.320 0.880
635 HG2 ARG 77 HG2 ARG 77 0.505 8.412 0.614
636 HG3 ARG 77 HG3 ARG 77 0.358 8.542 2.369
637 HD2 ARG 77 HD2 ARG 77 -0.538 10.504 1.133
638 HD3 ARG 77 HD3 ARG 77 0.735 10.907 2.285
639 HE ARG 77 HE ARG 77 2.216 10.754 0.173
640 HH11 ARG 77 HH11 ARG 77 -1.089 11.909 0.189
641 HH12 ARG 77 HH12 ARG 77 -0.811 13.083 -1.066
642 HH21 ARG 77 HH21 ARG 77 2.572 12.239 -1.504
643 HH22 ARG 77 HH22 ARG 77 1.267 13.258 -2.045
644 H TRP 78 H TRP 78 0.582 6.000 1.597
645 HA TRP 78 HA TRP 78 0.530 5.342 4.349
646 HB2 TRP 78 HB2 TRP 78 -0.864 4.045 1.993
647 HB3 TRP 78 HB3 TRP 78 -1.181 3.628 3.673
648 HD1 TRP 78 HD1 TRP 78 -2.542 5.693 1.025
649 HE1 TRP 78 HE1 TRP 78 -4.085 7.532 1.954
650 HE3 TRP 78 HE3 TRP 78 -1.180 5.475 5.945
651 HZ2 TRP 78 HZ2 TRP 78 -4.645 8.731 4.445
652 HZ3 TRP 78 HZ3 TRP 78 -2.268 7.007 7.538
653 HH2 TRP 78 HH2 TRP 78 -3.965 8.601 6.800
654 H LEU 79 H LEU 79 1.543 3.558 1.477
655 HA LEU 79 HA LEU 79 2.196 1.138 2.747
656 HB2 LEU 79 HB2 LEU 79 3.278 2.354 0.206
657 HB3 LEU 79 HB3 LEU 79 3.550 0.696 0.706
658 HG LEU 79 HG LEU 79 0.854 1.904 0.080
659 HD11 LEU 79 HD11 LEU 79 0.928 0.508 -1.921
660 HD12 LEU 79 HD12 LEU 79 2.554 -0.025 -1.500
661 HD13 LEU 79 HD13 LEU 79 2.260 1.664 -1.909
662 HD21 LEU 79 HD21 LEU 79 1.663 -0.939 0.688
663 HD22 LEU 79 HD22 LEU 79 0.051 -0.399 0.215
664 HD23 LEU 79 HD23 LEU 79 0.742 0.126 1.751
665 H LYS 80 H LYS 80 4.177 3.978 1.985
666 HA LYS 80 HA LYS 80 6.663 2.890 2.577
667 HB2 LYS 80 HB2 LYS 80 6.179 5.008 1.338
668 HB3 LYS 80 HB3 LYS 80 5.785 5.768 2.873
669 HG2 LYS 80 HG2 LYS 80 8.418 4.452 2.674
670 HG3 LYS 80 HG3 LYS 80 8.185 5.928 1.738
671 HD2 LYS 80 HD2 LYS 80 7.555 5.698 4.671
672 HD3 LYS 80 HD3 LYS 80 9.097 6.249 4.041
673 HE2 LYS 80 HE2 LYS 80 7.834 8.006 2.757
674 HE3 LYS 80 HE3 LYS 80 6.405 7.525 3.668
675 HZ1 LYS 80 HZ1 LYS 80 7.361 9.383 4.754
676 HZ2 LYS 80 HZ2 LYS 80 8.910 8.703 4.736
677 HZ3 LYS 80 HZ3 LYS 80 7.705 8.035 5.724
678 H ARG 81 H ARG 81 4.289 4.494 4.638
679 HA ARG 81 HA ARG 81 5.901 4.412 7.002
680 HB2 ARG 81 HB2 ARG 81 2.892 4.598 6.749
681 HB3 ARG 81 HB3 ARG 81 3.830 4.940 8.195
682 HG2 ARG 81 HG2 ARG 81 4.858 6.846 7.113
683 HG3 ARG 81 HG3 ARG 81 3.999 6.477 5.612
684 HD2 ARG 81 HD2 ARG 81 1.860 6.769 6.796
685 HD3 ARG 81 HD3 ARG 81 2.745 7.204 8.256
686 HE ARG 81 HE ARG 81 3.518 8.876 6.096
687 HH11 ARG 81 HH11 ARG 81 0.901 8.309 8.359
688 HH12 ARG 81 HH12 ARG 81 0.311 9.936 8.282
689 HH21 ARG 81 HH21 ARG 81 2.734 11.017 5.982
690 HH22 ARG 81 HH22 ARG 81 1.340 11.479 6.933
691 H MET 82 H MET 82 3.395 2.402 5.596
692 HA MET 82 HA MET 82 2.916 0.696 7.759
693 HB2 MET 82 HB2 MET 82 1.476 0.964 5.749
694 HB3 MET 82 HB3 MET 82 2.666 0.072 4.813
695 HG2 MET 82 HG2 MET 82 2.317 -1.871 6.291
696 HG3 MET 82 HG3 MET 82 1.056 -0.970 7.130
697 HE1 MET 82 HE1 MET 82 -0.183 0.628 4.551
698 HE2 MET 82 HE2 MET 82 -1.137 -0.044 5.874
699 HE3 MET 82 HE3 MET 82 -1.546 -0.438 4.205
700 H PHE 83 H PHE 83 5.024 0.213 4.918
701 HA PHE 83 HA PHE 83 5.951 -2.323 5.806
702 HB2 PHE 83 HB2 PHE 83 7.085 -0.413 3.756
703 HB3 PHE 83 HB3 PHE 83 7.706 -2.038 4.042
704 HD1 PHE 83 HD1 PHE 83 5.634 -3.831 4.148
705 HD2 PHE 83 HD2 PHE 83 5.771 -0.222 1.893
706 HE1 PHE 83 HE1 PHE 83 3.971 -4.750 2.587
707 HE2 PHE 83 HE2 PHE 83 4.106 -1.134 0.326
708 HZ PHE 83 HZ PHE 83 3.204 -3.401 0.672
709 H ASN 84 H ASN 84 7.103 0.966 6.225
710 HA ASN 84 HA ASN 84 9.638 0.364 7.293
711 HB2 ASN 84 HB2 ASN 84 9.021 2.627 6.574
712 HB3 ASN 84 HB3 ASN 84 7.837 2.728 7.872
713 HD21 ASN 84 HD21 ASN 84 8.505 3.181 9.928
714 HD22 ASN 84 HD22 ASN 84 10.132 3.616 10.329
715 H TYR 85 H TYR 85 6.437 0.483 8.715
716 HA TYR 85 HA TYR 85 7.199 0.228 11.422
717 HB2 TYR 85 HB2 TYR 85 4.938 0.852 10.911
718 HB3 TYR 85 HB3 TYR 85 4.694 -0.591 9.936
719 HD1 TYR 85 HD1 TYR 85 5.311 0.532 13.434
720 HD2 TYR 85 HD2 TYR 85 3.793 -2.525 10.892
721 HE1 TYR 85 HE1 TYR 85 4.391 -0.637 15.395
722 HE2 TYR 85 HE2 TYR 85 2.877 -3.701 12.844
723 HH TYR 85 HH TYR 85 2.636 -2.270 15.914
724 H ALA 86 H ALA 86 6.474 -2.183 8.922
725 HA ALA 86 HA ALA 86 6.827 -4.442 10.591
726 HB1 ALA 86 HB1 ALA 86 7.169 -4.271 7.596
727 HB2 ALA 86 HB2 ALA 86 5.636 -4.515 8.433
728 HB3 ALA 86 HB3 ALA 86 6.905 -5.735 8.544
729 H ILE 87 H ILE 87 9.036 -2.412 8.824
730 HA ILE 87 HA ILE 87 11.296 -4.141 9.031
731 HB ILE 87 HB ILE 87 11.169 -1.149 8.597
732 HG12 ILE 87 HG12 ILE 87 11.584 -3.423 6.643
733 HG13 ILE 87 HG13 ILE 87 10.087 -2.519 6.844
734 HG21 ILE 87 HG21 ILE 87 13.479 -1.355 7.791
735 HG22 ILE 87 HG22 ILE 87 13.486 -3.055 8.263
736 HG23 ILE 87 HG23 ILE 87 13.336 -1.799 9.492
737 HD11 ILE 87 HD11 ILE 87 11.222 -0.483 6.122
738 HD12 ILE 87 HD12 ILE 87 11.314 -1.754 4.903
739 HD13 ILE 87 HD13 ILE 87 12.717 -1.396 5.908
740 H LYS 88 H LYS 88 10.152 -1.336 10.925
741 HA LYS 88 HA LYS 88 12.402 -1.309 12.637
742 HB2 LYS 88 HB2 LYS 88 11.209 0.248 14.025
743 HB3 LYS 88 HB3 LYS 88 10.946 0.657 12.338
744 HG2 LYS 88 HG2 LYS 88 8.732 -0.181 12.391
745 HG3 LYS 88 HG3 LYS 88 8.989 -0.942 13.961
746 HD2 LYS 88 HD2 LYS 88 7.694 1.112 14.191
747 HD3 LYS 88 HD3 LYS 88 9.261 1.259 14.989
748 HE2 LYS 88 HE2 LYS 88 10.108 2.408 12.942
749 HE3 LYS 88 HE3 LYS 88 8.462 2.387 12.313
750 HZ1 LYS 88 HZ1 LYS 88 7.774 3.662 14.290
751 HZ2 LYS 88 HZ2 LYS 88 8.910 4.497 13.342
752 HZ3 LYS 88 HZ3 LYS 88 9.395 3.749 14.787
753 H ARG 89 H ARG 89 9.351 -3.044 12.805
754 HA ARG 89 HA ARG 89 10.036 -4.044 15.454
755 HB2 ARG 89 HB2 ARG 89 7.888 -5.235 15.366
756 HB3 ARG 89 HB3 ARG 89 7.708 -3.516 15.070
757 HG2 ARG 89 HG2 ARG 89 6.343 -4.286 13.453
758 HG3 ARG 89 HG3 ARG 89 7.857 -4.339 12.548
759 HD2 ARG 89 HD2 ARG 89 6.528 -6.395 12.300
760 HD3 ARG 89 HD3 ARG 89 8.103 -6.692 13.035
761 HE ARG 89 HE ARG 89 7.005 -6.951 15.159
762 HH11 ARG 89 HH11 ARG 89 4.847 -6.834 12.386
763 HH12 ARG 89 HH12 ARG 89 3.563 -7.663 13.207
764 HH21 ARG 89 HH21 ARG 89 5.293 -8.042 16.211
765 HH22 ARG 89 HH22 ARG 89 3.814 -8.347 15.351
766 H HIS 90 H HIS 90 11.193 -4.629 12.594
767 HA HIS 90 HA HIS 90 12.590 -6.175 11.777
768 HB2 HIS 90 HB2 HIS 90 13.334 -6.205 14.185
769 HB3 HIS 90 HB3 HIS 90 12.341 -7.644 14.399
770 HD1 HIS 90 HD1 HIS 90 14.321 -9.182 14.872
771 HD2 HIS 90 HD2 HIS 90 14.595 -7.217 11.220
772 HE1 HIS 90 HE1 HIS 90 16.217 -10.291 13.646
773 HE2 HIS 90 HE2 HIS 90 16.529 -8.897 11.568
774 H ILE 91 H ILE 91 10.662 -6.650 10.409
775 HA ILE 91 HA ILE 91 10.423 -9.589 10.443
776 HB ILE 91 HB ILE 91 8.384 -7.610 9.399
777 HG12 ILE 91 HG12 ILE 91 8.233 -9.803 11.482
778 HG13 ILE 91 HG13 ILE 91 8.181 -8.068 11.783
779 HG21 ILE 91 HG21 ILE 91 8.674 -9.394 7.768
780 HG22 ILE 91 HG22 ILE 91 7.115 -9.543 8.579
781 HG23 ILE 91 HG23 ILE 91 8.451 -10.606 9.029
782 HD11 ILE 91 HD11 ILE 91 6.067 -7.929 10.569
783 HD12 ILE 91 HD12 ILE 91 5.971 -9.044 11.932
784 HD13 ILE 91 HD13 ILE 91 6.116 -9.669 10.289
785 H ILE 92 H ILE 92 10.037 -6.841 8.217
786 HA ILE 92 HA ILE 92 11.751 -8.250 6.292
787 HB ILE 92 HB ILE 92 10.889 -6.646 4.610
788 HG12 ILE 92 HG12 ILE 92 8.971 -5.820 6.803
789 HG13 ILE 92 HG13 ILE 92 10.292 -4.832 6.185
790 HG21 ILE 92 HG21 ILE 92 8.671 -7.658 4.391
791 HG22 ILE 92 HG22 ILE 92 8.780 -8.244 6.052
792 HG23 ILE 92 HG23 ILE 92 9.897 -8.849 4.828
793 HD11 ILE 92 HD11 ILE 92 7.941 -5.793 4.571
794 HD12 ILE 92 HD12 ILE 92 9.235 -4.731 4.014
795 HD13 ILE 92 HD13 ILE 92 8.122 -4.183 5.266
796 H GLU 93 H GLU 93 13.097 -6.693 4.930
797 HA GLU 93 HA GLU 93 14.190 -4.562 6.648
798 HB2 GLU 93 HB2 GLU 93 15.593 -6.639 6.611
799 HB3 GLU 93 HB3 GLU 93 15.801 -6.416 4.882
800 HG2 GLU 93 HG2 GLU 93 17.008 -4.382 5.221
801 HG3 GLU 93 HG3 GLU 93 16.641 -4.398 6.946
802 H TYR 94 H TYR 94 12.805 -5.399 3.736
803 HA TYR 94 HA TYR 94 14.002 -3.113 2.327
804 HB2 TYR 94 HB2 TYR 94 12.583 -5.562 1.269
805 HB3 TYR 94 HB3 TYR 94 12.999 -4.174 0.270
806 HD1 TYR 94 HD1 TYR 94 14.455 -6.863 2.375
807 HD2 TYR 94 HD2 TYR 94 15.158 -3.930 -0.622
808 HE1 TYR 94 HE1 TYR 94 16.686 -7.812 1.979
809 HE2 TYR 94 HE2 TYR 94 17.389 -4.874 -1.028
810 HH TYR 94 HH TYR 94 18.389 -7.896 0.305
811 H ASN 95 H ASN 95 12.822 -1.361 2.072
812 HA ASN 95 HA ASN 95 9.945 -1.446 2.496
813 HB2 ASN 95 HB2 ASN 95 11.511 0.172 3.693
814 HB3 ASN 95 HB3 ASN 95 11.698 0.980 2.141
815 HD21 ASN 95 HD21 ASN 95 10.611 1.936 4.627
816 HD22 ASN 95 HD22 ASN 95 8.997 2.431 4.282
817 HA PRO 96 HA PRO 96 10.164 -1.683 -2.100
818 HB2 PRO 96 HB2 PRO 96 7.448 -2.162 -2.342
819 HB3 PRO 96 HB3 PRO 96 8.686 -3.409 -2.160
820 HG2 PRO 96 HG2 PRO 96 6.906 -2.185 -0.092
821 HG3 PRO 96 HG3 PRO 96 7.394 -3.880 -0.293
822 HD2 PRO 96 HD2 PRO 96 8.526 -2.335 1.567
823 HD3 PRO 96 HD3 PRO 96 9.487 -3.518 0.654
824 H ALA 97 H ALA 97 8.101 0.279 -0.069
825 HA ALA 97 HA ALA 97 7.146 1.873 -2.293
826 HB1 ALA 97 HB1 ALA 97 5.879 3.105 -0.642
827 HB2 ALA 97 HB2 ALA 97 6.748 2.297 0.663
828 HB3 ALA 97 HB3 ALA 97 5.677 1.371 -0.387
829 H ALA 98 H ALA 98 9.801 1.884 -0.149
830 HA ALA 98 HA ALA 98 10.257 4.723 -0.162
831 HB1 ALA 98 HB1 ALA 98 11.035 3.336 1.695
832 HB2 ALA 98 HB2 ALA 98 12.375 4.187 0.925
833 HB3 ALA 98 HB3 ALA 98 12.116 2.474 0.600
834 H ALA 99 H ALA 99 10.749 2.229 -2.373
835 HA ALA 99 HA ALA 99 13.079 3.273 -3.677
836 HB1 ALA 99 HB1 ALA 99 11.004 1.333 -4.698
837 HB2 ALA 99 HB2 ALA 99 12.469 0.902 -3.818
838 HB3 ALA 99 HB3 ALA 99 12.588 1.636 -5.416
839 H PHE 100 H PHE 100 9.867 4.199 -3.521
840 HA PHE 100 HA PHE 100 10.087 5.755 -6.012
841 HB2 PHE 100 HB2 PHE 100 7.595 4.878 -4.532
842 HB3 PHE 100 HB3 PHE 100 7.618 5.883 -5.977
843 HD1 PHE 100 HD1 PHE 100 8.187 2.507 -4.653
844 HD2 PHE 100 HD2 PHE 100 7.968 4.940 -8.138
845 HE1 PHE 100 HE1 PHE 100 8.106 0.485 -6.055
846 HE2 PHE 100 HE2 PHE 100 7.888 2.926 -9.544
847 HZ PHE 100 HZ PHE 100 7.957 0.694 -8.506
848 H ASP 101 H ASP 101 8.512 7.791 -5.730
849 HA ASP 101 HA ASP 101 9.216 9.016 -3.150
850 HB2 ASP 101 HB2 ASP 101 9.013 10.248 -5.898
851 HB3 ASP 101 HB3 ASP 101 9.011 11.217 -4.428
852 HA PRO 102 HA PRO 102 4.679 9.027 -2.993
853 HB2 PRO 102 HB2 PRO 102 5.051 8.893 -0.120
854 HB3 PRO 102 HB3 PRO 102 4.319 7.702 -1.196
855 HG2 PRO 102 HG2 PRO 102 6.690 7.303 0.086
856 HG3 PRO 102 HG3 PRO 102 6.280 6.551 -1.466
857 HD2 PRO 102 HD2 PRO 102 7.973 8.958 -0.915
858 HD3 PRO 102 HD3 PRO 102 8.241 7.632 -2.069
859 H GLY 103 H GLY 103 7.149 10.969 -1.583
860 HA2 GLY 103 HA2 GLY 103 7.178 13.200 -1.006
861 HA3 GLY 103 HA3 GLY 103 5.524 13.324 -1.594
862 H ASP 104 H ASP 104 6.735 11.165 0.911
863 HA ASP 104 HA ASP 104 4.923 12.515 2.799
864 HB2 ASP 104 HB2 ASP 104 4.234 10.218 2.285
865 HB3 ASP 104 HB3 ASP 104 5.823 9.625 2.766
866 H ALA 105 H ALA 105 6.440 13.987 3.516
867 HA ALA 105 HA ALA 105 8.336 12.942 5.455
868 HB1 ALA 105 HB1 ALA 105 9.651 13.067 3.387
869 HB2 ALA 105 HB2 ALA 105 10.206 14.251 4.574
870 HB3 ALA 105 HB3 ALA 105 9.208 14.765 3.214
871 H GLY 106 H GLY 106 5.818 14.458 5.441
872 HA2 GLY 106 HA2 GLY 106 6.348 17.213 5.915
873 HA3 GLY 106 HA3 GLY 106 4.868 16.353 6.318
874 H GLY 107 H GLY 107 6.179 18.348 7.893
875 HA2 GLY 107 HA2 GLY 107 7.416 16.902 10.100
876 HA3 GLY 107 HA3 GLY 107 7.252 18.647 9.957
877 H LYS 108 H LYS 108 4.332 17.523 9.140
878 HA LYS 108 HA LYS 108 3.139 18.139 11.655
879 HB2 LYS 108 HB2 LYS 108 2.165 18.753 9.455
880 HB3 LYS 108 HB3 LYS 108 1.964 17.051 9.082
881 HG2 LYS 108 HG2 LYS 108 0.650 18.292 11.466
882 HG3 LYS 108 HG3 LYS 108 -0.071 18.371 9.858
883 HD2 LYS 108 HD2 LYS 108 0.627 15.892 11.419
884 HD3 LYS 108 HD3 LYS 108 -0.976 16.496 11.039
885 HE2 LYS 108 HE2 LYS 108 1.057 15.521 9.051
886 HE3 LYS 108 HE3 LYS 108 -0.366 14.634 9.587
887 HZ1 LYS 108 HZ1 LYS 108 -0.943 15.595 7.545
888 HZ2 LYS 108 HZ2 LYS 108 -0.246 17.088 7.933
889 HZ3 LYS 108 HZ3 LYS 108 -1.678 16.594 8.700
890 H LEU 109 H LEU 109 3.247 16.718 13.243
891 HA LEU 109 HA LEU 109 2.400 13.990 12.915
892 HB2 LEU 109 HB2 LEU 109 4.804 14.023 12.138
893 HB3 LEU 109 HB3 LEU 109 5.254 14.496 13.764
894 HG LEU 109 HG LEU 109 4.308 12.367 14.618
895 HD11 LEU 109 HD11 LEU 109 3.788 10.584 13.014
896 HD12 LEU 109 HD12 LEU 109 3.954 11.740 11.691
897 HD13 LEU 109 HD13 LEU 109 2.667 11.941 12.881
898 HD21 LEU 109 HD21 LEU 109 6.376 12.063 12.445
899 HD22 LEU 109 HD22 LEU 109 6.084 10.926 13.761
900 HD23 LEU 109 HD23 LEU 109 6.687 12.546 14.113
901 H GLU 110 H GLU 110 1.774 16.413 14.438
902 HA GLU 110 HA GLU 110 2.671 16.256 17.097
903 HB2 GLU 110 HB2 GLU 110 1.292 18.096 15.761
904 HB3 GLU 110 HB3 GLU 110 -0.075 17.266 16.487
905 HG2 GLU 110 HG2 GLU 110 2.235 18.444 18.017
906 HG3 GLU 110 HG3 GLU 110 0.682 19.233 17.764
907 H HIS 111 H HIS 111 2.320 14.755 18.537
908 HA HIS 111 HA HIS 111 -0.165 13.192 18.391
909 HB2 HIS 111 HB2 HIS 111 1.197 11.294 19.405
910 HB3 HIS 111 HB3 HIS 111 1.513 11.668 17.717
911 HD1 HIS 111 HD1 HIS 111 3.788 12.968 17.214
912 HD2 HIS 111 HD2 HIS 111 3.373 11.470 21.077
913 HE1 HIS 111 HE1 HIS 111 6.104 12.982 18.207
914 HE2 HIS 111 HE2 HIS 111 5.830 12.083 20.550
915 H HIS 112 H HIS 112 -1.350 14.100 19.899
916 HA HIS 112 HA HIS 112 -0.410 15.403 22.190
917 HB2 HIS 112 HB2 HIS 112 -2.632 15.756 21.113
918 HB3 HIS 112 HB3 HIS 112 -3.152 14.202 21.748
919 HD1 HIS 112 HD1 HIS 112 -2.453 17.730 22.754
920 HD2 HIS 112 HD2 HIS 112 -3.787 14.188 24.484
921 HE1 HIS 112 HE1 HIS 112 -3.365 18.373 25.010
922 HE2 HIS 112 HE2 HIS 112 -3.998 16.193 26.107
923 H HIS 113 H HIS 113 -2.304 12.383 22.130
924 HA HIS 113 HA HIS 113 -0.555 11.268 24.193
925 HB2 HIS 113 HB2 HIS 113 -2.484 12.368 25.344
926 HB3 HIS 113 HB3 HIS 113 -3.578 11.333 24.436
927 HD1 HIS 113 HD1 HIS 113 -4.166 9.161 25.489
928 HD2 HIS 113 HD2 HIS 113 -0.732 10.832 27.140
929 HE1 HIS 113 HE1 HIS 113 -3.548 7.676 27.428
930 HE2 HIS 113 HE2 HIS 113 -1.361 8.600 28.285
931 H HIS 114 H HIS 114 -0.688 8.938 24.310
932 HA HIS 114 HA HIS 114 -0.981 7.623 21.862
933 HB2 HIS 114 HB2 HIS 114 0.386 6.778 23.741
934 HB3 HIS 114 HB3 HIS 114 -1.084 6.432 24.642
935 HD1 HIS 114 HD1 HIS 114 -2.252 4.247 24.180
936 HD2 HIS 114 HD2 HIS 114 0.813 5.047 21.481
937 HE1 HIS 114 HE1 HIS 114 -1.918 2.125 22.884
938 HE2 HIS 114 HE2 HIS 114 0.109 2.551 21.452
939 H HIS 115 H HIS 115 -2.795 7.340 20.769
940 HA HIS 115 HA HIS 115 -5.329 7.131 22.201
941 HB2 HIS 115 HB2 HIS 115 -6.392 7.396 19.995
942 HB3 HIS 115 HB3 HIS 115 -5.272 8.706 20.339
943 HD1 HIS 115 HD1 HIS 115 -3.517 9.172 18.607
944 HD2 HIS 115 HD2 HIS 115 -5.341 5.467 18.073
945 HE1 HIS 115 HE1 HIS 115 -2.672 8.304 16.403
946 HE2 HIS 115 HE2 HIS 115 -3.941 6.161 16.014
947 H HIS 116 H HIS 116 -6.772 5.405 21.921
948 HA HIS 116 HA HIS 116 -5.919 3.067 20.442
949 HB2 HIS 116 HB2 HIS 116 -4.697 2.866 22.591
950 HB3 HIS 116 HB3 HIS 116 -6.230 2.945 23.452
951 HD1 HIS 116 HD1 HIS 116 -7.508 0.803 23.736
952 HD2 HIS 116 HD2 HIS 116 -4.344 0.459 21.053
953 HE1 HIS 116 HE1 HIS 116 -7.293 -1.654 23.240
954 HE2 HIS 116 HE2 HIS 116 -5.241 -1.851 21.796
Start of MODEL 5
1 H1 MET 1 H1 MET 1 -2.258 -10.452 15.201
2 H2 MET 1 H2 MET 1 -3.728 -9.686 15.543
3 H3 MET 1 H3 MET 1 -2.893 -9.297 14.125
4 HA MET 1 HA MET 1 -4.096 -11.928 14.769
5 HB2 MET 1 HB2 MET 1 -5.658 -9.985 14.217
6 HB3 MET 1 HB3 MET 1 -4.942 -9.988 12.613
7 HG2 MET 1 HG2 MET 1 -5.691 -12.279 12.271
8 HG3 MET 1 HG3 MET 1 -6.378 -12.301 13.893
9 HE1 MET 1 HE1 MET 1 -9.598 -12.250 11.702
10 HE2 MET 1 HE2 MET 1 -8.758 -13.027 13.043
11 HE3 MET 1 HE3 MET 1 -8.097 -13.130 11.410
12 H ALA 2 H ALA 2 -1.331 -11.032 13.840
13 HA ALA 2 HA ALA 2 -1.295 -12.197 11.142
14 HB1 ALA 2 HB1 ALA 2 0.952 -11.259 10.963
15 HB2 ALA 2 HB2 ALA 2 0.853 -10.684 12.628
16 HB3 ALA 2 HB3 ALA 2 -0.220 -10.013 11.399
17 H GLU 3 H GLU 3 -1.320 -13.369 14.048
18 HA GLU 3 HA GLU 3 1.164 -14.771 14.283
19 HB2 GLU 3 HB2 GLU 3 -1.398 -15.375 15.760
20 HB3 GLU 3 HB3 GLU 3 0.241 -15.741 16.268
21 HG2 GLU 3 HG2 GLU 3 -0.493 -13.921 17.585
22 HG3 GLU 3 HG3 GLU 3 0.641 -13.258 16.410
23 H LYS 4 H LYS 4 -1.225 -15.163 12.169
24 HA LYS 4 HA LYS 4 -1.760 -17.948 12.243
25 HB2 LYS 4 HB2 LYS 4 -2.664 -17.620 9.989
26 HB3 LYS 4 HB3 LYS 4 -3.231 -16.364 11.081
27 HG2 LYS 4 HG2 LYS 4 -1.544 -14.828 10.169
28 HG3 LYS 4 HG3 LYS 4 -1.026 -16.087 9.049
29 HD2 LYS 4 HD2 LYS 4 -2.497 -14.625 7.868
30 HD3 LYS 4 HD3 LYS 4 -3.359 -16.138 8.151
31 HE2 LYS 4 HE2 LYS 4 -4.488 -15.117 10.079
32 HE3 LYS 4 HE3 LYS 4 -3.647 -13.599 9.759
33 HZ1 LYS 4 HZ1 LYS 4 -4.721 -13.630 7.524
34 HZ2 LYS 4 HZ2 LYS 4 -5.801 -13.442 8.816
35 HZ3 LYS 4 HZ3 LYS 4 -5.659 -14.944 8.043
36 H ASN 5 H ASN 5 0.778 -15.975 11.011
37 HA ASN 5 HA ASN 5 2.552 -18.158 10.642
38 HB2 ASN 5 HB2 ASN 5 1.298 -18.429 8.527
39 HB3 ASN 5 HB3 ASN 5 1.636 -16.751 8.113
40 HD21 ASN 5 HD21 ASN 5 2.774 -17.175 6.273
41 HD22 ASN 5 HD22 ASN 5 4.314 -17.966 6.259
42 H ALA 6 H ALA 6 2.091 -15.065 8.994
43 HA ALA 6 HA ALA 6 4.005 -13.731 10.691
44 HB1 ALA 6 HB1 ALA 6 5.473 -14.777 9.029
45 HB2 ALA 6 HB2 ALA 6 5.451 -13.023 8.839
46 HB3 ALA 6 HB3 ALA 6 4.531 -14.043 7.733
47 H TYR 7 H TYR 7 4.191 -11.364 9.890
48 HA TYR 7 HA TYR 7 1.564 -10.354 9.462
49 HB2 TYR 7 HB2 TYR 7 3.997 -9.316 10.384
50 HB3 TYR 7 HB3 TYR 7 3.633 -8.404 8.922
51 HD1 TYR 7 HD1 TYR 7 0.591 -8.488 9.175
52 HD2 TYR 7 HD2 TYR 7 3.660 -7.613 11.988
53 HE1 TYR 7 HE1 TYR 7 -0.978 -7.082 10.445
54 HE2 TYR 7 HE2 TYR 7 2.103 -6.205 13.260
55 HH TYR 7 HH TYR 7 -1.231 -6.235 12.780
56 H THR 8 H THR 8 0.958 -11.356 7.507
57 HA THR 8 HA THR 8 2.265 -10.898 5.029
58 HB THR 8 HB THR 8 -0.692 -11.413 5.266
59 HG1 THR 8 HG1 THR 8 -0.291 -13.185 6.354
60 HG21 THR 8 HG21 THR 8 -0.251 -12.879 3.344
61 HG22 THR 8 HG22 THR 8 1.461 -12.463 3.429
62 HG23 THR 8 HG23 THR 8 0.272 -11.223 3.033
63 H VAL 9 H VAL 9 1.560 -9.454 3.305
64 HA VAL 9 HA VAL 9 1.245 -6.826 4.181
65 HB VAL 9 HB VAL 9 2.300 -7.290 2.062
66 HG11 VAL 9 HG11 VAL 9 1.022 -9.214 1.351
67 HG12 VAL 9 HG12 VAL 9 1.021 -7.984 0.087
68 HG13 VAL 9 HG13 VAL 9 -0.404 -8.207 1.103
69 HG21 VAL 9 HG21 VAL 9 -0.222 -5.682 1.689
70 HG22 VAL 9 HG22 VAL 9 1.199 -5.616 0.649
71 HG23 VAL 9 HG23 VAL 9 1.311 -5.092 2.328
72 H ALA 10 H ALA 10 -1.186 -9.068 2.881
73 HA ALA 10 HA ALA 10 -3.335 -7.262 2.802
74 HB1 ALA 10 HB1 ALA 10 -3.368 -9.473 1.725
75 HB2 ALA 10 HB2 ALA 10 -4.776 -9.207 2.751
76 HB3 ALA 10 HB3 ALA 10 -3.455 -10.230 3.315
77 H GLN 11 H GLN 11 -1.985 -9.172 5.403
78 HA GLN 11 HA GLN 11 -4.167 -8.660 7.209
79 HB2 GLN 11 HB2 GLN 11 -2.881 -10.755 7.312
80 HB3 GLN 11 HB3 GLN 11 -1.428 -9.846 7.702
81 HG2 GLN 11 HG2 GLN 11 -2.336 -10.847 9.689
82 HG3 GLN 11 HG3 GLN 11 -2.478 -9.093 9.788
83 HE21 GLN 11 HE21 GLN 11 -4.511 -8.144 9.714
84 HE22 GLN 11 HE22 GLN 11 -5.963 -9.063 9.916
85 H LEU 12 H LEU 12 -0.907 -7.466 6.664
86 HA LEU 12 HA LEU 12 -0.634 -5.940 9.008
87 HB2 LEU 12 HB2 LEU 12 1.057 -6.634 7.083
88 HB3 LEU 12 HB3 LEU 12 0.630 -5.057 6.450
89 HG LEU 12 HG LEU 12 1.766 -5.524 9.211
90 HD11 LEU 12 HD11 LEU 12 3.373 -6.150 7.500
91 HD12 LEU 12 HD12 LEU 12 3.856 -4.654 8.299
92 HD13 LEU 12 HD13 LEU 12 3.133 -4.601 6.691
93 HD21 LEU 12 HD21 LEU 12 1.403 -2.987 7.616
94 HD22 LEU 12 HD22 LEU 12 2.171 -3.115 9.198
95 HD23 LEU 12 HD23 LEU 12 0.452 -3.469 9.023
96 H ALA 13 H ALA 13 -1.567 -4.963 5.714
97 HA ALA 13 HA ALA 13 -2.064 -2.268 6.344
98 HB1 ALA 13 HB1 ALA 13 -3.249 -3.920 4.118
99 HB2 ALA 13 HB2 ALA 13 -1.697 -3.083 4.065
100 HB3 ALA 13 HB3 ALA 13 -3.193 -2.158 4.196
101 H ASP 14 H ASP 14 -4.118 -5.119 6.431
102 HA ASP 14 HA ASP 14 -6.576 -3.730 6.668
103 HB2 ASP 14 HB2 ASP 14 -5.927 -6.310 6.188
104 HB3 ASP 14 HB3 ASP 14 -6.381 -6.418 7.888
105 H GLU 15 H GLU 15 -4.381 -5.194 9.031
106 HA GLU 15 HA GLU 15 -5.983 -4.499 11.292
107 HB2 GLU 15 HB2 GLU 15 -4.166 -6.351 11.058
108 HB3 GLU 15 HB3 GLU 15 -3.029 -5.060 11.428
109 HG2 GLU 15 HG2 GLU 15 -4.261 -4.628 13.525
110 HG3 GLU 15 HG3 GLU 15 -5.303 -6.001 13.161
111 H TYR 16 H TYR 16 -3.433 -3.000 9.476
112 HA TYR 16 HA TYR 16 -2.578 -0.987 11.207
113 HB2 TYR 16 HB2 TYR 16 -1.682 -1.694 8.904
114 HB3 TYR 16 HB3 TYR 16 -2.915 -0.640 8.230
115 HD1 TYR 16 HD1 TYR 16 0.129 -0.727 10.315
116 HD2 TYR 16 HD2 TYR 16 -2.600 1.718 8.151
117 HE1 TYR 16 HE1 TYR 16 1.686 1.165 10.500
118 HE2 TYR 16 HE2 TYR 16 -1.050 3.621 8.335
119 HH TYR 16 HH TYR 16 2.186 3.250 9.384
120 H PHE 17 H PHE 17 -5.387 -1.196 9.123
121 HA PHE 17 HA PHE 17 -6.316 1.416 9.134
122 HB2 PHE 17 HB2 PHE 17 -7.335 -0.314 7.769
123 HB3 PHE 17 HB3 PHE 17 -7.858 -1.188 9.201
124 HD1 PHE 17 HD2 PHE 17 -9.768 -0.413 10.504
125 HD2 PHE 17 HD1 PHE 17 -8.515 1.633 6.988
126 HE1 PHE 17 HE2 PHE 17 -11.914 0.782 10.441
127 HE2 PHE 17 HE1 PHE 17 -10.663 2.831 6.922
128 HZ PHE 17 HZ PHE 17 -12.367 2.406 8.648
129 H GLU 18 H GLU 18 -6.848 -1.143 11.507
130 HA GLU 18 HA GLU 18 -8.674 0.275 13.127
131 HB2 GLU 18 HB2 GLU 18 -6.894 -2.096 13.682
132 HB3 GLU 18 HB3 GLU 18 -8.070 -1.486 14.836
133 HG2 GLU 18 HG2 GLU 18 -8.728 -2.467 12.068
134 HG3 GLU 18 HG3 GLU 18 -8.876 -3.420 13.544
135 H ARG 19 H ARG 19 -5.273 0.485 12.828
136 HA ARG 19 HA ARG 19 -4.872 1.337 15.577
137 HB2 ARG 19 HB2 ARG 19 -2.823 1.292 13.366
138 HB3 ARG 19 HB3 ARG 19 -2.536 1.300 15.100
139 HG2 ARG 19 HG2 ARG 19 -3.758 -0.955 13.522
140 HG3 ARG 19 HG3 ARG 19 -2.106 -0.885 14.134
141 HD2 ARG 19 HD2 ARG 19 -2.982 -0.785 16.430
142 HD3 ARG 19 HD3 ARG 19 -4.624 -0.902 15.795
143 HE ARG 19 HE ARG 19 -3.173 -3.067 14.804
144 HH11 ARG 19 HH11 ARG 19 -4.382 -1.885 17.876
145 HH12 ARG 19 HH12 ARG 19 -4.438 -3.471 18.595
146 HH21 ARG 19 HH21 ARG 19 -3.271 -5.151 15.748
147 HH22 ARG 19 HH22 ARG 19 -3.831 -5.311 17.388
148 H MET 20 H MET 20 -4.193 2.704 12.344
149 HA MET 20 HA MET 20 -3.612 5.270 13.564
150 HB2 MET 20 HB2 MET 20 -3.314 4.147 10.805
151 HB3 MET 20 HB3 MET 20 -3.193 5.878 11.075
152 HG2 MET 20 HG2 MET 20 -1.008 4.867 11.040
153 HG3 MET 20 HG3 MET 20 -1.355 5.516 12.635
154 HE1 MET 20 HE1 MET 20 1.062 3.575 12.171
155 HE2 MET 20 HE2 MET 20 0.877 2.460 13.526
156 HE3 MET 20 HE3 MET 20 0.596 4.183 13.762
157 H ILE 21 H ILE 21 -6.343 3.817 12.180
158 HA ILE 21 HA ILE 21 -7.501 6.444 11.484
159 HB ILE 21 HB ILE 21 -8.507 3.752 10.545
160 HG12 ILE 21 HG12 ILE 21 -6.597 5.679 9.198
161 HG13 ILE 21 HG13 ILE 21 -6.198 4.073 9.792
162 HG21 ILE 21 HG21 ILE 21 -8.976 6.571 9.559
163 HG22 ILE 21 HG22 ILE 21 -10.142 5.556 10.408
164 HG23 ILE 21 HG23 ILE 21 -9.597 5.108 8.792
165 HD11 ILE 21 HD11 ILE 21 -7.669 3.086 8.136
166 HD12 ILE 21 HD12 ILE 21 -6.450 4.111 7.378
167 HD13 ILE 21 HD13 ILE 21 -8.107 4.689 7.555
168 H ALA 22 H ALA 22 -7.280 5.078 14.140
169 HA ALA 22 HA ALA 22 -10.148 5.149 14.820
170 HB1 ALA 22 HB1 ALA 22 -9.098 3.014 15.375
171 HB2 ALA 22 HB2 ALA 22 -9.586 3.879 16.832
172 HB3 ALA 22 HB3 ALA 22 -7.890 3.853 16.350
173 H GLY 23 H GLY 23 -10.842 6.778 16.066
174 HA2 GLY 23 HA2 GLY 23 -10.077 8.102 18.145
175 HA3 GLY 23 HA3 GLY 23 -8.813 8.664 17.060
176 H ARG 24 H ARG 24 -9.414 9.928 15.226
177 HA ARG 24 HA ARG 24 -12.136 10.909 15.051
178 HB2 ARG 24 HB2 ARG 24 -10.821 12.335 16.746
179 HB3 ARG 24 HB3 ARG 24 -9.872 12.883 15.375
180 HG2 ARG 24 HG2 ARG 24 -12.862 13.167 15.502
181 HG3 ARG 24 HG3 ARG 24 -11.749 14.388 16.111
182 HD2 ARG 24 HD2 ARG 24 -10.763 14.620 13.894
183 HD3 ARG 24 HD3 ARG 24 -11.832 13.363 13.277
184 HE ARG 24 HE ARG 24 -13.224 15.582 14.480
185 HH11 ARG 24 HH11 ARG 24 -11.811 14.316 11.536
186 HH12 ARG 24 HH12 ARG 24 -12.737 15.348 10.488
187 HH21 ARG 24 HH21 ARG 24 -14.449 16.940 13.108
188 HH22 ARG 24 HH22 ARG 24 -14.251 16.824 11.388
189 H TRP 25 H TRP 25 -12.452 10.446 12.968
190 HA TRP 25 HA TRP 25 -10.470 11.353 11.008
191 HB2 TRP 25 HB2 TRP 25 -10.501 9.213 9.839
192 HB3 TRP 25 HB3 TRP 25 -9.986 8.972 11.498
193 HD1 TRP 25 HD1 TRP 25 -12.364 7.707 8.997
194 HE1 TRP 25 HE1 TRP 25 -14.058 6.097 10.063
195 HE3 TRP 25 HE3 TRP 25 -11.409 8.647 13.928
196 HZ2 TRP 25 HZ2 TRP 25 -14.880 5.315 12.635
197 HZ3 TRP 25 HZ3 TRP 25 -12.692 7.422 15.627
198 HH2 TRP 25 HH2 TRP 25 -14.394 5.791 14.994
199 H LYS 26 H LYS 26 -13.720 10.040 11.543
200 HA LYS 26 HA LYS 26 -15.688 10.251 10.475
201 HB2 LYS 26 HB2 LYS 26 -14.376 12.836 9.789
202 HB3 LYS 26 HB3 LYS 26 -15.861 12.404 8.952
203 HG2 LYS 26 HG2 LYS 26 -15.497 12.625 11.934
204 HG3 LYS 26 HG3 LYS 26 -16.347 13.770 10.891
205 HD2 LYS 26 HD2 LYS 26 -17.958 12.018 10.293
206 HD3 LYS 26 HD3 LYS 26 -17.105 10.879 11.335
207 HE2 LYS 26 HE2 LYS 26 -19.024 11.692 12.509
208 HE3 LYS 26 HE3 LYS 26 -17.579 12.368 13.254
209 HZ1 LYS 26 HZ1 LYS 26 -17.971 14.441 12.105
210 HZ2 LYS 26 HZ2 LYS 26 -19.354 14.012 12.983
211 HZ3 LYS 26 HZ3 LYS 26 -19.315 13.787 11.303
212 H HIS 27 H HIS 27 -16.391 9.003 8.970
213 HA HIS 27 HA HIS 27 -16.656 7.873 7.028
214 HB2 HIS 27 HB2 HIS 27 -15.152 10.240 5.957
215 HB3 HIS 27 HB3 HIS 27 -15.510 8.864 4.919
216 HD1 HIS 27 HD1 HIS 27 -16.956 11.966 6.167
217 HD2 HIS 27 HD2 HIS 27 -18.372 8.331 4.721
218 HE1 HIS 27 HE1 HIS 27 -19.364 12.367 5.553
219 HE2 HIS 27 HE2 HIS 27 -20.240 10.112 4.841
220 HA PRO 28 HA PRO 28 -12.643 5.773 7.710
221 HB2 PRO 28 HB2 PRO 28 -13.690 3.353 8.295
222 HB3 PRO 28 HB3 PRO 28 -13.560 4.638 9.500
223 HG2 PRO 28 HG2 PRO 28 -15.943 3.761 7.918
224 HG3 PRO 28 HG3 PRO 28 -15.840 4.215 9.629
225 HD2 PRO 28 HD2 PRO 28 -16.744 5.891 7.668
226 HD3 PRO 28 HD3 PRO 28 -15.979 6.455 9.166
227 H ASN 29 H ASN 29 -15.414 5.137 5.728
228 HA ASN 29 HA ASN 29 -14.433 2.861 4.349
229 HB2 ASN 29 HB2 ASN 29 -16.299 3.280 2.771
230 HB3 ASN 29 HB3 ASN 29 -16.814 3.269 4.453
231 HD21 ASN 29 HD21 ASN 29 -17.961 4.485 2.008
232 HD22 ASN 29 HD22 ASN 29 -18.193 6.159 2.408
233 H ILE 30 H ILE 30 -14.286 6.317 3.714
234 HA ILE 30 HA ILE 30 -13.464 6.201 1.036
235 HB ILE 30 HB ILE 30 -12.808 8.300 3.107
236 HG12 ILE 30 HG12 ILE 30 -15.028 8.184 1.052
237 HG13 ILE 30 HG13 ILE 30 -15.229 7.907 2.779
238 HG21 ILE 30 HG21 ILE 30 -12.457 9.795 1.189
239 HG22 ILE 30 HG22 ILE 30 -12.684 8.428 0.098
240 HG23 ILE 30 HG23 ILE 30 -11.309 8.453 1.203
241 HD11 ILE 30 HD11 ILE 30 -15.943 10.137 2.168
242 HD12 ILE 30 HD12 ILE 30 -14.352 10.479 1.486
243 HD13 ILE 30 HD13 ILE 30 -14.528 10.206 3.219
244 H VAL 31 H VAL 31 -11.530 6.370 4.021
245 HA VAL 31 HA VAL 31 -9.067 6.105 2.571
246 HB VAL 31 HB VAL 31 -9.119 7.364 4.663
247 HG11 VAL 31 HG11 VAL 31 -9.719 4.730 5.987
248 HG12 VAL 31 HG12 VAL 31 -10.813 6.107 5.857
249 HG13 VAL 31 HG13 VAL 31 -9.339 6.239 6.816
250 HG21 VAL 31 HG21 VAL 31 -7.157 6.338 5.753
251 HG22 VAL 31 HG22 VAL 31 -7.007 6.411 3.997
252 HG23 VAL 31 HG23 VAL 31 -7.412 4.886 4.786
253 H ARG 32 H ARG 32 -11.342 3.966 4.087
254 HA ARG 32 HA ARG 32 -9.750 1.677 4.385
255 HB2 ARG 32 HB2 ARG 32 -12.001 1.880 5.342
256 HB3 ARG 32 HB3 ARG 32 -12.697 1.877 3.730
257 HG2 ARG 32 HG2 ARG 32 -12.991 -0.283 4.724
258 HG3 ARG 32 HG3 ARG 32 -11.839 -0.414 3.395
259 HD2 ARG 32 HD2 ARG 32 -9.991 -0.459 4.947
260 HD3 ARG 32 HD3 ARG 32 -11.079 -0.165 6.305
261 HE ARG 32 HE ARG 32 -11.943 -2.471 4.977
262 HH11 ARG 32 HH11 ARG 32 -9.225 -1.410 6.935
263 HH12 ARG 32 HH12 ARG 32 -8.870 -3.002 7.522
264 HH21 ARG 32 HH21 ARG 32 -11.467 -4.557 5.759
265 HH22 ARG 32 HH22 ARG 32 -10.117 -4.791 6.842
266 H SER 33 H SER 33 -11.521 2.954 1.609
267 HA SER 33 HA SER 33 -11.227 0.796 -0.134
268 HB2 SER 33 HB2 SER 33 -11.292 3.748 -0.792
269 HB3 SER 33 HB3 SER 33 -11.574 2.437 -1.939
270 HG SER 33 HG SER 33 -13.240 1.864 -0.130
271 H ARG 34 H ARG 34 -9.013 3.444 0.624
272 HA ARG 34 HA ARG 34 -7.059 2.885 -1.319
273 HB2 ARG 34 HB2 ARG 34 -7.096 4.305 1.296
274 HB3 ARG 34 HB3 ARG 34 -5.526 3.802 0.689
275 HG2 ARG 34 HG2 ARG 34 -5.960 6.076 0.049
276 HG3 ARG 34 HG3 ARG 34 -5.952 5.054 -1.385
277 HD2 ARG 34 HD2 ARG 34 -8.311 5.138 -1.564
278 HD3 ARG 34 HD3 ARG 34 -8.475 5.837 0.047
279 HE ARG 34 HE ARG 34 -7.064 7.738 -1.117
280 HH11 ARG 34 HH11 ARG 34 -9.700 5.894 -2.506
281 HH12 ARG 34 HH12 ARG 34 -10.327 7.235 -3.424
282 HH21 ARG 34 HH21 ARG 34 -7.843 9.493 -2.340
283 HH22 ARG 34 HH22 ARG 34 -9.245 9.280 -3.352
284 H ILE 35 H ILE 35 -7.610 1.609 1.911
285 HA ILE 35 HA ILE 35 -5.169 0.139 2.001
286 HB ILE 35 HB ILE 35 -7.626 0.004 3.744
287 HG12 ILE 35 HG12 ILE 35 -4.915 1.302 4.112
288 HG13 ILE 35 HG13 ILE 35 -6.430 2.143 3.809
289 HG21 ILE 35 HG21 ILE 35 -6.425 -2.113 3.820
290 HG22 ILE 35 HG22 ILE 35 -6.237 -1.230 5.335
291 HG23 ILE 35 HG23 ILE 35 -4.920 -1.260 4.161
292 HD11 ILE 35 HD11 ILE 35 -7.291 1.394 5.949
293 HD12 ILE 35 HD12 ILE 35 -5.770 2.266 6.148
294 HD13 ILE 35 HD13 ILE 35 -5.797 0.506 6.250
295 H GLU 36 H GLU 36 -8.587 -0.850 1.521
296 HA GLU 36 HA GLU 36 -7.702 -3.595 1.343
297 HB2 GLU 36 HB2 GLU 36 -10.115 -4.141 1.084
298 HB3 GLU 36 HB3 GLU 36 -9.714 -3.283 2.560
299 HG2 GLU 36 HG2 GLU 36 -11.714 -2.341 1.829
300 HG3 GLU 36 HG3 GLU 36 -10.475 -1.180 1.367
301 H LYS 37 H LYS 37 -8.303 -1.078 -0.898
302 HA LYS 37 HA LYS 37 -8.507 -3.065 -3.052
303 HB2 LYS 37 HB2 LYS 37 -10.394 -1.598 -3.091
304 HB3 LYS 37 HB3 LYS 37 -9.370 -0.175 -2.972
305 HG2 LYS 37 HG2 LYS 37 -8.882 -1.917 -5.299
306 HG3 LYS 37 HG3 LYS 37 -10.429 -1.068 -5.271
307 HD2 LYS 37 HD2 LYS 37 -9.396 1.037 -5.208
308 HD3 LYS 37 HD3 LYS 37 -7.839 0.352 -4.745
309 HE2 LYS 37 HE2 LYS 37 -7.610 -0.663 -6.944
310 HE3 LYS 37 HE3 LYS 37 -9.196 -0.048 -7.408
311 HZ1 LYS 37 HZ1 LYS 37 -7.214 1.283 -8.163
312 HZ2 LYS 37 HZ2 LYS 37 -6.997 1.744 -6.545
313 HZ3 LYS 37 HZ3 LYS 37 -8.428 2.150 -7.367
314 H ASP 38 H ASP 38 -6.943 0.086 -2.363
315 HA ASP 38 HA ASP 38 -5.255 -0.174 -4.673
316 HB2 ASP 38 HB2 ASP 38 -5.099 1.802 -2.388
317 HB3 ASP 38 HB3 ASP 38 -4.183 1.900 -3.886
318 H ILE 39 H ILE 39 -4.698 -0.350 -1.161
319 HA ILE 39 HA ILE 39 -1.932 -0.993 -1.420
320 HB ILE 39 HB ILE 39 -3.755 -1.523 0.933
321 HG12 ILE 39 HG12 ILE 39 -3.761 0.847 0.346
322 HG13 ILE 39 HG13 ILE 39 -2.869 0.595 1.840
323 HG21 ILE 39 HG21 ILE 39 -0.748 -1.344 0.769
324 HG22 ILE 39 HG22 ILE 39 -1.694 -2.810 1.036
325 HG23 ILE 39 HG23 ILE 39 -1.687 -1.532 2.250
326 HD11 ILE 39 HD11 ILE 39 -0.769 0.782 0.625
327 HD12 ILE 39 HD12 ILE 39 -1.771 2.214 0.391
328 HD13 ILE 39 HD13 ILE 39 -1.653 1.001 -0.884
329 H LYS 40 H LYS 40 -4.883 -2.895 -1.221
330 HA LYS 40 HA LYS 40 -3.258 -5.321 -1.613
331 HB2 LYS 40 HB2 LYS 40 -6.083 -5.216 -0.541
332 HB3 LYS 40 HB3 LYS 40 -5.043 -6.627 -0.641
333 HG2 LYS 40 HG2 LYS 40 -3.516 -5.556 0.992
334 HG3 LYS 40 HG3 LYS 40 -4.679 -4.237 1.151
335 HD2 LYS 40 HD2 LYS 40 -5.146 -7.150 1.803
336 HD3 LYS 40 HD3 LYS 40 -4.989 -5.823 2.956
337 HE2 LYS 40 HE2 LYS 40 -7.022 -4.805 2.069
338 HE3 LYS 40 HE3 LYS 40 -7.173 -6.109 0.893
339 HZ1 LYS 40 HZ1 LYS 40 -7.280 -7.655 2.858
340 HZ2 LYS 40 HZ2 LYS 40 -8.611 -6.628 2.669
341 HZ3 LYS 40 HZ3 LYS 40 -7.443 -6.285 3.845
342 HA PRO 41 HA PRO 41 -5.660 -4.578 -5.530
343 HB2 PRO 41 HB2 PRO 41 -3.209 -5.525 -6.826
344 HB3 PRO 41 HB3 PRO 41 -4.084 -4.011 -7.068
345 HG2 PRO 41 HG2 PRO 41 -1.673 -4.105 -5.861
346 HG3 PRO 41 HG3 PRO 41 -2.911 -2.917 -5.417
347 HD2 PRO 41 HD2 PRO 41 -2.150 -5.468 -4.042
348 HD3 PRO 41 HD3 PRO 41 -2.533 -3.881 -3.340
349 H ALA 42 H ALA 42 -3.198 -7.110 -5.187
350 HA ALA 42 HA ALA 42 -5.162 -9.214 -5.318
351 HB1 ALA 42 HB1 ALA 42 -4.178 -10.341 -7.258
352 HB2 ALA 42 HB2 ALA 42 -3.081 -8.980 -7.497
353 HB3 ALA 42 HB3 ALA 42 -4.820 -8.760 -7.702
354 H ILE 43 H ILE 43 -1.785 -8.294 -5.480
355 HA ILE 43 HA ILE 43 -0.644 -10.512 -4.187
356 HB ILE 43 HB ILE 43 1.141 -8.741 -3.543
357 HG12 ILE 43 HG12 ILE 43 -0.529 -7.147 -5.505
358 HG13 ILE 43 HG13 ILE 43 -0.405 -6.807 -3.785
359 HG21 ILE 43 HG21 ILE 43 1.380 -10.332 -5.377
360 HG22 ILE 43 HG22 ILE 43 2.037 -8.757 -5.820
361 HG23 ILE 43 HG23 ILE 43 0.463 -9.260 -6.437
362 HD11 ILE 43 HD11 ILE 43 0.993 -5.314 -5.072
363 HD12 ILE 43 HD12 ILE 43 1.835 -6.688 -5.790
364 HD13 ILE 43 HD13 ILE 43 1.987 -6.364 -4.062
365 H GLY 44 H GLY 44 -2.164 -10.962 -2.500
366 HA2 GLY 44 HA2 GLY 44 -2.047 -9.074 -0.231
367 HA3 GLY 44 HA3 GLY 44 -3.383 -10.175 -0.536
368 H SER 45 H SER 45 -2.028 -12.519 -1.054
369 HA SER 45 HA SER 45 -1.042 -13.145 1.628
370 HB2 SER 45 HB2 SER 45 -1.847 -15.014 -0.614
371 HB3 SER 45 HB3 SER 45 -1.525 -15.461 1.062
372 HG SER 45 HG SER 45 -3.715 -14.103 -0.046
373 H LEU 46 H LEU 46 0.415 -11.893 -0.767
374 HA LEU 46 HA LEU 46 2.571 -13.835 -1.147
375 HB2 LEU 46 HB2 LEU 46 1.526 -12.565 -3.072
376 HB3 LEU 46 HB3 LEU 46 2.245 -11.111 -2.410
377 HG LEU 46 HG LEU 46 4.485 -12.080 -2.728
378 HD11 LEU 46 HD11 LEU 46 2.985 -14.358 -4.013
379 HD12 LEU 46 HD12 LEU 46 3.941 -14.437 -2.533
380 HD13 LEU 46 HD13 LEU 46 4.731 -14.122 -4.078
381 HD21 LEU 46 HD21 LEU 46 2.799 -12.119 -5.224
382 HD22 LEU 46 HD22 LEU 46 4.548 -11.912 -5.149
383 HD23 LEU 46 HD23 LEU 46 3.484 -10.680 -4.471
384 H LYS 47 H LYS 47 2.063 -12.482 1.367
385 HA LYS 47 HA LYS 47 3.042 -11.361 3.073
386 HB2 LYS 47 HB2 LYS 47 5.535 -12.305 1.662
387 HB3 LYS 47 HB3 LYS 47 5.488 -11.675 3.301
388 HG2 LYS 47 HG2 LYS 47 3.770 -13.569 3.713
389 HG3 LYS 47 HG3 LYS 47 4.449 -14.263 2.238
390 HD2 LYS 47 HD2 LYS 47 5.917 -13.577 4.783
391 HD3 LYS 47 HD3 LYS 47 5.623 -15.183 4.121
392 HE2 LYS 47 HE2 LYS 47 7.005 -14.596 2.164
393 HE3 LYS 47 HE3 LYS 47 7.330 -13.025 2.888
394 HZ1 LYS 47 HZ1 LYS 47 8.160 -15.682 3.931
395 HZ2 LYS 47 HZ2 LYS 47 8.328 -14.238 4.801
396 HZ3 LYS 47 HZ3 LYS 47 9.167 -14.449 3.344
397 H VAL 48 H VAL 48 4.826 -9.739 3.709
398 HA VAL 48 HA VAL 48 4.793 -7.490 1.865
399 HB VAL 48 HB VAL 48 6.231 -7.670 4.517
400 HG11 VAL 48 HG11 VAL 48 6.931 -5.825 3.101
401 HG12 VAL 48 HG12 VAL 48 6.025 -5.229 4.491
402 HG13 VAL 48 HG13 VAL 48 5.254 -5.315 2.907
403 HG21 VAL 48 HG21 VAL 48 4.269 -6.597 5.518
404 HG22 VAL 48 HG22 VAL 48 3.881 -8.191 4.871
405 HG23 VAL 48 HG23 VAL 48 3.412 -6.740 3.983
406 H GLU 49 H GLU 49 6.780 -10.092 2.780
407 HA GLU 49 HA GLU 49 9.296 -8.941 1.986
408 HB2 GLU 49 HB2 GLU 49 9.140 -10.549 3.821
409 HB3 GLU 49 HB3 GLU 49 8.507 -11.763 2.723
410 HG2 GLU 49 HG2 GLU 49 10.642 -11.702 1.486
411 HG3 GLU 49 HG3 GLU 49 11.269 -10.574 2.690
412 H ASP 50 H ASP 50 6.800 -10.874 0.523
413 HA ASP 50 HA ASP 50 8.550 -11.641 -1.680
414 HB2 ASP 50 HB2 ASP 50 5.918 -12.596 -0.675
415 HB3 ASP 50 HB3 ASP 50 6.274 -12.823 -2.379
416 H VAL 51 H VAL 51 6.220 -9.262 -0.927
417 HA VAL 51 HA VAL 51 5.505 -8.746 -3.657
418 HB VAL 51 HB VAL 51 3.902 -8.090 -1.984
419 HG11 VAL 51 HG11 VAL 51 4.314 -6.270 -0.394
420 HG12 VAL 51 HG12 VAL 51 6.005 -6.230 -0.896
421 HG13 VAL 51 HG13 VAL 51 5.356 -7.662 -0.096
422 HG21 VAL 51 HG21 VAL 51 3.533 -5.738 -2.611
423 HG22 VAL 51 HG22 VAL 51 3.929 -6.761 -3.994
424 HG23 VAL 51 HG23 VAL 51 5.153 -5.692 -3.306
425 H LYS 52 H LYS 52 7.524 -8.690 -4.607
426 HA LYS 52 HA LYS 52 9.592 -6.884 -3.907
427 HB2 LYS 52 HB2 LYS 52 9.176 -7.973 -6.673
428 HB3 LYS 52 HB3 LYS 52 10.687 -7.654 -5.838
429 HG2 LYS 52 HG2 LYS 52 8.760 -9.894 -5.255
430 HG3 LYS 52 HG3 LYS 52 10.332 -10.033 -6.043
431 HD2 LYS 52 HD2 LYS 52 11.411 -9.237 -3.995
432 HD3 LYS 52 HD3 LYS 52 9.832 -9.122 -3.219
433 HE2 LYS 52 HE2 LYS 52 9.511 -11.513 -3.446
434 HE3 LYS 52 HE3 LYS 52 11.037 -11.656 -4.316
435 HZ1 LYS 52 HZ1 LYS 52 10.781 -10.715 -1.511
436 HZ2 LYS 52 HZ2 LYS 52 12.226 -10.996 -2.358
437 HZ3 LYS 52 HZ3 LYS 52 11.206 -12.294 -1.964
438 HA PRO 53 HA PRO 53 8.492 -2.984 -5.742
439 HB2 PRO 53 HB2 PRO 53 11.036 -3.196 -7.281
440 HB3 PRO 53 HB3 PRO 53 10.439 -1.877 -6.266
441 HG2 PRO 53 HG2 PRO 53 12.349 -3.496 -5.376
442 HG3 PRO 53 HG3 PRO 53 11.058 -2.938 -4.297
443 HD2 PRO 53 HD2 PRO 53 11.421 -5.602 -5.597
444 HD3 PRO 53 HD3 PRO 53 10.785 -5.206 -3.988
445 H ARG 54 H ARG 54 9.633 -5.561 -7.858
446 HA ARG 54 HA ARG 54 8.819 -4.550 -10.324
447 HB2 ARG 54 HB2 ARG 54 8.702 -6.896 -11.080
448 HB3 ARG 54 HB3 ARG 54 10.169 -6.562 -10.172
449 HG2 ARG 54 HG2 ARG 54 9.479 -7.805 -8.348
450 HG3 ARG 54 HG3 ARG 54 7.778 -7.712 -8.803
451 HD2 ARG 54 HD2 ARG 54 8.746 -9.950 -9.161
452 HD3 ARG 54 HD3 ARG 54 8.139 -9.222 -10.646
453 HE ARG 54 HE ARG 54 10.826 -8.586 -10.521
454 HH11 ARG 54 HH11 ARG 54 8.907 -11.514 -10.616
455 HH12 ARG 54 HH12 ARG 54 10.120 -12.434 -11.461
456 HH21 ARG 54 HH21 ARG 54 12.398 -9.772 -11.671
457 HH22 ARG 54 HH22 ARG 54 12.093 -11.427 -12.088
458 H HIS 55 H HIS 55 6.948 -6.031 -7.756
459 HA HIS 55 HA HIS 55 4.566 -6.337 -9.356
460 HB2 HIS 55 HB2 HIS 55 4.815 -6.341 -6.337
461 HB3 HIS 55 HB3 HIS 55 3.444 -6.922 -7.273
462 HD1 HIS 55 HD1 HIS 55 4.257 -9.005 -9.032
463 HD2 HIS 55 HD2 HIS 55 6.416 -8.318 -5.545
464 HE1 HIS 55 HE1 HIS 55 5.576 -11.113 -8.600
465 HE2 HIS 55 HE2 HIS 55 7.024 -10.585 -6.631
466 H ILE 56 H ILE 56 5.935 -4.032 -7.144
467 HA ILE 56 HA ILE 56 3.695 -2.367 -6.787
468 HB ILE 56 HB ILE 56 6.622 -1.614 -6.683
469 HG12 ILE 56 HG12 ILE 56 6.122 -3.487 -5.190
470 HG13 ILE 56 HG13 ILE 56 6.440 -2.025 -4.263
471 HG21 ILE 56 HG21 ILE 56 5.188 0.338 -6.802
472 HG22 ILE 56 HG22 ILE 56 5.885 0.188 -5.190
473 HG23 ILE 56 HG23 ILE 56 4.207 -0.276 -5.471
474 HD11 ILE 56 HD11 ILE 56 4.030 -1.714 -3.956
475 HD12 ILE 56 HD12 ILE 56 4.590 -3.258 -3.316
476 HD13 ILE 56 HD13 ILE 56 3.735 -3.201 -4.856
477 H ASP 57 H ASP 57 6.304 -2.378 -9.177
478 HA ASP 57 HA ASP 57 5.728 0.040 -10.462
479 HB2 ASP 57 HB2 ASP 57 7.782 -1.233 -10.883
480 HB3 ASP 57 HB3 ASP 57 6.847 -2.521 -11.633
481 H ASP 58 H ASP 58 4.412 -3.181 -10.861
482 HA ASP 58 HA ASP 58 2.886 -2.601 -13.192
483 HB2 ASP 58 HB2 ASP 58 3.493 -4.891 -12.718
484 HB3 ASP 58 HB3 ASP 58 2.656 -4.836 -11.169
485 H VAL 59 H VAL 59 2.067 -2.794 -9.734
486 HA VAL 59 HA VAL 59 -0.694 -2.231 -10.193
487 HB VAL 59 HB VAL 59 -0.909 -1.999 -7.765
488 HG11 VAL 59 HG11 VAL 59 -0.232 -4.265 -7.154
489 HG12 VAL 59 HG12 VAL 59 0.776 -4.353 -8.598
490 HG13 VAL 59 HG13 VAL 59 -0.976 -4.217 -8.753
491 HG21 VAL 59 HG21 VAL 59 2.088 -2.328 -7.700
492 HG22 VAL 59 HG22 VAL 59 1.020 -2.353 -6.297
493 HG23 VAL 59 HG23 VAL 59 1.186 -0.879 -7.252
494 H LEU 60 H LEU 60 2.128 -0.246 -9.476
495 HA LEU 60 HA LEU 60 0.763 2.139 -8.861
496 HB2 LEU 60 HB2 LEU 60 3.472 1.644 -10.075
497 HB3 LEU 60 HB3 LEU 60 2.874 3.262 -9.766
498 HG LEU 60 HG LEU 60 3.361 1.119 -7.695
499 HD11 LEU 60 HD11 LEU 60 5.124 2.613 -6.918
500 HD12 LEU 60 HD12 LEU 60 4.776 3.724 -8.241
501 HD13 LEU 60 HD13 LEU 60 5.402 2.113 -8.586
502 HD21 LEU 60 HD21 LEU 60 2.800 2.814 -6.048
503 HD22 LEU 60 HD22 LEU 60 1.432 2.527 -7.122
504 HD23 LEU 60 HD23 LEU 60 2.429 3.965 -7.329
505 H LYS 61 H LYS 61 1.941 0.878 -11.973
506 HA LYS 61 HA LYS 61 1.104 2.987 -13.574
507 HB2 LYS 61 HB2 LYS 61 2.578 1.104 -14.243
508 HB3 LYS 61 HB3 LYS 61 1.178 0.039 -14.229
509 HG2 LYS 61 HG2 LYS 61 0.258 1.920 -15.868
510 HG3 LYS 61 HG3 LYS 61 1.989 2.091 -16.179
511 HD2 LYS 61 HD2 LYS 61 1.213 0.501 -17.706
512 HD3 LYS 61 HD3 LYS 61 2.046 -0.417 -16.467
513 HE2 LYS 61 HE2 LYS 61 -0.079 -0.953 -15.418
514 HE3 LYS 61 HE3 LYS 61 -0.934 0.014 -16.618
515 HZ1 LYS 61 HZ1 LYS 61 0.581 -2.496 -17.085
516 HZ2 LYS 61 HZ2 LYS 61 -0.020 -1.515 -18.331
517 HZ3 LYS 61 HZ3 LYS 61 -1.093 -2.258 -17.245
518 H ALA 62 H ALA 62 -0.566 0.100 -12.446
519 HA ALA 62 HA ALA 62 -2.936 0.435 -13.930
520 HB1 ALA 62 HB1 ALA 62 -3.901 -1.210 -12.416
521 HB2 ALA 62 HB2 ALA 62 -2.539 -1.009 -11.314
522 HB3 ALA 62 HB3 ALA 62 -2.279 -1.690 -12.919
523 H VAL 63 H VAL 63 -2.115 1.401 -10.582
524 HA VAL 63 HA VAL 63 -4.721 2.412 -10.049
525 HB VAL 63 HB VAL 63 -3.136 1.721 -8.254
526 HG11 VAL 63 HG11 VAL 63 -1.424 3.253 -7.477
527 HG12 VAL 63 HG12 VAL 63 -1.767 4.341 -8.822
528 HG13 VAL 63 HG13 VAL 63 -1.098 2.741 -9.134
529 HG21 VAL 63 HG21 VAL 63 -3.750 3.481 -6.681
530 HG22 VAL 63 HG22 VAL 63 -5.099 3.059 -7.735
531 HG23 VAL 63 HG23 VAL 63 -4.181 4.538 -8.027
532 H MET 64 H MET 64 -1.848 3.808 -11.472
533 HA MET 64 HA MET 64 -2.833 6.503 -11.404
534 HB2 MET 64 HB2 MET 64 -0.679 5.221 -13.097
535 HB3 MET 64 HB3 MET 64 -1.033 6.944 -13.076
536 HG2 MET 64 HG2 MET 64 -0.427 7.061 -10.731
537 HG3 MET 64 HG3 MET 64 -0.129 5.324 -10.706
538 HE1 MET 64 HE1 MET 64 3.494 6.724 -10.404
539 HE2 MET 64 HE2 MET 64 2.301 5.606 -9.744
540 HE3 MET 64 HE3 MET 64 2.025 7.347 -9.651
541 H LYS 65 H LYS 65 -3.032 3.794 -13.597
542 HA LYS 65 HA LYS 65 -4.014 5.179 -15.834
543 HB2 LYS 65 HB2 LYS 65 -3.066 2.698 -15.403
544 HB3 LYS 65 HB3 LYS 65 -4.789 2.353 -15.385
545 HG2 LYS 65 HG2 LYS 65 -3.182 3.559 -17.617
546 HG3 LYS 65 HG3 LYS 65 -3.982 1.987 -17.584
547 HD2 LYS 65 HD2 LYS 65 -5.533 3.145 -18.743
548 HD3 LYS 65 HD3 LYS 65 -6.105 3.519 -17.125
549 HE2 LYS 65 HE2 LYS 65 -4.868 5.619 -17.169
550 HE3 LYS 65 HE3 LYS 65 -4.270 5.241 -18.778
551 HZ1 LYS 65 HZ1 LYS 65 -6.082 6.731 -19.007
552 HZ2 LYS 65 HZ2 LYS 65 -7.068 5.810 -17.988
553 HZ3 LYS 65 HZ3 LYS 65 -6.641 5.208 -19.513
554 H ARG 66 H ARG 66 -5.845 2.721 -14.040
555 HA ARG 66 HA ARG 66 -8.342 3.719 -14.859
556 HB2 ARG 66 HB2 ARG 66 -9.321 2.192 -13.183
557 HB3 ARG 66 HB3 ARG 66 -8.114 1.409 -14.190
558 HG2 ARG 66 HG2 ARG 66 -6.521 1.412 -12.441
559 HG3 ARG 66 HG3 ARG 66 -7.509 2.490 -11.453
560 HD2 ARG 66 HD2 ARG 66 -8.299 -0.301 -12.278
561 HD3 ARG 66 HD3 ARG 66 -7.591 0.127 -10.721
562 HE ARG 66 HE ARG 66 -9.895 1.705 -11.245
563 HH11 ARG 66 HH11 ARG 66 -8.945 -1.543 -10.280
564 HH12 ARG 66 HH12 ARG 66 -10.420 -1.832 -9.403
565 HH21 ARG 66 HH21 ARG 66 -11.806 1.313 -10.106
566 HH22 ARG 66 HH22 ARG 66 -12.046 -0.214 -9.301
567 H GLY 67 H GLY 67 -6.348 4.475 -12.111
568 HA2 GLY 67 HA2 GLY 67 -8.499 6.121 -10.975
569 HA3 GLY 67 HA3 GLY 67 -7.018 5.656 -10.145
570 H ALA 68 H ALA 68 -5.290 6.956 -10.232
571 HA ALA 68 HA ALA 68 -4.761 8.867 -12.238
572 HB1 ALA 68 HB1 ALA 68 -6.712 10.013 -11.280
573 HB2 ALA 68 HB2 ALA 68 -5.229 10.932 -11.029
574 HB3 ALA 68 HB3 ALA 68 -5.933 10.012 -9.698
575 HA PRO 69 HA PRO 69 -0.831 8.626 -10.133
576 HB2 PRO 69 HB2 PRO 69 0.186 11.052 -10.978
577 HB3 PRO 69 HB3 PRO 69 0.244 9.560 -11.923
578 HG2 PRO 69 HG2 PRO 69 -1.670 11.847 -12.108
579 HG3 PRO 69 HG3 PRO 69 -0.931 10.895 -13.409
580 HD2 PRO 69 HD2 PRO 69 -3.467 10.491 -12.630
581 HD3 PRO 69 HD3 PRO 69 -2.430 9.145 -13.144
582 H SER 70 H SER 70 -2.936 11.409 -9.960
583 HA SER 70 HA SER 70 -1.754 12.906 -7.958
584 HB2 SER 70 HB2 SER 70 -4.736 12.581 -8.115
585 HB3 SER 70 HB3 SER 70 -3.785 14.047 -7.855
586 HG SER 70 HG SER 70 -3.931 14.345 -9.921
587 H ILE 71 H ILE 71 -4.218 10.338 -7.606
588 HA ILE 71 HA ILE 71 -4.084 10.423 -4.748
589 HB ILE 71 HB ILE 71 -5.493 8.386 -4.806
590 HG12 ILE 71 HG12 ILE 71 -5.348 8.714 -7.812
591 HG13 ILE 71 HG13 ILE 71 -4.590 7.416 -6.897
592 HG21 ILE 71 HG21 ILE 71 -6.425 10.645 -6.571
593 HG22 ILE 71 HG22 ILE 71 -6.501 10.598 -4.809
594 HG23 ILE 71 HG23 ILE 71 -7.466 9.473 -5.765
595 HD11 ILE 71 HD11 ILE 71 -6.776 6.617 -6.198
596 HD12 ILE 71 HD12 ILE 71 -6.664 6.697 -7.957
597 HD13 ILE 71 HD13 ILE 71 -7.549 7.939 -7.073
598 H ALA 72 H ALA 72 -2.526 8.584 -7.273
599 HA ALA 72 HA ALA 72 -1.553 6.425 -5.782
600 HB1 ALA 72 HB1 ALA 72 -1.486 6.517 -8.227
601 HB2 ALA 72 HB2 ALA 72 0.101 6.153 -7.545
602 HB3 ALA 72 HB3 ALA 72 -0.252 7.776 -8.143
603 H ASN 73 H ASN 73 -0.331 9.698 -6.190
604 HA ASN 73 HA ASN 73 2.183 9.417 -4.983
605 HB2 ASN 73 HB2 ASN 73 0.335 11.813 -4.824
606 HB3 ASN 73 HB3 ASN 73 2.070 11.822 -4.532
607 HD21 ASN 73 HD21 ASN 73 0.335 13.216 -6.493
608 HD22 ASN 73 HD22 ASN 73 1.016 12.858 -8.040
609 H ASP 74 H ASP 74 -0.999 10.076 -3.604
610 HA ASP 74 HA ASP 74 -0.049 10.282 -0.912
611 HB2 ASP 74 HB2 ASP 74 -2.164 11.338 -1.692
612 HB3 ASP 74 HB3 ASP 74 -2.870 9.734 -1.862
613 H THR 75 H THR 75 -1.344 7.690 -2.908
614 HA THR 75 HA THR 75 -1.633 5.697 -0.977
615 HB THR 75 HB THR 75 -0.637 5.311 -3.814
616 HG1 THR 75 HG1 THR 75 -3.182 4.832 -3.762
617 HG21 THR 75 HG21 THR 75 -1.774 3.121 -3.622
618 HG22 THR 75 HG22 THR 75 -2.116 3.469 -1.926
619 HG23 THR 75 HG23 THR 75 -0.448 3.295 -2.471
620 H LEU 76 H LEU 76 1.220 6.919 -2.629
621 HA LEU 76 HA LEU 76 3.065 4.987 -1.754
622 HB2 LEU 76 HB2 LEU 76 3.470 7.905 -2.409
623 HB3 LEU 76 HB3 LEU 76 4.772 6.757 -2.163
624 HG LEU 76 HG LEU 76 2.693 6.565 -4.345
625 HD11 LEU 76 HD11 LEU 76 4.483 7.220 -5.853
626 HD12 LEU 76 HD12 LEU 76 5.584 7.406 -4.489
627 HD13 LEU 76 HD13 LEU 76 4.193 8.478 -4.650
628 HD21 LEU 76 HD21 LEU 76 4.132 4.819 -5.249
629 HD22 LEU 76 HD22 LEU 76 3.581 4.394 -3.628
630 HD23 LEU 76 HD23 LEU 76 5.223 4.988 -3.874
631 H ARG 77 H ARG 77 1.726 7.834 -0.203
632 HA ARG 77 HA ARG 77 3.495 7.928 2.009
633 HB2 ARG 77 HB2 ARG 77 0.613 8.800 1.759
634 HB3 ARG 77 HB3 ARG 77 1.612 9.117 3.167
635 HG2 ARG 77 HG2 ARG 77 3.128 10.449 1.790
636 HG3 ARG 77 HG3 ARG 77 2.115 10.129 0.377
637 HD2 ARG 77 HD2 ARG 77 0.237 11.224 1.437
638 HD3 ARG 77 HD3 ARG 77 1.177 11.471 2.906
639 HE ARG 77 HE ARG 77 2.660 12.901 1.432
640 HH11 ARG 77 HH11 ARG 77 -0.733 12.386 0.748
641 HH12 ARG 77 HH12 ARG 77 -0.965 13.959 0.037
642 HH21 ARG 77 HH21 ARG 77 2.372 14.986 0.531
643 HH22 ARG 77 HH22 ARG 77 0.809 15.439 -0.088
644 H TRP 78 H TRP 78 0.359 6.351 1.505
645 HA TRP 78 HA TRP 78 0.161 5.209 4.076
646 HB2 TRP 78 HB2 TRP 78 -1.077 4.350 1.450
647 HB3 TRP 78 HB3 TRP 78 -1.506 3.669 3.018
648 HD1 TRP 78 HD1 TRP 78 -2.226 6.571 0.761
649 HE1 TRP 78 HE1 TRP 78 -3.908 8.161 1.880
650 HE3 TRP 78 HE3 TRP 78 -2.207 4.571 5.462
651 HZ2 TRP 78 HZ2 TRP 78 -5.077 8.516 4.429
652 HZ3 TRP 78 HZ3 TRP 78 -3.636 5.595 7.185
653 HH2 TRP 78 HH2 TRP 78 -5.039 7.526 6.676
654 H LEU 79 H LEU 79 1.459 3.964 1.021
655 HA LEU 79 HA LEU 79 2.267 1.446 1.924
656 HB2 LEU 79 HB2 LEU 79 3.527 3.296 -0.101
657 HB3 LEU 79 HB3 LEU 79 4.051 1.643 0.157
658 HG LEU 79 HG LEU 79 1.287 2.450 -0.749
659 HD11 LEU 79 HD11 LEU 79 1.954 1.577 -2.924
660 HD12 LEU 79 HD12 LEU 79 3.581 1.282 -2.314
661 HD13 LEU 79 HD13 LEU 79 2.975 2.934 -2.446
662 HD21 LEU 79 HD21 LEU 79 2.609 -0.254 -0.545
663 HD22 LEU 79 HD22 LEU 79 1.002 0.066 -1.201
664 HD23 LEU 79 HD23 LEU 79 1.332 0.355 0.508
665 H LYS 80 H LYS 80 4.065 4.511 1.855
666 HA LYS 80 HA LYS 80 6.439 3.745 2.968
667 HB2 LYS 80 HB2 LYS 80 5.953 5.965 2.049
668 HB3 LYS 80 HB3 LYS 80 4.923 6.314 3.428
669 HG2 LYS 80 HG2 LYS 80 6.836 7.367 4.053
670 HG3 LYS 80 HG3 LYS 80 7.083 5.785 4.791
671 HD2 LYS 80 HD2 LYS 80 8.207 6.714 2.153
672 HD3 LYS 80 HD3 LYS 80 9.076 6.552 3.666
673 HE2 LYS 80 HE2 LYS 80 8.684 4.141 3.648
674 HE3 LYS 80 HE3 LYS 80 7.799 4.304 2.132
675 HZ1 LYS 80 HZ1 LYS 80 9.893 5.263 1.180
676 HZ2 LYS 80 HZ2 LYS 80 9.982 3.618 1.594
677 HZ3 LYS 80 HZ3 LYS 80 10.690 4.784 2.602
678 H ARG 81 H ARG 81 3.729 5.171 4.780
679 HA ARG 81 HA ARG 81 4.910 4.783 7.302
680 HB2 ARG 81 HB2 ARG 81 2.667 5.292 8.225
681 HB3 ARG 81 HB3 ARG 81 3.209 6.458 7.031
682 HG2 ARG 81 HG2 ARG 81 1.814 5.305 5.341
683 HG3 ARG 81 HG3 ARG 81 1.201 4.256 6.621
684 HD2 ARG 81 HD2 ARG 81 -0.338 6.095 6.156
685 HD3 ARG 81 HD3 ARG 81 0.306 6.195 7.793
686 HE ARG 81 HE ARG 81 1.855 7.925 6.893
687 HH11 ARG 81 HH11 ARG 81 -1.124 7.237 5.196
688 HH12 ARG 81 HH12 ARG 81 -1.263 8.835 4.524
689 HH21 ARG 81 HH21 ARG 81 1.660 10.049 6.013
690 HH22 ARG 81 HH22 ARG 81 0.302 10.418 4.997
691 H MET 82 H MET 82 2.889 2.671 5.366
692 HA MET 82 HA MET 82 2.305 0.866 7.506
693 HB2 MET 82 HB2 MET 82 0.888 1.049 5.480
694 HB3 MET 82 HB3 MET 82 2.197 0.370 4.524
695 HG2 MET 82 HG2 MET 82 1.233 -1.180 6.864
696 HG3 MET 82 HG3 MET 82 0.200 -1.100 5.440
697 HE1 MET 82 HE1 MET 82 2.367 -2.745 2.682
698 HE2 MET 82 HE2 MET 82 2.161 -1.026 3.025
699 HE3 MET 82 HE3 MET 82 0.776 -2.115 3.119
700 H PHE 83 H PHE 83 4.599 0.783 4.775
701 HA PHE 83 HA PHE 83 5.889 -1.600 5.567
702 HB2 PHE 83 HB2 PHE 83 6.889 0.719 3.905
703 HB3 PHE 83 HB3 PHE 83 7.798 -0.766 4.147
704 HD1 PHE 83 HD2 PHE 83 5.780 -2.834 3.890
705 HD2 PHE 83 HD1 PHE 83 6.259 0.778 1.699
706 HE1 PHE 83 HE2 PHE 83 4.628 -3.852 1.968
707 HE2 PHE 83 HE1 PHE 83 5.110 -0.230 -0.228
708 HZ PHE 83 HZ PHE 83 4.293 -2.549 -0.093
709 H ASN 84 H ASN 84 6.346 1.763 6.444
710 HA ASN 84 HA ASN 84 8.789 1.574 7.796
711 HB2 ASN 84 HB2 ASN 84 7.868 3.746 7.361
712 HB3 ASN 84 HB3 ASN 84 6.402 3.370 8.259
713 HD21 ASN 84 HD21 ASN 84 6.394 3.538 10.463
714 HD22 ASN 84 HD22 ASN 84 7.703 4.203 11.381
715 H TYR 85 H TYR 85 5.491 0.953 8.891
716 HA TYR 85 HA TYR 85 6.124 0.495 11.604
717 HB2 TYR 85 HB2 TYR 85 3.833 0.945 10.791
718 HB3 TYR 85 HB3 TYR 85 3.825 -0.615 9.977
719 HD1 TYR 85 HD2 TYR 85 4.225 0.905 13.356
720 HD2 TYR 85 HD1 TYR 85 3.002 -2.488 11.097
721 HE1 TYR 85 HE2 TYR 85 3.370 -0.146 15.406
722 HE2 TYR 85 HE1 TYR 85 2.143 -3.548 13.145
723 HH TYR 85 HH TYR 85 1.720 -1.856 16.047
724 H ALA 86 H ALA 86 6.110 -1.554 8.758
725 HA ALA 86 HA ALA 86 6.494 -4.005 10.176
726 HB1 ALA 86 HB1 ALA 86 6.911 -4.985 7.999
727 HB2 ALA 86 HB2 ALA 86 7.082 -3.384 7.283
728 HB3 ALA 86 HB3 ALA 86 5.520 -3.904 7.914
729 H ILE 87 H ILE 87 8.651 -1.660 8.624
730 HA ILE 87 HA ILE 87 11.034 -3.172 9.016
731 HB ILE 87 HB ILE 87 10.716 -0.180 8.682
732 HG12 ILE 87 HG12 ILE 87 11.349 -2.327 6.643
733 HG13 ILE 87 HG13 ILE 87 9.802 -1.502 6.802
734 HG21 ILE 87 HG21 ILE 87 13.071 -0.209 7.992
735 HG22 ILE 87 HG22 ILE 87 13.155 -1.929 8.370
736 HG23 ILE 87 HG23 ILE 87 12.875 -0.754 9.656
737 HD11 ILE 87 HD11 ILE 87 11.105 -0.593 4.970
738 HD12 ILE 87 HD12 ILE 87 12.422 -0.214 6.080
739 HD13 ILE 87 HD13 ILE 87 10.873 0.613 6.236
740 H LYS 88 H LYS 88 9.391 -0.661 10.855
741 HA LYS 88 HA LYS 88 11.232 -0.421 12.961
742 HB2 LYS 88 HB2 LYS 88 9.661 1.286 12.807
743 HB3 LYS 88 HB3 LYS 88 8.320 0.176 12.592
744 HG2 LYS 88 HG2 LYS 88 9.724 0.146 15.202
745 HG3 LYS 88 HG3 LYS 88 8.700 1.535 14.826
746 HD2 LYS 88 HD2 LYS 88 6.868 -0.082 14.269
747 HD3 LYS 88 HD3 LYS 88 7.896 -1.370 14.897
748 HE2 LYS 88 HE2 LYS 88 7.015 1.044 16.454
749 HE3 LYS 88 HE3 LYS 88 6.238 -0.532 16.534
750 HZ1 LYS 88 HZ1 LYS 88 8.279 -1.477 17.372
751 HZ2 LYS 88 HZ2 LYS 88 7.798 -0.184 18.356
752 HZ3 LYS 88 HZ3 LYS 88 9.072 0.022 17.252
753 H ARG 89 H ARG 89 8.502 -2.593 12.465
754 HA ARG 89 HA ARG 89 8.870 -3.944 14.982
755 HB2 ARG 89 HB2 ARG 89 6.702 -3.651 13.600
756 HB3 ARG 89 HB3 ARG 89 7.296 -5.001 12.646
757 HG2 ARG 89 HG2 ARG 89 7.245 -6.450 14.555
758 HG3 ARG 89 HG3 ARG 89 6.859 -5.096 15.619
759 HD2 ARG 89 HD2 ARG 89 4.755 -4.759 14.372
760 HD3 ARG 89 HD3 ARG 89 5.132 -6.179 13.397
761 HE ARG 89 HE ARG 89 5.149 -7.343 15.717
762 HH11 ARG 89 HH11 ARG 89 3.040 -4.717 14.759
763 HH12 ARG 89 HH12 ARG 89 1.717 -5.232 15.752
764 HH21 ARG 89 HH21 ARG 89 3.406 -8.020 17.062
765 HH22 ARG 89 HH22 ARG 89 1.932 -7.093 17.084
766 H HIS 90 H HIS 90 10.628 -3.881 12.251
767 HA HIS 90 HA HIS 90 12.264 -5.115 11.309
768 HB2 HIS 90 HB2 HIS 90 12.938 -5.167 13.765
769 HB3 HIS 90 HB3 HIS 90 12.267 -6.795 13.815
770 HD1 HIS 90 HD1 HIS 90 14.027 -8.522 13.548
771 HD2 HIS 90 HD2 HIS 90 14.928 -5.055 11.426
772 HE1 HIS 90 HE1 HIS 90 16.234 -8.962 12.431
773 HE2 HIS 90 HE2 HIS 90 16.728 -6.890 11.087
774 H ILE 91 H ILE 91 9.681 -5.845 10.612
775 HA ILE 91 HA ILE 91 9.595 -8.749 10.483
776 HB ILE 91 HB ILE 91 7.821 -6.726 9.099
777 HG12 ILE 91 HG12 ILE 91 7.304 -8.235 11.667
778 HG13 ILE 91 HG13 ILE 91 7.840 -6.559 11.599
779 HG21 ILE 91 HG21 ILE 91 7.764 -8.941 8.078
780 HG22 ILE 91 HG22 ILE 91 6.246 -8.596 8.908
781 HG23 ILE 91 HG23 ILE 91 7.432 -9.668 9.650
782 HD11 ILE 91 HD11 ILE 91 5.808 -5.950 10.417
783 HD12 ILE 91 HD12 ILE 91 5.445 -6.726 11.958
784 HD13 ILE 91 HD13 ILE 91 5.276 -7.631 10.453
785 H ILE 92 H ILE 92 9.882 -6.014 8.252
786 HA ILE 92 HA ILE 92 11.487 -7.683 6.462
787 HB ILE 92 HB ILE 92 10.371 -6.606 4.479
788 HG12 ILE 92 HG12 ILE 92 7.860 -6.009 5.114
789 HG13 ILE 92 HG13 ILE 92 8.598 -5.571 6.649
790 HG21 ILE 92 HG21 ILE 92 8.660 -8.398 6.186
791 HG22 ILE 92 HG22 ILE 92 9.925 -8.907 5.066
792 HG23 ILE 92 HG23 ILE 92 8.462 -8.135 4.453
793 HD11 ILE 92 HD11 ILE 92 10.073 -4.008 5.488
794 HD12 ILE 92 HD12 ILE 92 8.372 -3.642 5.198
795 HD13 ILE 92 HD13 ILE 92 9.327 -4.448 3.953
796 H GLU 93 H GLU 93 12.992 -6.506 5.206
797 HA GLU 93 HA GLU 93 13.283 -3.675 5.972
798 HB2 GLU 93 HB2 GLU 93 15.474 -5.712 5.526
799 HB3 GLU 93 HB3 GLU 93 15.735 -3.999 5.830
800 HG2 GLU 93 HG2 GLU 93 14.689 -4.224 8.024
801 HG3 GLU 93 HG3 GLU 93 14.417 -5.939 7.720
802 H TYR 94 H TYR 94 12.083 -5.148 3.620
803 HA TYR 94 HA TYR 94 13.776 -4.510 1.388
804 HB2 TYR 94 HB2 TYR 94 10.970 -5.547 1.669
805 HB3 TYR 94 HB3 TYR 94 11.585 -5.033 0.102
806 HD1 TYR 94 HD1 TYR 94 12.004 -7.489 2.830
807 HD2 TYR 94 HD2 TYR 94 13.117 -6.366 -1.116
808 HE1 TYR 94 HE1 TYR 94 13.028 -9.701 2.494
809 HE2 TYR 94 HE2 TYR 94 14.143 -8.568 -1.464
810 HH TYR 94 HH TYR 94 15.063 -10.384 -0.192
811 H ASN 95 H ASN 95 10.613 -3.299 2.489
812 HA ASN 95 HA ASN 95 9.403 -1.457 1.976
813 HB2 ASN 95 HB2 ASN 95 11.542 -0.444 3.072
814 HB3 ASN 95 HB3 ASN 95 11.944 0.058 1.431
815 HD21 ASN 95 HD21 ASN 95 9.863 0.502 4.133
816 HD22 ASN 95 HD22 ASN 95 9.061 1.919 3.564
817 HA PRO 96 HA PRO 96 10.024 -2.480 -2.498
818 HB2 PRO 96 HB2 PRO 96 7.092 -2.705 -2.483
819 HB3 PRO 96 HB3 PRO 96 8.307 -3.892 -2.975
820 HG2 PRO 96 HG2 PRO 96 6.860 -4.171 -0.717
821 HG3 PRO 96 HG3 PRO 96 8.534 -4.738 -0.849
822 HD2 PRO 96 HD2 PRO 96 7.462 -2.276 0.466
823 HD3 PRO 96 HD3 PRO 96 8.755 -3.372 1.002
824 H ALA 97 H ALA 97 8.309 -0.073 -0.816
825 HA ALA 97 HA ALA 97 7.285 1.328 -3.107
826 HB1 ALA 97 HB1 ALA 97 7.594 2.238 -0.245
827 HB2 ALA 97 HB2 ALA 97 6.159 1.493 -0.951
828 HB3 ALA 97 HB3 ALA 97 6.692 3.079 -1.507
829 H ALA 98 H ALA 98 10.337 0.857 -2.008
830 HA ALA 98 HA ALA 98 11.493 3.428 -2.116
831 HB1 ALA 98 HB1 ALA 98 12.777 0.757 -2.672
832 HB2 ALA 98 HB2 ALA 98 12.613 1.514 -1.087
833 HB3 ALA 98 HB3 ALA 98 13.624 2.264 -2.324
834 H ALA 99 H ALA 99 10.293 1.380 -4.576
835 HA ALA 99 HA ALA 99 11.888 2.109 -6.764
836 HB1 ALA 99 HB1 ALA 99 10.245 0.281 -6.816
837 HB2 ALA 99 HB2 ALA 99 10.018 1.409 -8.152
838 HB3 ALA 99 HB3 ALA 99 8.939 1.465 -6.758
839 H PHE 100 H PHE 100 9.074 3.646 -5.311
840 HA PHE 100 HA PHE 100 9.873 6.158 -6.559
841 HB2 PHE 100 HB2 PHE 100 7.099 4.973 -6.683
842 HB3 PHE 100 HB3 PHE 100 7.390 6.698 -6.863
843 HD1 PHE 100 HD2 PHE 100 8.741 7.520 -8.776
844 HD2 PHE 100 HD1 PHE 100 7.488 3.466 -8.468
845 HE1 PHE 100 HE2 PHE 100 9.184 7.204 -11.176
846 HE2 PHE 100 HE1 PHE 100 7.926 3.144 -10.867
847 HZ PHE 100 HZ PHE 100 8.775 5.015 -12.225
848 H ASP 101 H ASP 101 10.741 6.410 -4.429
849 HA ASP 101 HA ASP 101 8.915 6.488 -2.189
850 HB2 ASP 101 HB2 ASP 101 11.239 5.627 -1.974
851 HB3 ASP 101 HB3 ASP 101 11.843 7.244 -2.316
852 HA PRO 102 HA PRO 102 7.724 10.615 -3.301
853 HB2 PRO 102 HB2 PRO 102 6.283 11.101 -0.998
854 HB3 PRO 102 HB3 PRO 102 5.663 10.259 -2.421
855 HG2 PRO 102 HG2 PRO 102 6.718 9.141 0.137
856 HG3 PRO 102 HG3 PRO 102 5.354 8.589 -0.854
857 HD2 PRO 102 HD2 PRO 102 7.735 7.335 -0.885
858 HD3 PRO 102 HD3 PRO 102 6.722 7.462 -2.337
859 H GLY 103 H GLY 103 8.846 10.005 0.036
860 HA2 GLY 103 HA2 GLY 103 10.366 11.224 1.296
861 HA3 GLY 103 HA3 GLY 103 10.598 12.298 -0.078
862 H ASP 104 H ASP 104 7.378 11.714 0.860
863 HA ASP 104 HA ASP 104 7.208 14.051 2.582
864 HB2 ASP 104 HB2 ASP 104 6.994 14.989 0.323
865 HB3 ASP 104 HB3 ASP 104 5.711 13.843 -0.046
866 H ALA 105 H ALA 105 6.485 12.767 4.229
867 HA ALA 105 HA ALA 105 4.227 10.971 3.719
868 HB1 ALA 105 HB1 ALA 105 6.166 10.069 4.904
869 HB2 ALA 105 HB2 ALA 105 4.718 10.031 5.910
870 HB3 ALA 105 HB3 ALA 105 5.944 11.267 6.179
871 H GLY 106 H GLY 106 4.614 14.119 4.557
872 HA2 GLY 106 HA2 GLY 106 2.777 15.531 5.032
873 HA3 GLY 106 HA3 GLY 106 1.954 14.166 5.776
874 H GLY 107 H GLY 107 3.200 13.281 7.761
875 HA2 GLY 107 HA2 GLY 107 4.853 14.143 9.485
876 HA3 GLY 107 HA3 GLY 107 3.903 15.621 9.410
877 H LYS 108 H LYS 108 3.436 12.128 9.887
878 HA LYS 108 HA LYS 108 1.046 12.502 11.380
879 HB2 LYS 108 HB2 LYS 108 2.784 10.159 10.741
880 HB3 LYS 108 HB3 LYS 108 1.556 10.014 11.996
881 HG2 LYS 108 HG2 LYS 108 1.063 10.855 9.150
882 HG3 LYS 108 HG3 LYS 108 0.719 9.262 9.836
883 HD2 LYS 108 HD2 LYS 108 -0.896 10.209 11.353
884 HD3 LYS 108 HD3 LYS 108 -0.468 11.846 10.849
885 HE2 LYS 108 HE2 LYS 108 -1.337 11.456 8.652
886 HE3 LYS 108 HE3 LYS 108 -1.593 9.754 9.023
887 HZ1 LYS 108 HZ1 LYS 108 -3.637 11.122 9.130
888 HZ2 LYS 108 HZ2 LYS 108 -2.960 11.986 10.426
889 HZ3 LYS 108 HZ3 LYS 108 -3.288 10.328 10.587
890 H LEU 109 H LEU 109 0.639 12.284 13.483
891 HA LEU 109 HA LEU 109 2.609 11.621 15.448
892 HB2 LEU 109 HB2 LEU 109 3.222 13.978 14.946
893 HB3 LEU 109 HB3 LEU 109 1.585 14.466 15.341
894 HG LEU 109 HG LEU 109 1.927 13.709 17.667
895 HD11 LEU 109 HD11 LEU 109 4.181 13.141 18.426
896 HD12 LEU 109 HD12 LEU 109 4.755 13.197 16.760
897 HD13 LEU 109 HD13 LEU 109 3.582 11.974 17.246
898 HD21 LEU 109 HD21 LEU 109 3.491 15.483 18.319
899 HD22 LEU 109 HD22 LEU 109 2.342 16.031 17.101
900 HD23 LEU 109 HD23 LEU 109 3.999 15.643 16.637
901 H GLU 110 H GLU 110 1.580 11.252 17.502
902 HA GLU 110 HA GLU 110 -1.331 11.491 17.327
903 HB2 GLU 110 HB2 GLU 110 -1.559 9.417 18.614
904 HB3 GLU 110 HB3 GLU 110 -0.740 9.169 17.084
905 HG2 GLU 110 HG2 GLU 110 0.556 7.895 18.428
906 HG3 GLU 110 HG3 GLU 110 1.410 9.425 18.578
907 H HIS 111 H HIS 111 -2.239 12.675 18.697
908 HA HIS 111 HA HIS 111 -1.744 12.550 21.490
909 HB2 HIS 111 HB2 HIS 111 -0.158 14.435 20.297
910 HB3 HIS 111 HB3 HIS 111 -1.615 15.377 20.605
911 HD1 HIS 111 HD1 HIS 111 -1.983 16.183 22.982
912 HD2 HIS 111 HD2 HIS 111 1.013 13.307 22.689
913 HE1 HIS 111 HE1 HIS 111 -0.923 16.067 25.257
914 HE2 HIS 111 HE2 HIS 111 0.806 14.247 25.094
915 H HIS 112 H HIS 112 -3.606 13.209 22.567
916 HA HIS 112 HA HIS 112 -5.881 13.369 22.779
917 HB2 HIS 112 HB2 HIS 112 -5.950 14.441 19.940
918 HB3 HIS 112 HB3 HIS 112 -7.301 14.402 21.057
919 HD1 HIS 112 HD1 HIS 112 -7.435 16.284 22.817
920 HD2 HIS 112 HD2 HIS 112 -4.085 16.495 20.357
921 HE1 HIS 112 HE1 HIS 112 -6.486 18.583 23.155
922 HE2 HIS 112 HE2 HIS 112 -4.543 18.739 21.559
923 H HIS 113 H HIS 113 -7.715 12.033 22.150
924 HA HIS 113 HA HIS 113 -7.419 10.388 19.794
925 HB2 HIS 113 HB2 HIS 113 -6.076 9.290 21.716
926 HB3 HIS 113 HB3 HIS 113 -7.653 8.895 22.393
927 HD1 HIS 113 HD1 HIS 113 -5.169 7.750 19.973
928 HD2 HIS 113 HD2 HIS 113 -9.239 7.178 20.641
929 HE1 HIS 113 HE1 HIS 113 -5.802 5.709 18.638
930 HE2 HIS 113 HE2 HIS 113 -8.288 5.463 18.962
931 H HIS 114 H HIS 114 -9.142 10.018 22.882
932 HA HIS 114 HA HIS 114 -11.343 9.850 23.403
933 HB2 HIS 114 HB2 HIS 114 -11.768 11.393 20.835
934 HB3 HIS 114 HB3 HIS 114 -13.005 11.091 22.049
935 HD1 HIS 114 HD1 HIS 114 -10.619 13.556 21.044
936 HD2 HIS 114 HD2 HIS 114 -12.180 12.272 24.678
937 HE1 HIS 114 HE1 HIS 114 -10.166 15.415 22.676
938 HE2 HIS 114 HE2 HIS 114 -10.916 14.516 24.907
939 H HIS 115 H HIS 115 -13.476 8.891 22.627
940 HA HIS 115 HA HIS 115 -14.622 7.122 21.761
941 HB2 HIS 115 HB2 HIS 115 -12.829 7.508 19.346
942 HB3 HIS 115 HB3 HIS 115 -14.332 6.594 19.378
943 HD1 HIS 115 HD1 HIS 115 -13.293 9.505 17.961
944 HD2 HIS 115 HD2 HIS 115 -16.372 8.727 20.646
945 HE1 HIS 115 HE1 HIS 115 -14.904 11.418 17.721
946 HE2 HIS 115 HE2 HIS 115 -16.617 11.046 19.526
947 H HIS 116 H HIS 116 -13.500 5.094 19.905
948 HA HIS 116 HA HIS 116 -11.526 3.859 21.717
949 HB2 HIS 116 HB2 HIS 116 -13.889 2.557 20.363
950 HB3 HIS 116 HB3 HIS 116 -12.553 1.638 21.048
951 HD1 HIS 116 HD1 HIS 116 -12.308 1.645 23.642
952 HD2 HIS 116 HD2 HIS 116 -15.696 3.593 22.212
953 HE1 HIS 116 HE1 HIS 116 -13.806 1.970 25.641
954 HE2 HIS 116 HE2 HIS 116 -15.909 3.016 24.727
Start of MODEL 6
1 H1 MET 1 H1 MET 1 3.629 -17.653 15.462
2 H2 MET 1 H2 MET 1 2.089 -17.652 14.748
3 H3 MET 1 H3 MET 1 2.389 -18.619 16.105
4 HA MET 1 HA MET 1 1.110 -16.596 16.608
5 HB2 MET 1 HB2 MET 1 2.450 -15.945 18.559
6 HB3 MET 1 HB3 MET 1 2.438 -17.689 18.352
7 HG2 MET 1 HG2 MET 1 4.667 -17.556 17.318
8 HG3 MET 1 HG3 MET 1 4.675 -15.817 17.605
9 HE1 MET 1 HE1 MET 1 6.979 -15.987 18.900
10 HE2 MET 1 HE2 MET 1 7.008 -17.722 18.589
11 HE3 MET 1 HE3 MET 1 7.278 -17.115 20.223
12 H ALA 2 H ALA 2 1.996 -15.858 14.114
13 HA ALA 2 HA ALA 2 2.807 -14.199 12.794
14 HB1 ALA 2 HB1 ALA 2 2.640 -12.507 15.293
15 HB2 ALA 2 HB2 ALA 2 1.314 -12.792 14.164
16 HB3 ALA 2 HB3 ALA 2 2.753 -11.919 13.633
17 H GLU 3 H GLU 3 4.637 -12.158 13.216
18 HA GLU 3 HA GLU 3 6.785 -11.581 13.715
19 HB2 GLU 3 HB2 GLU 3 6.249 -12.464 15.995
20 HB3 GLU 3 HB3 GLU 3 6.868 -14.026 15.488
21 HG2 GLU 3 HG2 GLU 3 8.555 -12.935 16.749
22 HG3 GLU 3 HG3 GLU 3 9.063 -12.951 15.061
23 H LYS 4 H LYS 4 6.396 -15.091 13.269
24 HA LYS 4 HA LYS 4 9.034 -15.256 12.053
25 HB2 LYS 4 HB2 LYS 4 8.297 -16.898 13.767
26 HB3 LYS 4 HB3 LYS 4 7.025 -17.432 12.683
27 HG2 LYS 4 HG2 LYS 4 9.890 -17.545 11.832
28 HG3 LYS 4 HG3 LYS 4 9.204 -18.800 12.863
29 HD2 LYS 4 HD2 LYS 4 7.378 -19.038 11.124
30 HD3 LYS 4 HD3 LYS 4 8.369 -18.020 10.080
31 HE2 LYS 4 HE2 LYS 4 9.276 -20.604 11.324
32 HE3 LYS 4 HE3 LYS 4 8.669 -20.449 9.678
33 HZ1 LYS 4 HZ1 LYS 4 11.067 -20.446 9.705
34 HZ2 LYS 4 HZ2 LYS 4 11.100 -19.132 10.777
35 HZ3 LYS 4 HZ3 LYS 4 10.505 -18.929 9.200
36 H ASN 5 H ASN 5 5.732 -16.354 11.204
37 HA ASN 5 HA ASN 5 6.453 -15.917 8.383
38 HB2 ASN 5 HB2 ASN 5 6.770 -18.282 8.801
39 HB3 ASN 5 HB3 ASN 5 5.161 -18.405 9.505
40 HD21 ASN 5 HD21 ASN 5 3.391 -18.528 8.184
41 HD22 ASN 5 HD22 ASN 5 3.503 -18.722 6.464
42 H ALA 6 H ALA 6 3.790 -16.561 10.643
43 HA ALA 6 HA ALA 6 1.756 -15.949 8.752
44 HB1 ALA 6 HB1 ALA 6 0.225 -16.055 10.633
45 HB2 ALA 6 HB2 ALA 6 1.583 -16.028 11.756
46 HB3 ALA 6 HB3 ALA 6 1.361 -17.406 10.678
47 H TYR 7 H TYR 7 2.381 -13.931 7.903
48 HA TYR 7 HA TYR 7 1.001 -11.760 9.100
49 HB2 TYR 7 HB2 TYR 7 3.490 -11.973 10.146
50 HB3 TYR 7 HB3 TYR 7 3.839 -10.993 8.726
51 HD1 TYR 7 HD1 TYR 7 2.022 -9.000 8.402
52 HD2 TYR 7 HD2 TYR 7 3.078 -10.838 12.086
53 HE1 TYR 7 HE1 TYR 7 1.261 -6.998 9.612
54 HE2 TYR 7 HE2 TYR 7 2.322 -8.845 13.307
55 HH TYR 7 HH TYR 7 0.427 -6.463 11.965
56 H THR 8 H THR 8 -0.040 -11.507 7.177
57 HA THR 8 HA THR 8 1.539 -11.166 4.743
58 HB THR 8 HB THR 8 -0.688 -11.165 3.603
59 HG1 THR 8 HG1 THR 8 -2.506 -11.761 4.856
60 HG21 THR 8 HG21 THR 8 -0.080 -13.533 5.377
61 HG22 THR 8 HG22 THR 8 0.575 -13.231 3.768
62 HG23 THR 8 HG23 THR 8 -1.144 -13.569 3.971
63 H VAL 9 H VAL 9 0.479 -9.423 3.207
64 HA VAL 9 HA VAL 9 0.937 -6.902 4.379
65 HB VAL 9 HB VAL 9 1.252 -7.310 1.979
66 HG11 VAL 9 HG11 VAL 9 -0.639 -8.768 1.556
67 HG12 VAL 9 HG12 VAL 9 -0.664 -7.389 0.456
68 HG13 VAL 9 HG13 VAL 9 -1.756 -7.433 1.840
69 HG21 VAL 9 HG21 VAL 9 0.993 -5.022 2.737
70 HG22 VAL 9 HG22 VAL 9 -0.760 -5.145 2.584
71 HG23 VAL 9 HG23 VAL 9 0.258 -5.221 1.146
72 H ALA 10 H ALA 10 -1.998 -8.752 3.834
73 HA ALA 10 HA ALA 10 -3.896 -6.764 4.394
74 HB1 ALA 10 HB1 ALA 10 -4.064 -9.722 4.966
75 HB2 ALA 10 HB2 ALA 10 -4.468 -8.948 3.435
76 HB3 ALA 10 HB3 ALA 10 -5.424 -8.603 4.877
77 H GLN 11 H GLN 11 -2.218 -9.049 6.522
78 HA GLN 11 HA GLN 11 -3.510 -8.232 8.904
79 HB2 GLN 11 HB2 GLN 11 -0.869 -9.631 8.451
80 HB3 GLN 11 HB3 GLN 11 -1.596 -9.394 10.035
81 HG2 GLN 11 HG2 GLN 11 -2.891 -10.890 7.768
82 HG3 GLN 11 HG3 GLN 11 -1.986 -11.645 9.080
83 HE21 GLN 11 HE21 GLN 11 -4.919 -10.024 8.178
84 HE22 GLN 11 HE22 GLN 11 -5.793 -10.338 9.641
85 H LEU 12 H LEU 12 -0.544 -7.233 7.286
86 HA LEU 12 HA LEU 12 0.442 -5.563 9.329
87 HB2 LEU 12 HB2 LEU 12 1.836 -6.290 7.466
88 HB3 LEU 12 HB3 LEU 12 0.842 -5.383 6.341
89 HG LEU 12 HG LEU 12 1.521 -3.289 7.559
90 HD11 LEU 12 HD11 LEU 12 3.460 -5.175 8.880
91 HD12 LEU 12 HD12 LEU 12 2.183 -4.247 9.670
92 HD13 LEU 12 HD13 LEU 12 3.555 -3.415 8.937
93 HD21 LEU 12 HD21 LEU 12 3.691 -3.146 6.490
94 HD22 LEU 12 HD22 LEU 12 2.550 -3.991 5.445
95 HD23 LEU 12 HD23 LEU 12 3.758 -4.903 6.350
96 H ALA 13 H ALA 13 -1.445 -4.771 6.413
97 HA ALA 13 HA ALA 13 -1.620 -2.015 6.916
98 HB1 ALA 13 HB1 ALA 13 -3.392 -1.994 5.248
99 HB2 ALA 13 HB2 ALA 13 -3.533 -3.748 5.358
100 HB3 ALA 13 HB3 ALA 13 -2.057 -3.020 4.726
101 H ASP 14 H ASP 14 -3.660 -4.710 7.885
102 HA ASP 14 HA ASP 14 -5.810 -3.203 8.898
103 HB2 ASP 14 HB2 ASP 14 -5.961 -5.608 8.407
104 HB3 ASP 14 HB3 ASP 14 -4.859 -5.950 9.737
105 H GLU 15 H GLU 15 -2.874 -4.449 10.445
106 HA GLU 15 HA GLU 15 -3.631 -3.435 13.023
107 HB2 GLU 15 HB2 GLU 15 -2.129 -5.454 12.568
108 HB3 GLU 15 HB3 GLU 15 -0.855 -4.288 12.230
109 HG2 GLU 15 HG2 GLU 15 -0.910 -3.448 14.439
110 HG3 GLU 15 HG3 GLU 15 -2.402 -4.313 14.804
111 H TYR 16 H TYR 16 -1.808 -2.281 10.294
112 HA TYR 16 HA TYR 16 -0.599 -0.078 11.636
113 HB2 TYR 16 HB2 TYR 16 0.315 -0.867 9.531
114 HB3 TYR 16 HB3 TYR 16 -1.201 -0.519 8.706
115 HD1 TYR 16 HD1 TYR 16 1.447 1.207 10.706
116 HD2 TYR 16 HD2 TYR 16 -1.418 1.480 7.575
117 HE1 TYR 16 HE1 TYR 16 2.238 3.476 10.186
118 HE2 TYR 16 HE2 TYR 16 -0.629 3.743 7.045
119 HH TYR 16 HH TYR 16 0.530 5.581 8.119
120 H PHE 17 H PHE 17 -3.609 -0.419 9.727
121 HA PHE 17 HA PHE 17 -4.117 2.381 9.824
122 HB2 PHE 17 HB2 PHE 17 -5.885 2.021 8.440
123 HB3 PHE 17 HB3 PHE 17 -5.014 0.525 8.154
124 HD1 PHE 17 HD1 PHE 17 -7.938 2.049 9.754
125 HD2 PHE 17 HD2 PHE 17 -5.913 -1.579 8.855
126 HE1 PHE 17 HE1 PHE 17 -9.962 0.782 10.339
127 HE2 PHE 17 HE2 PHE 17 -7.929 -2.856 9.445
128 HZ PHE 17 HZ PHE 17 -9.959 -1.679 10.189
129 H GLU 18 H GLU 18 -5.021 -0.285 11.919
130 HA GLU 18 HA GLU 18 -7.138 0.969 13.277
131 HB2 GLU 18 HB2 GLU 18 -6.674 -0.580 15.126
132 HB3 GLU 18 HB3 GLU 18 -6.666 -1.405 13.571
133 HG2 GLU 18 HG2 GLU 18 -4.328 -1.607 13.573
134 HG3 GLU 18 HG3 GLU 18 -4.149 -0.436 14.876
135 H ARG 19 H ARG 19 -3.755 1.543 13.356
136 HA ARG 19 HA ARG 19 -3.876 3.016 15.876
137 HB2 ARG 19 HB2 ARG 19 -1.531 2.580 14.016
138 HB3 ARG 19 HB3 ARG 19 -1.464 3.195 15.661
139 HG2 ARG 19 HG2 ARG 19 -2.323 0.424 14.858
140 HG3 ARG 19 HG3 ARG 19 -0.756 0.871 15.537
141 HD2 ARG 19 HD2 ARG 19 -1.883 1.671 17.563
142 HD3 ARG 19 HD3 ARG 19 -3.432 1.178 16.888
143 HE ARG 19 HE ARG 19 -2.828 -1.083 17.153
144 HH11 ARG 19 HH11 ARG 19 -0.403 1.125 18.420
145 HH12 ARG 19 HH12 ARG 19 0.445 -0.112 19.294
146 HH21 ARG 19 HH21 ARG 19 -1.714 -2.700 18.343
147 HH22 ARG 19 HH22 ARG 19 -0.299 -2.263 19.260
148 H MET 20 H MET 20 -3.293 3.515 12.451
149 HA MET 20 HA MET 20 -2.667 6.314 12.783
150 HB2 MET 20 HB2 MET 20 -1.588 4.765 11.109
151 HB3 MET 20 HB3 MET 20 -3.097 4.789 10.212
152 HG2 MET 20 HG2 MET 20 -1.428 6.306 9.288
153 HG3 MET 20 HG3 MET 20 -2.869 7.161 9.824
154 HE1 MET 20 HE1 MET 20 0.116 5.710 11.970
155 HE2 MET 20 HE2 MET 20 1.150 7.133 12.102
156 HE3 MET 20 HE3 MET 20 0.905 6.365 10.534
157 H ILE 21 H ILE 21 -5.439 4.409 11.916
158 HA ILE 21 HA ILE 21 -6.960 6.711 10.954
159 HB ILE 21 HB ILE 21 -7.681 3.780 11.241
160 HG12 ILE 21 HG12 ILE 21 -6.007 4.190 9.525
161 HG13 ILE 21 HG13 ILE 21 -7.542 3.765 8.777
162 HG21 ILE 21 HG21 ILE 21 -9.276 5.971 9.923
163 HG22 ILE 21 HG22 ILE 21 -9.694 5.139 11.420
164 HG23 ILE 21 HG23 ILE 21 -9.660 4.250 9.897
165 HD11 ILE 21 HD11 ILE 21 -6.419 5.568 7.587
166 HD12 ILE 21 HD12 ILE 21 -6.434 6.552 9.053
167 HD13 ILE 21 HD13 ILE 21 -7.952 6.109 8.272
168 H ALA 22 H ALA 22 -6.106 5.553 13.897
169 HA ALA 22 HA ALA 22 -8.612 5.564 15.272
170 HB1 ALA 22 HB1 ALA 22 -5.802 5.721 16.352
171 HB2 ALA 22 HB2 ALA 22 -6.736 4.249 16.088
172 HB3 ALA 22 HB3 ALA 22 -7.255 5.418 17.303
173 H GLY 23 H GLY 23 -6.556 8.028 14.161
174 HA2 GLY 23 HA2 GLY 23 -7.290 9.926 16.244
175 HA3 GLY 23 HA3 GLY 23 -6.211 10.233 14.893
176 H ARG 24 H ARG 24 -6.975 11.321 13.185
177 HA ARG 24 HA ARG 24 -9.885 11.713 12.995
178 HB2 ARG 24 HB2 ARG 24 -7.658 13.687 12.830
179 HB3 ARG 24 HB3 ARG 24 -9.045 13.924 11.780
180 HG2 ARG 24 HG2 ARG 24 -9.263 15.199 13.829
181 HG3 ARG 24 HG3 ARG 24 -10.521 13.970 13.715
182 HD2 ARG 24 HD2 ARG 24 -9.368 12.563 15.268
183 HD3 ARG 24 HD3 ARG 24 -7.964 13.625 15.262
184 HE ARG 24 HE ARG 24 -10.571 14.590 16.237
185 HH11 ARG 24 HH11 ARG 24 -7.207 13.824 16.784
186 HH12 ARG 24 HH12 ARG 24 -7.108 14.668 18.297
187 HH21 ARG 24 HH21 ARG 24 -10.478 15.670 18.258
188 HH22 ARG 24 HH22 ARG 24 -8.990 15.706 19.148
189 H TRP 25 H TRP 25 -10.311 10.276 11.494
190 HA TRP 25 HA TRP 25 -8.781 10.317 8.992
191 HB2 TRP 25 HB2 TRP 25 -9.611 8.078 8.598
192 HB3 TRP 25 HB3 TRP 25 -8.946 8.155 10.219
193 HD1 TRP 25 HD1 TRP 25 -11.906 7.055 8.368
194 HE1 TRP 25 HE1 TRP 25 -13.832 6.432 9.955
195 HE3 TRP 25 HE3 TRP 25 -10.078 9.057 12.703
196 HZ2 TRP 25 HZ2 TRP 25 -14.486 6.735 12.674
197 HZ3 TRP 25 HZ3 TRP 25 -11.420 8.843 14.754
198 HH2 TRP 25 HH2 TRP 25 -13.579 7.706 14.738
199 H LYS 26 H LYS 26 -12.103 10.230 10.216
200 HA LYS 26 HA LYS 26 -14.069 11.015 9.463
201 HB2 LYS 26 HB2 LYS 26 -12.204 12.883 8.034
202 HB3 LYS 26 HB3 LYS 26 -13.950 13.022 7.879
203 HG2 LYS 26 HG2 LYS 26 -12.230 13.445 10.291
204 HG3 LYS 26 HG3 LYS 26 -13.433 14.519 9.575
205 HD2 LYS 26 HD2 LYS 26 -13.924 11.986 11.131
206 HD3 LYS 26 HD3 LYS 26 -14.354 13.631 11.597
207 HE2 LYS 26 HE2 LYS 26 -15.448 12.335 9.120
208 HE3 LYS 26 HE3 LYS 26 -16.208 12.115 10.688
209 HZ1 LYS 26 HZ1 LYS 26 -15.927 14.582 9.083
210 HZ2 LYS 26 HZ2 LYS 26 -16.209 14.672 10.752
211 HZ3 LYS 26 HZ3 LYS 26 -17.335 13.900 9.744
212 H HIS 27 H HIS 27 -12.427 9.033 7.718
213 HA HIS 27 HA HIS 27 -14.450 8.829 5.639
214 HB2 HIS 27 HB2 HIS 27 -11.519 8.842 4.868
215 HB3 HIS 27 HB3 HIS 27 -12.888 8.653 3.791
216 HD1 HIS 27 HD1 HIS 27 -10.756 11.206 5.386
217 HD2 HIS 27 HD2 HIS 27 -14.371 11.071 3.340
218 HE1 HIS 27 HE1 HIS 27 -11.243 13.577 4.720
219 HE2 HIS 27 HE2 HIS 27 -13.343 13.444 3.328
220 HA PRO 28 HA PRO 28 -12.820 4.999 7.751
221 HB2 PRO 28 HB2 PRO 28 -15.262 3.903 8.314
222 HB3 PRO 28 HB3 PRO 28 -14.427 5.036 9.383
223 HG2 PRO 28 HG2 PRO 28 -16.652 5.528 7.457
224 HG3 PRO 28 HG3 PRO 28 -16.398 6.207 9.073
225 HD2 PRO 28 HD2 PRO 28 -15.851 7.575 6.790
226 HD3 PRO 28 HD3 PRO 28 -14.962 7.829 8.304
227 H ASN 29 H ASN 29 -15.709 5.058 5.653
228 HA ASN 29 HA ASN 29 -15.323 2.422 4.679
229 HB2 ASN 29 HB2 ASN 29 -17.514 3.511 4.772
230 HB3 ASN 29 HB3 ASN 29 -16.969 4.724 3.619
231 HD21 ASN 29 HD21 ASN 29 -18.456 4.285 2.109
232 HD22 ASN 29 HD22 ASN 29 -18.486 2.816 1.205
233 H ILE 30 H ILE 30 -14.472 5.640 3.568
234 HA ILE 30 HA ILE 30 -13.795 5.013 0.930
235 HB ILE 30 HB ILE 30 -12.622 7.177 2.682
236 HG12 ILE 30 HG12 ILE 30 -14.980 7.150 0.795
237 HG13 ILE 30 HG13 ILE 30 -15.031 7.368 2.538
238 HG21 ILE 30 HG21 ILE 30 -12.620 6.863 -0.321
239 HG22 ILE 30 HG22 ILE 30 -11.218 6.791 0.745
240 HG23 ILE 30 HG23 ILE 30 -12.100 8.306 0.548
241 HD11 ILE 30 HD11 ILE 30 -13.795 9.269 0.560
242 HD12 ILE 30 HD12 ILE 30 -13.875 9.497 2.307
243 HD13 ILE 30 HD13 ILE 30 -15.358 9.465 1.353
244 H VAL 31 H VAL 31 -11.658 5.272 3.793
245 HA VAL 31 HA VAL 31 -9.348 4.514 2.336
246 HB VAL 31 HB VAL 31 -9.244 5.808 4.452
247 HG11 VAL 31 HG11 VAL 31 -10.903 4.666 5.773
248 HG12 VAL 31 HG12 VAL 31 -9.345 4.607 6.601
249 HG13 VAL 31 HG13 VAL 31 -9.947 3.183 5.750
250 HG21 VAL 31 HG21 VAL 31 -7.679 3.231 4.445
251 HG22 VAL 31 HG22 VAL 31 -7.260 4.682 5.355
252 HG23 VAL 31 HG23 VAL 31 -7.254 4.717 3.594
253 H ARG 32 H ARG 32 -11.719 2.706 4.211
254 HA ARG 32 HA ARG 32 -10.214 0.294 4.292
255 HB2 ARG 32 HB2 ARG 32 -11.983 0.838 5.920
256 HB3 ARG 32 HB3 ARG 32 -13.185 0.727 4.645
257 HG2 ARG 32 HG2 ARG 32 -13.075 -1.260 6.115
258 HG3 ARG 32 HG3 ARG 32 -12.822 -1.622 4.407
259 HD2 ARG 32 HD2 ARG 32 -10.484 -1.876 4.718
260 HD3 ARG 32 HD3 ARG 32 -10.557 -1.189 6.340
261 HE ARG 32 HE ARG 32 -10.989 -3.275 7.119
262 HH11 ARG 32 HH11 ARG 32 -11.988 -3.203 3.756
263 HH12 ARG 32 HH12 ARG 32 -12.420 -4.885 3.721
264 HH21 ARG 32 HH21 ARG 32 -11.522 -5.480 7.060
265 HH22 ARG 32 HH22 ARG 32 -12.178 -6.179 5.609
266 H SER 33 H SER 33 -12.711 1.562 2.135
267 HA SER 33 HA SER 33 -12.894 -0.795 0.553
268 HB2 SER 33 HB2 SER 33 -14.664 0.954 0.616
269 HB3 SER 33 HB3 SER 33 -13.568 2.056 -0.218
270 HG SER 33 HG SER 33 -13.875 -0.386 -1.446
271 H ARG 34 H ARG 34 -10.915 2.117 0.438
272 HA ARG 34 HA ARG 34 -9.811 1.648 -2.118
273 HB2 ARG 34 HB2 ARG 34 -9.659 3.848 -1.073
274 HB3 ARG 34 HB3 ARG 34 -8.641 3.189 0.203
275 HG2 ARG 34 HG2 ARG 34 -6.930 2.630 -1.440
276 HG3 ARG 34 HG3 ARG 34 -7.947 3.278 -2.726
277 HD2 ARG 34 HD2 ARG 34 -7.840 5.488 -1.721
278 HD3 ARG 34 HD3 ARG 34 -6.874 4.849 -0.389
279 HE ARG 34 HE ARG 34 -5.679 4.322 -2.940
280 HH11 ARG 34 HH11 ARG 34 -6.117 6.771 -0.479
281 HH12 ARG 34 HH12 ARG 34 -4.665 7.640 -0.888
282 HH21 ARG 34 HH21 ARG 34 -3.760 5.463 -3.492
283 HH22 ARG 34 HH22 ARG 34 -3.342 6.893 -2.601
284 H ILE 35 H ILE 35 -8.593 0.899 1.150
285 HA ILE 35 HA ILE 35 -6.115 -0.090 0.429
286 HB ILE 35 HB ILE 35 -7.898 -0.982 2.696
287 HG12 ILE 35 HG12 ILE 35 -5.499 0.864 2.614
288 HG13 ILE 35 HG13 ILE 35 -7.178 1.382 2.726
289 HG21 ILE 35 HG21 ILE 35 -6.305 -2.751 2.209
290 HG22 ILE 35 HG22 ILE 35 -5.876 -1.937 3.713
291 HG23 ILE 35 HG23 ILE 35 -4.978 -1.590 2.234
292 HD11 ILE 35 HD11 ILE 35 -7.370 0.256 4.888
293 HD12 ILE 35 HD12 ILE 35 -6.092 1.470 4.889
294 HD13 ILE 35 HD13 ILE 35 -5.682 -0.241 4.774
295 H GLU 36 H GLU 36 -9.133 -1.968 0.788
296 HA GLU 36 HA GLU 36 -7.845 -4.413 0.116
297 HB2 GLU 36 HB2 GLU 36 -10.762 -3.703 0.359
298 HB3 GLU 36 HB3 GLU 36 -10.173 -5.334 0.064
299 HG2 GLU 36 HG2 GLU 36 -9.636 -3.621 2.477
300 HG3 GLU 36 HG3 GLU 36 -10.640 -5.066 2.401
301 H LYS 37 H LYS 37 -9.076 -1.913 -1.857
302 HA LYS 37 HA LYS 37 -9.231 -3.786 -4.123
303 HB2 LYS 37 HB2 LYS 37 -11.274 -2.645 -4.015
304 HB3 LYS 37 HB3 LYS 37 -10.504 -1.114 -3.619
305 HG2 LYS 37 HG2 LYS 37 -11.381 -1.112 -5.888
306 HG3 LYS 37 HG3 LYS 37 -9.625 -0.949 -5.877
307 HD2 LYS 37 HD2 LYS 37 -9.580 -3.493 -6.217
308 HD3 LYS 37 HD3 LYS 37 -11.289 -3.332 -6.641
309 HE2 LYS 37 HE2 LYS 37 -10.655 -1.660 -8.349
310 HE3 LYS 37 HE3 LYS 37 -8.964 -1.948 -7.966
311 HZ1 LYS 37 HZ1 LYS 37 -10.856 -3.993 -9.002
312 HZ2 LYS 37 HZ2 LYS 37 -9.215 -4.243 -8.659
313 HZ3 LYS 37 HZ3 LYS 37 -9.668 -3.198 -9.916
314 H ASP 38 H ASP 38 -8.187 -0.466 -3.449
315 HA ASP 38 HA ASP 38 -6.724 -0.172 -5.847
316 HB2 ASP 38 HB2 ASP 38 -7.734 1.645 -4.405
317 HB3 ASP 38 HB3 ASP 38 -6.387 1.418 -3.301
318 H ILE 39 H ILE 39 -5.820 -1.107 -2.572
319 HA ILE 39 HA ILE 39 -2.992 -1.135 -3.285
320 HB ILE 39 HB ILE 39 -4.309 -1.684 -0.621
321 HG12 ILE 39 HG12 ILE 39 -2.911 0.797 -1.654
322 HG13 ILE 39 HG13 ILE 39 -4.647 0.629 -1.418
323 HG21 ILE 39 HG21 ILE 39 -2.073 -1.423 0.319
324 HG22 ILE 39 HG22 ILE 39 -1.410 -1.200 -1.301
325 HG23 ILE 39 HG23 ILE 39 -2.117 -2.749 -0.843
326 HD11 ILE 39 HD11 ILE 39 -4.285 0.348 0.981
327 HD12 ILE 39 HD12 ILE 39 -3.633 1.878 0.394
328 HD13 ILE 39 HD13 ILE 39 -2.548 0.529 0.736
329 H LYS 40 H LYS 40 -5.596 -3.390 -2.565
330 HA LYS 40 HA LYS 40 -3.726 -5.644 -2.817
331 HB2 LYS 40 HB2 LYS 40 -6.598 -6.108 -2.197
332 HB3 LYS 40 HB3 LYS 40 -5.172 -6.920 -1.570
333 HG2 LYS 40 HG2 LYS 40 -5.875 -4.114 -0.792
334 HG3 LYS 40 HG3 LYS 40 -6.542 -5.514 0.042
335 HD2 LYS 40 HD2 LYS 40 -3.590 -5.148 -0.330
336 HD3 LYS 40 HD3 LYS 40 -4.458 -4.434 1.034
337 HE2 LYS 40 HE2 LYS 40 -4.423 -7.358 0.310
338 HE3 LYS 40 HE3 LYS 40 -3.475 -6.604 1.585
339 HZ1 LYS 40 HZ1 LYS 40 -5.398 -6.133 2.830
340 HZ2 LYS 40 HZ2 LYS 40 -5.612 -7.727 2.281
341 HZ3 LYS 40 HZ3 LYS 40 -6.434 -6.456 1.531
342 HA PRO 41 HA PRO 41 -5.918 -5.989 -6.840
343 HB2 PRO 41 HB2 PRO 41 -3.756 -6.249 -8.435
344 HB3 PRO 41 HB3 PRO 41 -4.388 -4.676 -7.947
345 HG2 PRO 41 HG2 PRO 41 -1.978 -6.116 -7.010
346 HG3 PRO 41 HG3 PRO 41 -2.290 -4.376 -7.101
347 HD2 PRO 41 HD2 PRO 41 -2.439 -6.007 -4.800
348 HD3 PRO 41 HD3 PRO 41 -2.984 -4.328 -4.950
349 H ALA 42 H ALA 42 -2.836 -7.727 -6.302
350 HA ALA 42 HA ALA 42 -4.283 -10.260 -6.322
351 HB1 ALA 42 HB1 ALA 42 -2.754 -11.246 -7.965
352 HB2 ALA 42 HB2 ALA 42 -1.970 -9.679 -8.173
353 HB3 ALA 42 HB3 ALA 42 -3.651 -9.894 -8.655
354 H ILE 43 H ILE 43 -2.616 -8.474 -4.503
355 HA ILE 43 HA ILE 43 -0.653 -10.515 -3.691
356 HB ILE 43 HB ILE 43 0.637 -8.576 -2.681
357 HG12 ILE 43 HG12 ILE 43 -0.981 -6.944 -4.640
358 HG13 ILE 43 HG13 ILE 43 -1.326 -6.989 -2.915
359 HG21 ILE 43 HG21 ILE 43 1.730 -8.014 -4.815
360 HG22 ILE 43 HG22 ILE 43 0.381 -8.746 -5.680
361 HG23 ILE 43 HG23 ILE 43 1.414 -9.742 -4.656
362 HD11 ILE 43 HD11 ILE 43 -0.031 -5.027 -3.486
363 HD12 ILE 43 HD12 ILE 43 1.225 -6.036 -4.200
364 HD13 ILE 43 HD13 ILE 43 0.918 -6.106 -2.464
365 H GLY 44 H GLY 44 -3.552 -9.656 -2.874
366 HA2 GLY 44 HA2 GLY 44 -3.361 -8.600 -0.250
367 HA3 GLY 44 HA3 GLY 44 -4.755 -9.429 -0.920
368 H SER 45 H SER 45 -3.255 -11.867 -1.480
369 HA SER 45 HA SER 45 -3.283 -12.962 1.230
370 HB2 SER 45 HB2 SER 45 -3.135 -14.460 -1.394
371 HB3 SER 45 HB3 SER 45 -3.598 -15.099 0.185
372 HG SER 45 HG SER 45 -5.379 -13.524 0.071
373 H LEU 46 H LEU 46 -1.052 -11.398 -0.120
374 HA LEU 46 HA LEU 46 1.075 -13.430 -0.037
375 HB2 LEU 46 HB2 LEU 46 0.579 -11.917 -2.105
376 HB3 LEU 46 HB3 LEU 46 1.374 -10.668 -1.170
377 HG LEU 46 HG LEU 46 3.411 -12.060 -1.073
378 HD11 LEU 46 HD11 LEU 46 3.586 -14.024 -2.526
379 HD12 LEU 46 HD12 LEU 46 1.871 -13.891 -2.911
380 HD13 LEU 46 HD13 LEU 46 2.376 -14.259 -1.262
381 HD21 LEU 46 HD21 LEU 46 3.108 -10.370 -2.831
382 HD22 LEU 46 HD22 LEU 46 2.373 -11.595 -3.868
383 HD23 LEU 46 HD23 LEU 46 4.065 -11.743 -3.392
384 H LYS 47 H LYS 47 3.043 -12.896 1.105
385 HA LYS 47 HA LYS 47 2.539 -11.452 3.532
386 HB2 LYS 47 HB2 LYS 47 5.088 -12.675 2.479
387 HB3 LYS 47 HB3 LYS 47 4.916 -11.957 4.069
388 HG2 LYS 47 HG2 LYS 47 3.137 -13.662 4.536
389 HG3 LYS 47 HG3 LYS 47 3.598 -14.441 3.018
390 HD2 LYS 47 HD2 LYS 47 5.295 -14.017 5.474
391 HD3 LYS 47 HD3 LYS 47 4.796 -15.544 4.752
392 HE2 LYS 47 HE2 LYS 47 6.140 -15.033 2.764
393 HE3 LYS 47 HE3 LYS 47 6.641 -13.517 3.499
394 HZ1 LYS 47 HZ1 LYS 47 7.305 -16.259 4.411
395 HZ2 LYS 47 HZ2 LYS 47 7.611 -14.871 5.337
396 HZ3 LYS 47 HZ3 LYS 47 8.371 -15.074 3.837
397 H VAL 48 H VAL 48 4.378 -9.999 4.345
398 HA VAL 48 HA VAL 48 4.582 -7.741 2.545
399 HB VAL 48 HB VAL 48 5.823 -8.045 5.286
400 HG11 VAL 48 HG11 VAL 48 5.769 -5.595 5.312
401 HG12 VAL 48 HG12 VAL 48 5.125 -5.598 3.670
402 HG13 VAL 48 HG13 VAL 48 6.747 -6.220 3.982
403 HG21 VAL 48 HG21 VAL 48 3.844 -6.884 6.158
404 HG22 VAL 48 HG22 VAL 48 3.429 -8.442 5.445
405 HG23 VAL 48 HG23 VAL 48 3.105 -6.953 4.558
406 H GLU 49 H GLU 49 6.482 -10.385 3.614
407 HA GLU 49 HA GLU 49 9.045 -9.417 2.855
408 HB2 GLU 49 HB2 GLU 49 8.713 -11.249 4.460
409 HB3 GLU 49 HB3 GLU 49 8.002 -12.237 3.194
410 HG2 GLU 49 HG2 GLU 49 10.158 -12.185 1.995
411 HG3 GLU 49 HG3 GLU 49 10.851 -11.288 3.348
412 H ASP 50 H ASP 50 6.330 -10.522 1.136
413 HA ASP 50 HA ASP 50 7.886 -11.428 -1.163
414 HB2 ASP 50 HB2 ASP 50 4.955 -11.610 -0.483
415 HB3 ASP 50 HB3 ASP 50 5.592 -12.046 -2.063
416 H VAL 51 H VAL 51 6.064 -8.682 -0.097
417 HA VAL 51 HA VAL 51 5.365 -7.825 -2.740
418 HB VAL 51 HB VAL 51 3.900 -7.165 -0.946
419 HG11 VAL 51 HG11 VAL 51 6.219 -5.602 0.173
420 HG12 VAL 51 HG12 VAL 51 5.463 -7.023 0.894
421 HG13 VAL 51 HG13 VAL 51 4.552 -5.518 0.748
422 HG21 VAL 51 HG21 VAL 51 4.051 -5.704 -2.894
423 HG22 VAL 51 HG22 VAL 51 5.311 -4.763 -2.096
424 HG23 VAL 51 HG23 VAL 51 3.677 -4.790 -1.433
425 H LYS 52 H LYS 52 7.313 -7.910 -3.771
426 HA LYS 52 HA LYS 52 9.424 -6.065 -3.061
427 HB2 LYS 52 HB2 LYS 52 10.531 -7.074 -5.081
428 HB3 LYS 52 HB3 LYS 52 10.119 -8.214 -3.812
429 HG2 LYS 52 HG2 LYS 52 7.970 -8.607 -5.187
430 HG3 LYS 52 HG3 LYS 52 8.881 -7.855 -6.500
431 HD2 LYS 52 HD2 LYS 52 9.093 -10.299 -6.536
432 HD3 LYS 52 HD3 LYS 52 10.647 -9.515 -6.238
433 HE2 LYS 52 HE2 LYS 52 10.420 -9.947 -3.847
434 HE3 LYS 52 HE3 LYS 52 8.848 -10.694 -4.121
435 HZ1 LYS 52 HZ1 LYS 52 11.420 -11.682 -5.227
436 HZ2 LYS 52 HZ2 LYS 52 9.904 -12.423 -5.400
437 HZ3 LYS 52 HZ3 LYS 52 10.630 -12.322 -3.871
438 HA PRO 53 HA PRO 53 8.647 -2.519 -5.459
439 HB2 PRO 53 HB2 PRO 53 10.988 -3.177 -7.193
440 HB3 PRO 53 HB3 PRO 53 10.591 -1.672 -6.356
441 HG2 PRO 53 HG2 PRO 53 12.451 -3.304 -5.387
442 HG3 PRO 53 HG3 PRO 53 11.326 -2.464 -4.304
443 HD2 PRO 53 HD2 PRO 53 11.377 -5.320 -5.141
444 HD3 PRO 53 HD3 PRO 53 10.873 -4.603 -3.599
445 H ARG 54 H ARG 54 9.323 -5.389 -7.431
446 HA ARG 54 HA ARG 54 8.370 -4.382 -9.861
447 HB2 ARG 54 HB2 ARG 54 9.040 -7.010 -8.785
448 HB3 ARG 54 HB3 ARG 54 7.775 -7.055 -10.013
449 HG2 ARG 54 HG2 ARG 54 10.496 -5.798 -10.306
450 HG3 ARG 54 HG3 ARG 54 9.948 -7.312 -11.037
451 HD2 ARG 54 HD2 ARG 54 8.407 -6.205 -12.422
452 HD3 ARG 54 HD3 ARG 54 8.514 -4.715 -11.494
453 HE ARG 54 HE ARG 54 11.041 -5.331 -12.591
454 HH11 ARG 54 HH11 ARG 54 7.843 -4.307 -13.601
455 HH12 ARG 54 HH12 ARG 54 8.430 -3.294 -14.893
456 HH21 ARG 54 HH21 ARG 54 11.826 -4.006 -14.289
457 HH22 ARG 54 HH22 ARG 54 10.698 -3.118 -15.274
458 H HIS 55 H HIS 55 6.637 -5.701 -7.137
459 HA HIS 55 HA HIS 55 4.122 -5.907 -8.493
460 HB2 HIS 55 HB2 HIS 55 4.653 -5.620 -5.522
461 HB3 HIS 55 HB3 HIS 55 3.121 -6.087 -6.250
462 HD1 HIS 55 HD1 HIS 55 3.178 -8.467 -7.570
463 HD2 HIS 55 HD2 HIS 55 6.314 -7.671 -4.954
464 HE1 HIS 55 HE1 HIS 55 4.284 -10.683 -7.120
465 HE2 HIS 55 HE2 HIS 55 6.064 -10.208 -5.415
466 H ILE 56 H ILE 56 5.827 -3.444 -6.702
467 HA ILE 56 HA ILE 56 3.675 -1.635 -6.357
468 HB ILE 56 HB ILE 56 6.636 -1.025 -6.456
469 HG12 ILE 56 HG12 ILE 56 6.161 -2.736 -4.780
470 HG13 ILE 56 HG13 ILE 56 6.558 -1.212 -3.996
471 HG21 ILE 56 HG21 ILE 56 5.280 0.977 -6.663
472 HG22 ILE 56 HG22 ILE 56 6.064 0.926 -5.083
473 HG23 ILE 56 HG23 ILE 56 4.353 0.520 -5.233
474 HD11 ILE 56 HD11 ILE 56 3.792 -2.332 -4.382
475 HD12 ILE 56 HD12 ILE 56 4.184 -0.800 -3.599
476 HD13 ILE 56 HD13 ILE 56 4.715 -2.321 -2.880
477 H ASP 57 H ASP 57 5.987 -2.182 -8.936
478 HA ASP 57 HA ASP 57 5.629 0.257 -10.318
479 HB2 ASP 57 HB2 ASP 57 7.533 -1.237 -10.745
480 HB3 ASP 57 HB3 ASP 57 6.444 -2.464 -11.382
481 H ASP 58 H ASP 58 4.074 -2.907 -10.647
482 HA ASP 58 HA ASP 58 2.436 -2.134 -12.834
483 HB2 ASP 58 HB2 ASP 58 2.352 -4.438 -10.912
484 HB3 ASP 58 HB3 ASP 58 1.049 -4.177 -12.066
485 H VAL 59 H VAL 59 1.883 -2.251 -9.322
486 HA VAL 59 HA VAL 59 -0.874 -1.637 -9.525
487 HB VAL 59 HB VAL 59 -0.862 -1.176 -7.143
488 HG11 VAL 59 HG11 VAL 59 0.021 -3.342 -6.354
489 HG12 VAL 59 HG12 VAL 59 0.804 -3.558 -7.921
490 HG13 VAL 59 HG13 VAL 59 -0.954 -3.475 -7.817
491 HG21 VAL 59 HG21 VAL 59 2.143 -1.384 -7.310
492 HG22 VAL 59 HG22 VAL 59 1.204 -1.307 -5.819
493 HG23 VAL 59 HG23 VAL 59 1.211 0.064 -6.928
494 H LEU 60 H LEU 60 2.000 0.398 -9.210
495 HA LEU 60 HA LEU 60 0.640 2.847 -8.793
496 HB2 LEU 60 HB2 LEU 60 3.326 2.207 -10.013
497 HB3 LEU 60 HB3 LEU 60 2.758 3.847 -9.799
498 HG LEU 60 HG LEU 60 3.261 1.838 -7.610
499 HD11 LEU 60 HD11 LEU 60 5.058 3.370 -6.971
500 HD12 LEU 60 HD12 LEU 60 4.703 4.368 -8.381
501 HD13 LEU 60 HD13 LEU 60 5.296 2.720 -8.593
502 HD21 LEU 60 HD21 LEU 60 2.792 3.696 -6.076
503 HD22 LEU 60 HD22 LEU 60 1.378 3.268 -7.042
504 HD23 LEU 60 HD23 LEU 60 2.324 4.701 -7.448
505 H LYS 61 H LYS 61 1.649 1.143 -11.709
506 HA LYS 61 HA LYS 61 0.758 3.034 -13.583
507 HB2 LYS 61 HB2 LYS 61 2.248 1.337 -14.264
508 HB3 LYS 61 HB3 LYS 61 1.252 0.070 -13.575
509 HG2 LYS 61 HG2 LYS 61 -0.412 0.440 -15.336
510 HG3 LYS 61 HG3 LYS 61 0.636 1.681 -16.036
511 HD2 LYS 61 HD2 LYS 61 0.864 -0.550 -17.098
512 HD3 LYS 61 HD3 LYS 61 2.371 0.077 -16.440
513 HE2 LYS 61 HE2 LYS 61 1.765 -1.276 -14.340
514 HE3 LYS 61 HE3 LYS 61 0.599 -2.100 -15.374
515 HZ1 LYS 61 HZ1 LYS 61 2.396 -2.766 -16.832
516 HZ2 LYS 61 HZ2 LYS 61 2.700 -3.292 -15.244
517 HZ3 LYS 61 HZ3 LYS 61 3.523 -1.942 -15.864
518 H ALA 62 H ALA 62 -0.811 0.306 -11.970
519 HA ALA 62 HA ALA 62 -3.257 0.441 -13.385
520 HB1 ALA 62 HB1 ALA 62 -4.143 -0.985 -11.600
521 HB2 ALA 62 HB2 ALA 62 -2.686 -0.692 -10.649
522 HB3 ALA 62 HB3 ALA 62 -2.579 -1.558 -12.182
523 H VAL 63 H VAL 63 -2.271 1.763 -10.219
524 HA VAL 63 HA VAL 63 -4.811 2.882 -9.638
525 HB VAL 63 HB VAL 63 -3.702 4.117 -7.842
526 HG11 VAL 63 HG11 VAL 63 -2.677 1.298 -8.069
527 HG12 VAL 63 HG12 VAL 63 -4.268 1.774 -7.478
528 HG13 VAL 63 HG13 VAL 63 -2.822 2.236 -6.581
529 HG21 VAL 63 HG21 VAL 63 -1.301 3.932 -7.470
530 HG22 VAL 63 HG22 VAL 63 -1.672 4.779 -8.972
531 HG23 VAL 63 HG23 VAL 63 -1.131 3.101 -9.015
532 H MET 64 H MET 64 -2.083 4.018 -11.461
533 HA MET 64 HA MET 64 -2.847 6.763 -11.521
534 HB2 MET 64 HB2 MET 64 -0.555 6.098 -11.979
535 HB3 MET 64 HB3 MET 64 -1.078 5.154 -13.367
536 HG2 MET 64 HG2 MET 64 -1.808 7.199 -14.483
537 HG3 MET 64 HG3 MET 64 -1.288 8.141 -13.088
538 HE1 MET 64 HE1 MET 64 1.414 6.652 -12.263
539 HE2 MET 64 HE2 MET 64 1.251 8.407 -12.341
540 HE3 MET 64 HE3 MET 64 2.598 7.611 -13.155
541 H LYS 65 H LYS 65 -3.275 4.042 -13.747
542 HA LYS 65 HA LYS 65 -4.587 5.591 -15.742
543 HB2 LYS 65 HB2 LYS 65 -4.980 3.474 -16.859
544 HB3 LYS 65 HB3 LYS 65 -3.337 3.554 -16.251
545 HG2 LYS 65 HG2 LYS 65 -4.170 2.234 -14.254
546 HG3 LYS 65 HG3 LYS 65 -5.629 1.944 -15.203
547 HD2 LYS 65 HD2 LYS 65 -2.829 1.268 -16.083
548 HD3 LYS 65 HD3 LYS 65 -3.970 0.120 -15.385
549 HE2 LYS 65 HE2 LYS 65 -5.500 0.494 -17.248
550 HE3 LYS 65 HE3 LYS 65 -4.388 1.679 -17.935
551 HZ1 LYS 65 HZ1 LYS 65 -4.286 -0.627 -18.899
552 HZ2 LYS 65 HZ2 LYS 65 -3.603 -1.135 -17.432
553 HZ3 LYS 65 HZ3 LYS 65 -2.806 0.016 -18.384
554 H ARG 66 H ARG 66 -5.696 3.582 -13.093
555 HA ARG 66 HA ARG 66 -8.428 3.522 -13.875
556 HB2 ARG 66 HB2 ARG 66 -8.918 2.699 -11.651
557 HB3 ARG 66 HB3 ARG 66 -7.484 1.905 -12.287
558 HG2 ARG 66 HG2 ARG 66 -6.060 3.309 -10.925
559 HG3 ARG 66 HG3 ARG 66 -7.466 4.201 -10.340
560 HD2 ARG 66 HD2 ARG 66 -6.608 2.470 -8.759
561 HD3 ARG 66 HD3 ARG 66 -8.303 2.279 -9.198
562 HE ARG 66 HE ARG 66 -7.264 0.627 -10.932
563 HH11 ARG 66 HH11 ARG 66 -6.161 1.111 -7.629
564 HH12 ARG 66 HH12 ARG 66 -5.703 -0.556 -7.422
565 HH21 ARG 66 HH21 ARG 66 -6.684 -1.544 -10.648
566 HH22 ARG 66 HH22 ARG 66 -6.026 -2.076 -9.126
567 H GLY 67 H GLY 67 -6.535 5.987 -12.417
568 HA2 GLY 67 HA2 GLY 67 -8.955 7.609 -12.124
569 HA3 GLY 67 HA3 GLY 67 -7.929 7.417 -10.711
570 H ALA 68 H ALA 68 -5.818 8.297 -10.741
571 HA ALA 68 HA ALA 68 -5.071 10.101 -12.871
572 HB1 ALA 68 HB1 ALA 68 -5.823 11.193 -10.157
573 HB2 ALA 68 HB2 ALA 68 -6.726 11.437 -11.653
574 HB3 ALA 68 HB3 ALA 68 -5.106 12.115 -11.478
575 HA PRO 69 HA PRO 69 -0.966 9.281 -11.444
576 HB2 PRO 69 HB2 PRO 69 0.125 11.837 -11.523
577 HB3 PRO 69 HB3 PRO 69 0.021 10.724 -12.888
578 HG2 PRO 69 HG2 PRO 69 -1.758 13.009 -12.170
579 HG3 PRO 69 HG3 PRO 69 -1.216 12.463 -13.766
580 HD2 PRO 69 HD2 PRO 69 -3.688 11.935 -12.879
581 HD3 PRO 69 HD3 PRO 69 -2.783 10.758 -13.857
582 H SER 70 H SER 70 -2.667 11.991 -9.952
583 HA SER 70 HA SER 70 -1.011 12.310 -7.708
584 HB2 SER 70 HB2 SER 70 -3.981 12.839 -7.954
585 HB3 SER 70 HB3 SER 70 -2.923 13.477 -6.695
586 HG SER 70 HG SER 70 -2.229 14.954 -8.023
587 H ILE 71 H ILE 71 -3.530 10.000 -8.432
588 HA ILE 71 HA ILE 71 -3.974 9.095 -5.783
589 HB ILE 71 HB ILE 71 -4.325 7.619 -8.400
590 HG12 ILE 71 HG12 ILE 71 -6.301 9.107 -6.654
591 HG13 ILE 71 HG13 ILE 71 -5.685 9.657 -8.209
592 HG21 ILE 71 HG21 ILE 71 -5.407 6.950 -5.662
593 HG22 ILE 71 HG22 ILE 71 -4.126 6.080 -6.503
594 HG23 ILE 71 HG23 ILE 71 -5.763 6.088 -7.159
595 HD11 ILE 71 HD11 ILE 71 -6.756 7.773 -9.310
596 HD12 ILE 71 HD12 ILE 71 -7.926 8.735 -8.405
597 HD13 ILE 71 HD13 ILE 71 -7.357 7.198 -7.754
598 H ALA 72 H ALA 72 -1.843 7.992 -8.395
599 HA ALA 72 HA ALA 72 -0.630 5.841 -7.092
600 HB1 ALA 72 HB1 ALA 72 -0.352 6.317 -9.485
601 HB2 ALA 72 HB2 ALA 72 1.200 6.112 -8.673
602 HB3 ALA 72 HB3 ALA 72 0.627 7.728 -9.084
603 H ASN 73 H ASN 73 0.182 9.275 -7.107
604 HA ASN 73 HA ASN 73 2.496 9.178 -5.526
605 HB2 ASN 73 HB2 ASN 73 0.405 11.365 -5.701
606 HB3 ASN 73 HB3 ASN 73 2.009 11.553 -5.006
607 HD21 ASN 73 HD21 ASN 73 0.807 12.993 -7.164
608 HD22 ASN 73 HD22 ASN 73 1.813 12.739 -8.551
609 H ASP 74 H ASP 74 -0.872 9.795 -4.616
610 HA ASP 74 HA ASP 74 -0.453 10.011 -1.853
611 HB2 ASP 74 HB2 ASP 74 -2.522 10.688 -3.126
612 HB3 ASP 74 HB3 ASP 74 -2.969 8.987 -3.174
613 H THR 75 H THR 75 -1.032 7.170 -3.881
614 HA THR 75 HA THR 75 -1.338 5.290 -1.811
615 HB THR 75 HB THR 75 -0.112 4.843 -4.547
616 HG1 THR 75 HG1 THR 75 -2.480 3.967 -4.696
617 HG21 THR 75 HG21 THR 75 -1.398 2.895 -2.624
618 HG22 THR 75 HG22 THR 75 0.324 2.998 -2.989
619 HG23 THR 75 HG23 THR 75 -0.816 2.515 -4.246
620 H LEU 76 H LEU 76 1.600 6.200 -3.649
621 HA LEU 76 HA LEU 76 3.449 4.673 -2.211
622 HB2 LEU 76 HB2 LEU 76 3.762 7.334 -3.595
623 HB3 LEU 76 HB3 LEU 76 5.111 6.423 -2.943
624 HG LEU 76 HG LEU 76 3.254 5.386 -5.080
625 HD11 LEU 76 HD11 LEU 76 4.518 7.340 -5.857
626 HD12 LEU 76 HD12 LEU 76 5.058 5.854 -6.640
627 HD13 LEU 76 HD13 LEU 76 6.019 6.565 -5.343
628 HD21 LEU 76 HD21 LEU 76 4.976 3.686 -5.381
629 HD22 LEU 76 HD22 LEU 76 4.354 3.663 -3.730
630 HD23 LEU 76 HD23 LEU 76 5.920 4.397 -4.072
631 H ARG 77 H ARG 77 2.262 7.922 -1.683
632 HA ARG 77 HA ARG 77 3.813 8.823 0.402
633 HB2 ARG 77 HB2 ARG 77 1.855 9.880 -0.952
634 HB3 ARG 77 HB3 ARG 77 0.841 9.244 0.330
635 HG2 ARG 77 HG2 ARG 77 2.081 10.572 1.964
636 HG3 ARG 77 HG3 ARG 77 3.088 11.218 0.662
637 HD2 ARG 77 HD2 ARG 77 0.951 11.978 -0.444
638 HD3 ARG 77 HD3 ARG 77 0.128 11.572 1.059
639 HE ARG 77 HE ARG 77 2.351 13.484 1.100
640 HH11 ARG 77 HH11 ARG 77 -1.033 12.742 1.560
641 HH12 ARG 77 HH12 ARG 77 -1.427 14.315 2.189
642 HH21 ARG 77 HH21 ARG 77 1.848 15.558 1.941
643 HH22 ARG 77 HH22 ARG 77 0.214 15.907 2.429
644 H TRP 78 H TRP 78 0.921 6.791 0.526
645 HA TRP 78 HA TRP 78 0.906 6.545 3.380
646 HB2 TRP 78 HB2 TRP 78 -1.118 6.414 1.928
647 HB3 TRP 78 HB3 TRP 78 -0.524 4.888 1.289
648 HD1 TRP 78 HD1 TRP 78 -1.192 2.753 2.575
649 HE1 TRP 78 HE1 TRP 78 -2.448 2.281 4.771
650 HE3 TRP 78 HE3 TRP 78 -1.403 7.516 4.436
651 HZ2 TRP 78 HZ2 TRP 78 -3.403 3.733 6.992
652 HZ3 TRP 78 HZ3 TRP 78 -2.515 7.884 6.600
653 HH2 TRP 78 HH2 TRP 78 -3.491 6.030 7.850
654 H LEU 79 H LEU 79 1.959 4.525 0.674
655 HA LEU 79 HA LEU 79 2.327 2.104 1.984
656 HB2 LEU 79 HB2 LEU 79 3.907 3.233 -0.322
657 HB3 LEU 79 HB3 LEU 79 3.937 1.557 0.184
658 HG LEU 79 HG LEU 79 1.546 3.031 -0.917
659 HD11 LEU 79 HD11 LEU 79 3.255 2.532 -2.594
660 HD12 LEU 79 HD12 LEU 79 1.808 1.554 -2.837
661 HD13 LEU 79 HD13 LEU 79 3.243 0.838 -2.104
662 HD21 LEU 79 HD21 LEU 79 1.849 0.142 -0.108
663 HD22 LEU 79 HD22 LEU 79 0.436 0.855 -0.888
664 HD23 LEU 79 HD23 LEU 79 0.894 1.360 0.739
665 H LYS 80 H LYS 80 4.656 4.759 1.586
666 HA LYS 80 HA LYS 80 6.950 3.506 2.501
667 HB2 LYS 80 HB2 LYS 80 6.167 6.368 3.061
668 HB3 LYS 80 HB3 LYS 80 7.798 5.713 3.004
669 HG2 LYS 80 HG2 LYS 80 7.612 5.312 0.644
670 HG3 LYS 80 HG3 LYS 80 5.914 5.796 0.656
671 HD2 LYS 80 HD2 LYS 80 7.165 7.640 -0.158
672 HD3 LYS 80 HD3 LYS 80 6.670 8.041 1.485
673 HE2 LYS 80 HE2 LYS 80 8.796 8.465 1.939
674 HE3 LYS 80 HE3 LYS 80 9.106 6.740 1.778
675 HZ1 LYS 80 HZ1 LYS 80 10.613 7.842 0.343
676 HZ2 LYS 80 HZ2 LYS 80 9.407 8.827 -0.319
677 HZ3 LYS 80 HZ3 LYS 80 9.428 7.169 -0.662
678 H ARG 81 H ARG 81 4.759 5.520 4.445
679 HA ARG 81 HA ARG 81 5.850 4.930 6.945
680 HB2 ARG 81 HB2 ARG 81 3.281 6.020 5.985
681 HB3 ARG 81 HB3 ARG 81 3.257 5.314 7.593
682 HG2 ARG 81 HG2 ARG 81 5.057 6.781 8.293
683 HG3 ARG 81 HG3 ARG 81 5.140 7.470 6.670
684 HD2 ARG 81 HD2 ARG 81 3.057 8.499 6.875
685 HD3 ARG 81 HD3 ARG 81 2.597 7.503 8.254
686 HE ARG 81 HE ARG 81 4.106 8.772 9.621
687 HH11 ARG 81 HH11 ARG 81 3.598 10.091 6.414
688 HH12 ARG 81 HH12 ARG 81 4.082 11.694 6.870
689 HH21 ARG 81 HH21 ARG 81 4.737 10.865 10.229
690 HH22 ARG 81 HH22 ARG 81 4.733 12.141 9.043
691 H MET 82 H MET 82 3.382 3.201 5.112
692 HA MET 82 HA MET 82 2.586 1.447 7.163
693 HB2 MET 82 HB2 MET 82 1.334 1.795 5.050
694 HB3 MET 82 HB3 MET 82 2.586 0.905 4.190
695 HG2 MET 82 HG2 MET 82 2.085 -1.082 5.526
696 HG3 MET 82 HG3 MET 82 0.825 -0.191 6.374
697 HE1 MET 82 HE1 MET 82 0.662 -1.295 1.889
698 HE2 MET 82 HE2 MET 82 1.941 -1.826 2.983
699 HE3 MET 82 HE3 MET 82 1.802 -0.122 2.549
700 H PHE 83 H PHE 83 5.118 1.124 4.690
701 HA PHE 83 HA PHE 83 5.831 -1.536 5.349
702 HB2 PHE 83 HB2 PHE 83 7.304 0.667 3.920
703 HB3 PHE 83 HB3 PHE 83 8.043 -0.903 4.212
704 HD1 PHE 83 HD2 PHE 83 6.306 -2.915 3.572
705 HD2 PHE 83 HD1 PHE 83 6.464 0.961 1.824
706 HE1 PHE 83 HE2 PHE 83 5.244 -3.796 1.535
707 HE2 PHE 83 HE1 PHE 83 5.403 0.088 -0.216
708 HZ PHE 83 HZ PHE 83 4.789 -2.295 -0.360
709 H ASN 84 H ASN 84 6.607 1.515 6.791
710 HA ASN 84 HA ASN 84 8.971 0.829 8.148
711 HB2 ASN 84 HB2 ASN 84 8.097 3.141 7.992
712 HB3 ASN 84 HB3 ASN 84 6.774 2.701 9.068
713 HD21 ASN 84 HD21 ASN 84 7.214 3.963 10.764
714 HD22 ASN 84 HD22 ASN 84 8.663 3.862 11.715
715 H TYR 85 H TYR 85 5.576 0.357 8.954
716 HA TYR 85 HA TYR 85 5.903 -0.554 11.605
717 HB2 TYR 85 HB2 TYR 85 3.755 0.145 10.279
718 HB3 TYR 85 HB3 TYR 85 3.712 -1.547 9.802
719 HD1 TYR 85 HD1 TYR 85 3.481 -3.315 11.582
720 HD2 TYR 85 HD2 TYR 85 3.043 0.833 12.423
721 HE1 TYR 85 HE1 TYR 85 2.337 -3.866 13.689
722 HE2 TYR 85 HE2 TYR 85 1.902 0.292 14.530
723 HH TYR 85 HH TYR 85 0.562 -1.685 15.440
724 H ALA 86 H ALA 86 6.064 -2.139 8.487
725 HA ALA 86 HA ALA 86 6.052 -4.813 9.419
726 HB1 ALA 86 HB1 ALA 86 6.836 -5.407 7.210
727 HB2 ALA 86 HB2 ALA 86 7.268 -3.729 6.879
728 HB3 ALA 86 HB3 ALA 86 5.574 -4.182 7.084
729 H ILE 87 H ILE 87 8.691 -2.582 8.567
730 HA ILE 87 HA ILE 87 10.816 -4.324 9.178
731 HB ILE 87 HB ILE 87 10.763 -1.309 9.424
732 HG12 ILE 87 HG12 ILE 87 11.542 -3.113 7.123
733 HG13 ILE 87 HG13 ILE 87 10.149 -2.035 7.181
734 HG21 ILE 87 HG21 ILE 87 13.205 -1.466 9.155
735 HG22 ILE 87 HG22 ILE 87 13.085 -3.226 9.207
736 HG23 ILE 87 HG23 ILE 87 12.646 -2.268 10.620
737 HD11 ILE 87 HD11 ILE 87 11.911 -1.085 5.836
738 HD12 ILE 87 HD12 ILE 87 13.040 -1.211 7.184
739 HD13 ILE 87 HD13 ILE 87 11.663 -0.114 7.287
740 H LYS 88 H LYS 88 9.030 -2.005 11.111
741 HA LYS 88 HA LYS 88 10.379 -2.221 13.522
742 HB2 LYS 88 HB2 LYS 88 8.767 -0.501 13.194
743 HB3 LYS 88 HB3 LYS 88 7.498 -1.658 12.834
744 HG2 LYS 88 HG2 LYS 88 8.752 -1.733 15.526
745 HG3 LYS 88 HG3 LYS 88 7.629 -0.423 15.145
746 HD2 LYS 88 HD2 LYS 88 5.977 -2.153 14.425
747 HD3 LYS 88 HD3 LYS 88 7.091 -3.387 15.012
748 HE2 LYS 88 HE2 LYS 88 5.877 -1.190 16.663
749 HE3 LYS 88 HE3 LYS 88 5.334 -2.864 16.635
750 HZ1 LYS 88 HZ1 LYS 88 7.566 -3.510 17.431
751 HZ2 LYS 88 HZ2 LYS 88 6.730 -2.522 18.530
752 HZ3 LYS 88 HZ3 LYS 88 7.969 -1.866 17.578
753 H ARG 89 H ARG 89 7.690 -4.203 12.281
754 HA ARG 89 HA ARG 89 7.854 -5.963 14.572
755 HB2 ARG 89 HB2 ARG 89 6.132 -6.027 12.102
756 HB3 ARG 89 HB3 ARG 89 6.085 -7.274 13.341
757 HG2 ARG 89 HG2 ARG 89 5.721 -5.192 14.920
758 HG3 ARG 89 HG3 ARG 89 5.123 -4.470 13.426
759 HD2 ARG 89 HD2 ARG 89 3.313 -5.499 14.702
760 HD3 ARG 89 HD3 ARG 89 3.546 -6.310 13.153
761 HE ARG 89 HE ARG 89 5.038 -7.833 14.761
762 HH11 ARG 89 HH11 ARG 89 1.779 -6.588 15.160
763 HH12 ARG 89 HH12 ARG 89 1.269 -7.932 16.135
764 HH21 ARG 89 HH21 ARG 89 4.351 -9.581 16.053
765 HH22 ARG 89 HH22 ARG 89 2.711 -9.634 16.630
766 H HIS 90 H HIS 90 9.987 -5.690 12.301
767 HA HIS 90 HA HIS 90 11.735 -7.027 11.715
768 HB2 HIS 90 HB2 HIS 90 10.397 -9.290 13.200
769 HB3 HIS 90 HB3 HIS 90 12.099 -9.135 12.794
770 HD1 HIS 90 HD1 HIS 90 10.179 -9.107 15.623
771 HD2 HIS 90 HD2 HIS 90 12.927 -6.377 14.112
772 HE1 HIS 90 HE1 HIS 90 10.947 -7.744 17.602
773 HE2 HIS 90 HE2 HIS 90 12.785 -6.277 16.692
774 H ILE 91 H ILE 91 8.954 -7.105 10.347
775 HA ILE 91 HA ILE 91 8.721 -9.707 9.196
776 HB ILE 91 HB ILE 91 7.559 -7.117 8.157
777 HG12 ILE 91 HG12 ILE 91 6.314 -9.110 10.065
778 HG13 ILE 91 HG13 ILE 91 7.017 -7.573 10.556
779 HG21 ILE 91 HG21 ILE 91 6.708 -9.985 7.768
780 HG22 ILE 91 HG22 ILE 91 7.478 -8.957 6.560
781 HG23 ILE 91 HG23 ILE 91 5.863 -8.566 7.150
782 HD11 ILE 91 HD11 ILE 91 5.370 -6.378 9.238
783 HD12 ILE 91 HD12 ILE 91 4.589 -7.459 10.394
784 HD13 ILE 91 HD13 ILE 91 4.682 -7.909 8.691
785 H ILE 92 H ILE 92 10.129 -6.660 8.145
786 HA ILE 92 HA ILE 92 11.776 -8.008 6.196
787 HB ILE 92 HB ILE 92 9.609 -7.571 5.015
788 HG12 ILE 92 HG12 ILE 92 11.950 -5.965 3.969
789 HG13 ILE 92 HG13 ILE 92 11.743 -7.703 3.777
790 HG21 ILE 92 HG21 ILE 92 9.064 -5.243 4.399
791 HG22 ILE 92 HG22 ILE 92 10.323 -4.683 5.500
792 HG23 ILE 92 HG23 ILE 92 8.922 -5.550 6.130
793 HD11 ILE 92 HD11 ILE 92 9.709 -7.307 2.481
794 HD12 ILE 92 HD12 ILE 92 11.117 -6.529 1.758
795 HD13 ILE 92 HD13 ILE 92 9.945 -5.567 2.660
796 H GLU 93 H GLU 93 13.412 -6.483 5.301
797 HA GLU 93 HA GLU 93 13.794 -4.159 7.075
798 HB2 GLU 93 HB2 GLU 93 15.473 -6.000 7.321
799 HB3 GLU 93 HB3 GLU 93 15.930 -5.758 5.641
800 HG2 GLU 93 HG2 GLU 93 16.591 -3.446 6.193
801 HG3 GLU 93 HG3 GLU 93 16.208 -3.769 7.883
802 H TYR 94 H TYR 94 12.547 -4.685 4.250
803 HA TYR 94 HA TYR 94 14.091 -2.611 2.841
804 HB2 TYR 94 HB2 TYR 94 12.492 -4.832 1.556
805 HB3 TYR 94 HB3 TYR 94 13.524 -3.663 0.738
806 HD1 TYR 94 HD2 TYR 94 16.043 -3.655 1.682
807 HD2 TYR 94 HD1 TYR 94 13.345 -6.940 1.891
808 HE1 TYR 94 HE2 TYR 94 17.942 -5.196 1.912
809 HE2 TYR 94 HE1 TYR 94 15.241 -8.488 2.122
810 HH TYR 94 HH TYR 94 18.316 -7.505 2.917
811 H ASN 95 H ASN 95 13.015 -0.929 1.973
812 HA ASN 95 HA ASN 95 10.088 -0.874 2.278
813 HB2 ASN 95 HB2 ASN 95 12.006 1.461 2.086
814 HB3 ASN 95 HB3 ASN 95 10.266 1.577 2.299
815 HD21 ASN 95 HD21 ASN 95 9.367 1.107 4.303
816 HD22 ASN 95 HD22 ASN 95 10.329 0.988 5.732
817 HA PRO 96 HA PRO 96 10.876 -1.394 -2.229
818 HB2 PRO 96 HB2 PRO 96 7.947 -1.890 -2.108
819 HB3 PRO 96 HB3 PRO 96 9.217 -2.833 -2.897
820 HG2 PRO 96 HG2 PRO 96 8.116 -3.695 -0.643
821 HG3 PRO 96 HG3 PRO 96 9.861 -3.868 -0.923
822 HD2 PRO 96 HD2 PRO 96 8.401 -1.881 0.778
823 HD3 PRO 96 HD3 PRO 96 9.922 -2.742 1.102
824 H ALA 97 H ALA 97 8.517 0.584 -0.566
825 HA ALA 97 HA ALA 97 7.988 2.136 -2.983
826 HB1 ALA 97 HB1 ALA 97 6.243 3.240 -1.684
827 HB2 ALA 97 HB2 ALA 97 6.753 2.362 -0.242
828 HB3 ALA 97 HB3 ALA 97 6.070 1.487 -1.613
829 H ALA 98 H ALA 98 10.318 2.141 -0.680
830 HA ALA 98 HA ALA 98 10.415 4.957 -0.077
831 HB1 ALA 98 HB1 ALA 98 12.548 2.854 0.278
832 HB2 ALA 98 HB2 ALA 98 11.338 3.304 1.479
833 HB3 ALA 98 HB3 ALA 98 12.554 4.475 0.972
834 H ALA 99 H ALA 99 11.506 2.910 -2.602
835 HA ALA 99 HA ALA 99 13.553 4.675 -3.590
836 HB1 ALA 99 HB1 ALA 99 13.639 3.162 -5.504
837 HB2 ALA 99 HB2 ALA 99 12.182 2.345 -4.935
838 HB3 ALA 99 HB3 ALA 99 13.669 2.262 -3.988
839 H PHE 100 H PHE 100 10.382 5.080 -3.372
840 HA PHE 100 HA PHE 100 10.221 6.665 -5.841
841 HB2 PHE 100 HB2 PHE 100 7.966 5.101 -4.560
842 HB3 PHE 100 HB3 PHE 100 7.815 6.151 -5.965
843 HD1 PHE 100 HD1 PHE 100 8.911 5.500 -8.101
844 HD2 PHE 100 HD2 PHE 100 8.723 2.878 -4.754
845 HE1 PHE 100 HE1 PHE 100 9.404 3.592 -9.572
846 HE2 PHE 100 HE2 PHE 100 9.218 0.963 -6.221
847 HZ PHE 100 HZ PHE 100 9.559 1.321 -8.634
848 H ASP 101 H ASP 101 9.442 8.701 -5.603
849 HA ASP 101 HA ASP 101 8.140 9.401 -3.067
850 HB2 ASP 101 HB2 ASP 101 10.532 10.752 -4.274
851 HB3 ASP 101 HB3 ASP 101 9.371 11.694 -3.343
852 HA PRO 102 HA PRO 102 5.038 10.699 -5.840
853 HB2 PRO 102 HB2 PRO 102 4.140 12.420 -3.606
854 HB3 PRO 102 HB3 PRO 102 3.279 11.130 -4.450
855 HG2 PRO 102 HG2 PRO 102 4.191 10.770 -1.968
856 HG3 PRO 102 HG3 PRO 102 4.247 9.462 -3.166
857 HD2 PRO 102 HD2 PRO 102 6.443 11.262 -2.220
858 HD3 PRO 102 HD3 PRO 102 6.480 9.518 -2.556
859 H GLY 103 H GLY 103 6.704 13.169 -3.931
860 HA2 GLY 103 HA2 GLY 103 7.535 15.203 -4.960
861 HA3 GLY 103 HA3 GLY 103 6.187 15.111 -6.093
862 H ASP 104 H ASP 104 4.254 14.366 -4.144
863 HA ASP 104 HA ASP 104 3.857 16.855 -2.684
864 HB2 ASP 104 HB2 ASP 104 1.926 16.018 -3.889
865 HB3 ASP 104 HB3 ASP 104 2.084 14.440 -3.130
866 H ALA 105 H ALA 105 5.151 16.856 -0.940
867 HA ALA 105 HA ALA 105 5.811 14.427 0.447
868 HB1 ALA 105 HB1 ALA 105 7.283 15.811 1.779
869 HB2 ALA 105 HB2 ALA 105 6.530 17.272 1.137
870 HB3 ALA 105 HB3 ALA 105 7.461 16.219 0.071
871 H GLY 106 H GLY 106 5.809 14.528 2.924
872 HA2 GLY 106 HA2 GLY 106 3.119 15.384 3.780
873 HA3 GLY 106 HA3 GLY 106 3.969 13.984 4.423
874 H GLY 107 H GLY 107 3.429 17.342 4.687
875 HA2 GLY 107 HA2 GLY 107 5.703 17.727 6.502
876 HA3 GLY 107 HA3 GLY 107 4.645 18.988 5.882
877 H LYS 108 H LYS 108 3.002 16.250 6.898
878 HA LYS 108 HA LYS 108 1.837 17.635 9.125
879 HB2 LYS 108 HB2 LYS 108 1.419 14.856 8.030
880 HB3 LYS 108 HB3 LYS 108 0.555 15.482 9.426
881 HG2 LYS 108 HG2 LYS 108 0.458 16.595 6.628
882 HG3 LYS 108 HG3 LYS 108 -0.801 15.654 7.429
883 HD2 LYS 108 HD2 LYS 108 -1.582 17.794 7.756
884 HD3 LYS 108 HD3 LYS 108 -0.648 17.559 9.227
885 HE2 LYS 108 HE2 LYS 108 1.259 18.700 8.166
886 HE3 LYS 108 HE3 LYS 108 0.274 18.981 6.735
887 HZ1 LYS 108 HZ1 LYS 108 -0.330 20.010 9.454
888 HZ2 LYS 108 HZ2 LYS 108 -1.223 20.322 8.042
889 HZ3 LYS 108 HZ3 LYS 108 0.361 20.911 8.193
890 H LEU 109 H LEU 109 1.917 17.086 11.272
891 HA LEU 109 HA LEU 109 4.319 15.561 12.021
892 HB2 LEU 109 HB2 LEU 109 4.278 18.048 12.461
893 HB3 LEU 109 HB3 LEU 109 2.964 17.771 13.582
894 HG LEU 109 HG LEU 109 5.590 16.365 13.978
895 HD11 LEU 109 HD11 LEU 109 6.357 18.221 15.348
896 HD12 LEU 109 HD12 LEU 109 4.921 19.153 14.925
897 HD13 LEU 109 HD13 LEU 109 6.108 18.750 13.685
898 HD21 LEU 109 HD21 LEU 109 3.683 15.683 15.351
899 HD22 LEU 109 HD22 LEU 109 3.461 17.353 15.878
900 HD23 LEU 109 HD23 LEU 109 4.922 16.471 16.326
901 H GLU 110 H GLU 110 3.962 13.708 13.050
902 HA GLU 110 HA GLU 110 1.372 12.997 14.051
903 HB2 GLU 110 HB2 GLU 110 4.071 11.646 14.254
904 HB3 GLU 110 HB3 GLU 110 2.576 10.936 14.852
905 HG2 GLU 110 HG2 GLU 110 1.708 10.645 12.723
906 HG3 GLU 110 HG3 GLU 110 2.798 11.832 12.009
907 H HIS 111 H HIS 111 0.689 14.159 15.736
908 HA HIS 111 HA HIS 111 2.373 15.459 17.565
909 HB2 HIS 111 HB2 HIS 111 -0.039 16.008 16.866
910 HB3 HIS 111 HB3 HIS 111 -0.524 14.836 18.086
911 HD1 HIS 111 HD1 HIS 111 0.643 18.298 17.626
912 HD2 HIS 111 HD2 HIS 111 0.098 15.635 20.779
913 HE1 HIS 111 HE1 HIS 111 0.696 19.696 19.719
914 HE2 HIS 111 HE2 HIS 111 0.193 18.093 21.595
915 H HIS 112 H HIS 112 -0.096 13.066 18.513
916 HA HIS 112 HA HIS 112 1.899 11.629 20.079
917 HB2 HIS 112 HB2 HIS 112 -0.420 13.120 21.250
918 HB3 HIS 112 HB3 HIS 112 0.094 11.612 21.992
919 HD1 HIS 112 HD1 HIS 112 0.368 14.841 22.872
920 HD2 HIS 112 HD2 HIS 112 3.312 12.032 21.981
921 HE1 HIS 112 HE1 HIS 112 2.456 15.648 24.024
922 HE2 HIS 112 HE2 HIS 112 4.252 14.030 23.329
923 H HIS 113 H HIS 113 1.610 9.514 19.924
924 HA HIS 113 HA HIS 113 -0.493 8.311 18.521
925 HB2 HIS 113 HB2 HIS 113 0.337 6.179 19.360
926 HB3 HIS 113 HB3 HIS 113 1.686 7.207 18.901
927 HD1 HIS 113 HD1 HIS 113 0.248 5.343 21.744
928 HD2 HIS 113 HD2 HIS 113 3.189 8.227 21.143
929 HE1 HIS 113 HE1 HIS 113 1.637 5.344 23.840
930 HE2 HIS 113 HE2 HIS 113 3.280 7.235 23.534
931 H HIS 114 H HIS 114 -2.497 7.756 19.048
932 HA HIS 114 HA HIS 114 -3.286 8.013 21.876
933 HB2 HIS 114 HB2 HIS 114 -4.577 8.914 19.343
934 HB3 HIS 114 HB3 HIS 114 -5.613 8.441 20.686
935 HD1 HIS 114 HD1 HIS 114 -2.886 10.936 19.847
936 HD2 HIS 114 HD2 HIS 114 -5.871 10.304 22.670
937 HE1 HIS 114 HE1 HIS 114 -2.998 13.053 21.197
938 HE2 HIS 114 HE2 HIS 114 -4.670 12.570 23.025
939 H HIS 115 H HIS 115 -5.910 7.081 21.507
940 HA HIS 115 HA HIS 115 -7.205 5.223 21.426
941 HB2 HIS 115 HB2 HIS 115 -6.017 4.909 19.134
942 HB3 HIS 115 HB3 HIS 115 -5.066 3.684 19.964
943 HD1 HIS 115 HD1 HIS 115 -8.626 4.461 18.961
944 HD2 HIS 115 HD2 HIS 115 -6.332 1.249 20.288
945 HE1 HIS 115 HE1 HIS 115 -10.081 2.426 18.698
946 HE2 HIS 115 HE2 HIS 115 -8.729 0.517 19.631
947 H HIS 116 H HIS 116 -4.943 5.819 23.327
948 HA HIS 116 HA HIS 116 -4.164 5.001 25.294
949 HB2 HIS 116 HB2 HIS 116 -6.626 4.440 25.487
950 HB3 HIS 116 HB3 HIS 116 -6.217 2.806 24.981
951 HD1 HIS 116 HD1 HIS 116 -6.205 1.312 26.952
952 HD2 HIS 116 HD2 HIS 116 -4.706 5.088 27.856
953 HE1 HIS 116 HE1 HIS 116 -5.581 1.236 29.389
954 HE2 HIS 116 HE2 HIS 116 -4.877 3.587 29.957
Start of MODEL 7
1 H1 MET 1 H1 MET 1 -3.557 -9.423 19.275
2 H2 MET 1 H2 MET 1 -4.005 -10.157 17.814
3 H3 MET 1 H3 MET 1 -2.664 -9.127 17.867
4 HA MET 1 HA MET 1 -1.528 -10.672 19.359
5 HB2 MET 1 HB2 MET 1 -3.941 -12.401 18.756
6 HB3 MET 1 HB3 MET 1 -2.479 -12.965 19.552
7 HG2 MET 1 HG2 MET 1 -2.886 -11.555 21.439
8 HG3 MET 1 HG3 MET 1 -4.242 -10.777 20.623
9 HE1 MET 1 HE1 MET 1 -6.849 -13.695 20.426
10 HE2 MET 1 HE2 MET 1 -5.686 -13.159 19.212
11 HE3 MET 1 HE3 MET 1 -6.584 -11.972 20.157
12 H ALA 2 H ALA 2 0.046 -10.651 17.805
13 HA ALA 2 HA ALA 2 -0.206 -12.599 15.660
14 HB1 ALA 2 HB1 ALA 2 0.337 -11.016 13.890
15 HB2 ALA 2 HB2 ALA 2 0.284 -9.690 15.052
16 HB3 ALA 2 HB3 ALA 2 -1.182 -10.598 14.682
17 H GLU 3 H GLU 3 1.711 -10.925 17.904
18 HA GLU 3 HA GLU 3 4.163 -11.026 16.431
19 HB2 GLU 3 HB2 GLU 3 3.820 -9.383 18.238
20 HB3 GLU 3 HB3 GLU 3 3.788 -10.698 19.408
21 HG2 GLU 3 HG2 GLU 3 6.082 -11.314 18.710
22 HG3 GLU 3 HG3 GLU 3 6.105 -9.898 17.661
23 H LYS 4 H LYS 4 4.420 -13.079 15.728
24 HA LYS 4 HA LYS 4 6.180 -14.658 17.154
25 HB2 LYS 4 HB2 LYS 4 4.885 -16.713 17.568
26 HB3 LYS 4 HB3 LYS 4 4.322 -15.377 18.560
27 HG2 LYS 4 HG2 LYS 4 2.403 -15.066 17.177
28 HG3 LYS 4 HG3 LYS 4 3.011 -16.227 15.994
29 HD2 LYS 4 HD2 LYS 4 2.825 -18.015 17.623
30 HD3 LYS 4 HD3 LYS 4 2.281 -16.867 18.847
31 HE2 LYS 4 HE2 LYS 4 0.305 -16.365 17.499
32 HE3 LYS 4 HE3 LYS 4 0.851 -17.507 16.272
33 HZ1 LYS 4 HZ1 LYS 4 -0.816 -18.472 17.747
34 HZ2 LYS 4 HZ2 LYS 4 0.199 -18.207 19.084
35 HZ3 LYS 4 HZ3 LYS 4 0.666 -19.289 17.863
36 H ASN 5 H ASN 5 3.836 -14.259 14.655
37 HA ASN 5 HA ASN 5 5.475 -15.922 12.873
38 HB2 ASN 5 HB2 ASN 5 3.325 -16.495 11.664
39 HB3 ASN 5 HB3 ASN 5 3.518 -17.232 13.249
40 HD21 ASN 5 HD21 ASN 5 1.688 -15.018 11.322
41 HD22 ASN 5 HD22 ASN 5 0.470 -14.687 12.506
42 H ALA 6 H ALA 6 5.746 -15.169 10.799
43 HA ALA 6 HA ALA 6 5.400 -12.339 10.444
44 HB1 ALA 6 HB1 ALA 6 7.429 -13.467 9.666
45 HB2 ALA 6 HB2 ALA 6 6.593 -12.661 8.338
46 HB3 ALA 6 HB3 ALA 6 6.469 -14.411 8.525
47 H TYR 7 H TYR 7 3.409 -11.633 10.021
48 HA TYR 7 HA TYR 7 1.550 -13.219 8.503
49 HB2 TYR 7 HB2 TYR 7 0.038 -11.195 8.848
50 HB3 TYR 7 HB3 TYR 7 0.546 -12.069 10.285
51 HD1 TYR 7 HD2 TYR 7 0.947 -8.955 8.361
52 HD2 TYR 7 HD1 TYR 7 1.956 -11.034 11.933
53 HE1 TYR 7 HE2 TYR 7 1.763 -6.853 9.348
54 HE2 TYR 7 HE1 TYR 7 2.764 -8.941 12.933
55 HH TYR 7 HH TYR 7 2.120 -5.896 11.591
56 H THR 8 H THR 8 0.282 -12.228 6.723
57 HA THR 8 HA THR 8 2.173 -11.448 4.688
58 HB THR 8 HB THR 8 0.229 -11.765 3.150
59 HG1 THR 8 HG1 THR 8 -1.588 -12.931 4.361
60 HG21 THR 8 HG21 THR 8 1.727 -13.628 3.642
61 HG22 THR 8 HG22 THR 8 0.067 -14.199 3.462
62 HG23 THR 8 HG23 THR 8 0.774 -14.034 5.069
63 H VAL 9 H VAL 9 1.162 -9.944 2.937
64 HA VAL 9 HA VAL 9 1.107 -7.329 3.898
65 HB VAL 9 HB VAL 9 1.752 -7.752 1.634
66 HG11 VAL 9 HG11 VAL 9 0.419 -9.740 1.209
67 HG12 VAL 9 HG12 VAL 9 0.192 -8.554 -0.075
68 HG13 VAL 9 HG13 VAL 9 -1.050 -8.763 1.160
69 HG21 VAL 9 HG21 VAL 9 -0.855 -6.237 1.668
70 HG22 VAL 9 HG22 VAL 9 0.342 -6.177 0.376
71 HG23 VAL 9 HG23 VAL 9 0.749 -5.574 1.983
72 H ALA 10 H ALA 10 -1.510 -9.578 3.269
73 HA ALA 10 HA ALA 10 -3.630 -7.723 3.223
74 HB1 ALA 10 HB1 ALA 10 -5.079 -9.657 3.560
75 HB2 ALA 10 HB2 ALA 10 -3.677 -10.639 3.989
76 HB3 ALA 10 HB3 ALA 10 -3.836 -9.993 2.355
77 H GLN 11 H GLN 11 -2.002 -9.393 5.848
78 HA GLN 11 HA GLN 11 -3.961 -8.607 7.809
79 HB2 GLN 11 HB2 GLN 11 -1.186 -9.733 8.227
80 HB3 GLN 11 HB3 GLN 11 -2.457 -9.624 9.436
81 HG2 GLN 11 HG2 GLN 11 -2.479 -11.327 6.957
82 HG3 GLN 11 HG3 GLN 11 -2.285 -11.882 8.618
83 HE21 GLN 11 HE21 GLN 11 -4.088 -11.894 9.991
84 HE22 GLN 11 HE22 GLN 11 -5.703 -11.807 9.376
85 H LEU 12 H LEU 12 -0.826 -7.502 6.691
86 HA LEU 12 HA LEU 12 -0.276 -5.672 8.758
87 HB2 LEU 12 HB2 LEU 12 1.413 -6.415 7.150
88 HB3 LEU 12 HB3 LEU 12 0.558 -5.600 5.856
89 HG LEU 12 HG LEU 12 0.999 -3.426 6.984
90 HD11 LEU 12 HD11 LEU 12 2.661 -3.334 8.768
91 HD12 LEU 12 HD12 LEU 12 2.725 -5.096 8.810
92 HD13 LEU 12 HD13 LEU 12 1.243 -4.255 9.269
93 HD21 LEU 12 HD21 LEU 12 3.429 -5.099 6.358
94 HD22 LEU 12 HD22 LEU 12 3.379 -3.338 6.411
95 HD23 LEU 12 HD23 LEU 12 2.447 -4.208 5.194
96 H ALA 13 H ALA 13 -2.059 -5.359 5.739
97 HA ALA 13 HA ALA 13 -2.413 -2.587 5.705
98 HB1 ALA 13 HB1 ALA 13 -2.906 -4.004 3.793
99 HB2 ALA 13 HB2 ALA 13 -4.318 -3.040 4.222
100 HB3 ALA 13 HB3 ALA 13 -4.246 -4.746 4.665
101 H ASP 14 H ASP 14 -4.421 -5.123 7.183
102 HA ASP 14 HA ASP 14 -6.431 -3.295 8.062
103 HB2 ASP 14 HB2 ASP 14 -6.812 -5.741 7.655
104 HB3 ASP 14 HB3 ASP 14 -5.894 -6.074 9.121
105 H GLU 15 H GLU 15 -3.572 -4.719 9.496
106 HA GLU 15 HA GLU 15 -3.950 -3.845 12.150
107 HB2 GLU 15 HB2 GLU 15 -2.293 -5.540 11.501
108 HB3 GLU 15 HB3 GLU 15 -1.404 -4.337 10.584
109 HG2 GLU 15 HG2 GLU 15 -0.268 -4.735 12.643
110 HG3 GLU 15 HG3 GLU 15 -0.966 -3.117 12.691
111 H TYR 16 H TYR 16 -2.323 -2.393 9.365
112 HA TYR 16 HA TYR 16 -1.389 -0.066 10.625
113 HB2 TYR 16 HB2 TYR 16 -0.541 -0.753 8.469
114 HB3 TYR 16 HB3 TYR 16 -2.136 -0.603 7.745
115 HD1 TYR 16 HD1 TYR 16 0.459 1.445 9.481
116 HD2 TYR 16 HD2 TYR 16 -2.690 1.345 6.621
117 HE1 TYR 16 HE1 TYR 16 0.979 3.760 8.833
118 HE2 TYR 16 HE2 TYR 16 -2.178 3.659 5.965
119 HH TYR 16 HH TYR 16 -1.103 5.628 6.869
120 H PHE 17 H PHE 17 -4.483 -0.873 9.196
121 HA PHE 17 HA PHE 17 -5.577 1.694 8.968
122 HB2 PHE 17 HB2 PHE 17 -6.524 -0.400 7.974
123 HB3 PHE 17 HB3 PHE 17 -7.062 -0.872 9.580
124 HD1 PHE 17 HD2 PHE 17 -7.569 1.466 6.808
125 HD2 PHE 17 HD1 PHE 17 -8.991 0.143 10.592
126 HE1 PHE 17 HE2 PHE 17 -9.672 2.688 6.439
127 HE2 PHE 17 HE1 PHE 17 -11.098 1.358 10.230
128 HZ PHE 17 HZ PHE 17 -11.441 2.633 8.149
129 H GLU 18 H GLU 18 -5.858 -0.668 11.630
130 HA GLU 18 HA GLU 18 -7.532 0.922 13.236
131 HB2 GLU 18 HB2 GLU 18 -5.677 -1.344 13.943
132 HB3 GLU 18 HB3 GLU 18 -6.743 -0.582 15.113
133 HG2 GLU 18 HG2 GLU 18 -8.612 -1.129 13.438
134 HG3 GLU 18 HG3 GLU 18 -7.441 -2.233 12.725
135 H ARG 19 H ARG 19 -4.154 1.127 12.682
136 HA ARG 19 HA ARG 19 -3.545 2.318 15.235
137 HB2 ARG 19 HB2 ARG 19 -1.858 2.097 12.734
138 HB3 ARG 19 HB3 ARG 19 -1.279 2.590 14.323
139 HG2 ARG 19 HG2 ARG 19 -2.352 -0.104 13.525
140 HG3 ARG 19 HG3 ARG 19 -0.701 0.302 14.011
141 HD2 ARG 19 HD2 ARG 19 -1.310 0.635 16.227
142 HD3 ARG 19 HD3 ARG 19 -3.016 0.812 15.838
143 HE ARG 19 HE ARG 19 -1.919 -1.801 15.257
144 HH11 ARG 19 HH11 ARG 19 -3.385 0.226 17.714
145 HH12 ARG 19 HH12 ARG 19 -4.139 -1.110 18.537
146 HH21 ARG 19 HH21 ARG 19 -2.895 -3.535 16.315
147 HH22 ARG 19 HH22 ARG 19 -3.875 -3.253 17.728
148 H MET 20 H MET 20 -3.528 3.471 11.881
149 HA MET 20 HA MET 20 -3.043 6.178 12.798
150 HB2 MET 20 HB2 MET 20 -3.439 5.132 9.994
151 HB3 MET 20 HB3 MET 20 -2.869 6.738 10.424
152 HG2 MET 20 HG2 MET 20 -1.417 4.235 11.227
153 HG3 MET 20 HG3 MET 20 -1.131 5.050 9.695
154 HE1 MET 20 HE1 MET 20 -0.554 5.066 13.553
155 HE2 MET 20 HE2 MET 20 -1.703 6.397 13.426
156 HE3 MET 20 HE3 MET 20 -0.025 6.719 13.866
157 H ILE 21 H ILE 21 -5.740 4.308 11.636
158 HA ILE 21 HA ILE 21 -7.342 6.618 10.961
159 HB ILE 21 HB ILE 21 -8.103 3.695 11.187
160 HG12 ILE 21 HG12 ILE 21 -6.427 4.064 9.476
161 HG13 ILE 21 HG13 ILE 21 -7.979 3.742 8.713
162 HG21 ILE 21 HG21 ILE 21 -10.080 4.247 9.879
163 HG22 ILE 21 HG22 ILE 21 -9.627 5.951 9.882
164 HG23 ILE 21 HG23 ILE 21 -10.066 5.154 11.393
165 HD11 ILE 21 HD11 ILE 21 -8.267 6.143 8.322
166 HD12 ILE 21 HD12 ILE 21 -6.808 5.512 7.560
167 HD13 ILE 21 HD13 ILE 21 -6.690 6.440 9.054
168 H ALA 22 H ALA 22 -6.477 5.083 13.811
169 HA ALA 22 HA ALA 22 -8.901 5.733 15.261
170 HB1 ALA 22 HB1 ALA 22 -7.571 3.772 15.895
171 HB2 ALA 22 HB2 ALA 22 -7.711 4.924 17.223
172 HB3 ALA 22 HB3 ALA 22 -6.214 4.826 16.295
173 H GLY 23 H GLY 23 -6.284 7.445 14.110
174 HA2 GLY 23 HA2 GLY 23 -6.468 9.428 16.292
175 HA3 GLY 23 HA3 GLY 23 -5.024 9.171 15.322
176 H ARG 24 H ARG 24 -5.408 9.480 12.899
177 HA ARG 24 HA ARG 24 -7.233 11.739 12.433
178 HB2 ARG 24 HB2 ARG 24 -4.368 11.746 12.295
179 HB3 ARG 24 HB3 ARG 24 -5.016 11.981 10.676
180 HG2 ARG 24 HG2 ARG 24 -4.625 14.107 11.788
181 HG3 ARG 24 HG3 ARG 24 -6.343 13.867 11.470
182 HD2 ARG 24 HD2 ARG 24 -6.621 13.093 13.803
183 HD3 ARG 24 HD3 ARG 24 -4.921 13.455 14.095
184 HE ARG 24 HE ARG 24 -5.941 15.799 13.143
185 HH11 ARG 24 HH11 ARG 24 -6.800 13.639 15.759
186 HH12 ARG 24 HH12 ARG 24 -7.430 14.900 16.774
187 HH21 ARG 24 HH21 ARG 24 -6.779 17.464 14.454
188 HH22 ARG 24 HH22 ARG 24 -7.442 17.082 16.017
189 H TRP 25 H TRP 25 -8.752 10.563 11.412
190 HA TRP 25 HA TRP 25 -7.898 8.755 9.273
191 HB2 TRP 25 HB2 TRP 25 -9.963 7.572 9.609
192 HB3 TRP 25 HB3 TRP 25 -9.214 7.825 11.180
193 HD1 TRP 25 HD1 TRP 25 -12.351 8.383 9.304
194 HE1 TRP 25 HE1 TRP 25 -14.056 9.692 10.713
195 HE3 TRP 25 HE3 TRP 25 -9.267 9.855 13.096
196 HZ2 TRP 25 HZ2 TRP 25 -14.077 11.160 13.124
197 HZ3 TRP 25 HZ3 TRP 25 -10.208 11.218 14.914
198 HH2 TRP 25 HH2 TRP 25 -12.564 11.858 14.927
199 H LYS 26 H LYS 26 -10.342 11.220 10.003
200 HA LYS 26 HA LYS 26 -11.398 12.761 8.753
201 HB2 LYS 26 HB2 LYS 26 -9.396 12.001 6.626
202 HB3 LYS 26 HB3 LYS 26 -10.486 13.380 6.536
203 HG2 LYS 26 HG2 LYS 26 -9.456 14.316 8.555
204 HG3 LYS 26 HG3 LYS 26 -8.354 12.943 8.621
205 HD2 LYS 26 HD2 LYS 26 -8.539 14.934 6.366
206 HD3 LYS 26 HD3 LYS 26 -7.307 14.929 7.627
207 HE2 LYS 26 HE2 LYS 26 -6.646 12.649 6.882
208 HE3 LYS 26 HE3 LYS 26 -7.784 12.803 5.543
209 HZ1 LYS 26 HZ1 LYS 26 -5.632 13.395 4.756
210 HZ2 LYS 26 HZ2 LYS 26 -5.379 14.464 6.049
211 HZ3 LYS 26 HZ3 LYS 26 -6.541 14.829 4.867
212 H HIS 27 H HIS 27 -10.871 9.750 6.899
213 HA HIS 27 HA HIS 27 -13.683 9.702 6.170
214 HB2 HIS 27 HB2 HIS 27 -11.493 9.904 4.092
215 HB3 HIS 27 HB3 HIS 27 -13.099 9.292 3.731
216 HD1 HIS 27 HD1 HIS 27 -11.289 12.179 3.184
217 HD2 HIS 27 HD2 HIS 27 -15.058 11.503 4.819
218 HE1 HIS 27 HE1 HIS 27 -12.532 14.353 2.952
219 HE2 HIS 27 HE2 HIS 27 -14.858 13.873 3.793
220 HA PRO 28 HA PRO 28 -11.776 5.745 7.434
221 HB2 PRO 28 HB2 PRO 28 -14.545 4.991 8.066
222 HB3 PRO 28 HB3 PRO 28 -13.129 5.053 9.119
223 HG2 PRO 28 HG2 PRO 28 -15.109 6.849 9.318
224 HG3 PRO 28 HG3 PRO 28 -13.423 7.286 9.607
225 HD2 PRO 28 HD2 PRO 28 -15.126 7.764 7.195
226 HD3 PRO 28 HD3 PRO 28 -13.960 8.847 7.986
227 H ASN 29 H ASN 29 -15.043 5.599 5.984
228 HA ASN 29 HA ASN 29 -14.630 3.078 4.801
229 HB2 ASN 29 HB2 ASN 29 -16.686 3.468 3.571
230 HB3 ASN 29 HB3 ASN 29 -16.877 4.042 5.223
231 HD21 ASN 29 HD21 ASN 29 -17.004 6.258 5.619
232 HD22 ASN 29 HD22 ASN 29 -17.329 7.398 4.350
233 H ILE 30 H ILE 30 -13.955 6.314 3.728
234 HA ILE 30 HA ILE 30 -13.550 5.723 0.987
235 HB ILE 30 HB ILE 30 -12.443 7.990 2.651
236 HG12 ILE 30 HG12 ILE 30 -14.891 7.946 2.609
237 HG13 ILE 30 HG13 ILE 30 -14.280 9.307 1.676
238 HG21 ILE 30 HG21 ILE 30 -12.593 7.707 -0.348
239 HG22 ILE 30 HG22 ILE 30 -11.127 7.674 0.631
240 HG23 ILE 30 HG23 ILE 30 -12.085 9.152 0.524
241 HD11 ILE 30 HD11 ILE 30 -14.686 8.089 -0.388
242 HD12 ILE 30 HD12 ILE 30 -16.159 8.211 0.576
243 HD13 ILE 30 HD13 ILE 30 -15.251 6.699 0.536
244 H VAL 31 H VAL 31 -11.240 6.241 3.674
245 HA VAL 31 HA VAL 31 -8.974 5.613 2.109
246 HB VAL 31 HB VAL 31 -8.784 6.924 4.172
247 HG11 VAL 31 HG11 VAL 31 -10.368 5.837 5.602
248 HG12 VAL 31 HG12 VAL 31 -8.777 5.785 6.362
249 HG13 VAL 31 HG13 VAL 31 -9.426 4.345 5.578
250 HG21 VAL 31 HG21 VAL 31 -6.753 5.880 5.049
251 HG22 VAL 31 HG22 VAL 31 -6.805 5.823 3.287
252 HG23 VAL 31 HG23 VAL 31 -7.174 4.376 4.228
253 H ARG 32 H ARG 32 -11.071 3.627 4.157
254 HA ARG 32 HA ARG 32 -9.595 1.266 4.088
255 HB2 ARG 32 HB2 ARG 32 -11.446 1.479 5.596
256 HB3 ARG 32 HB3 ARG 32 -12.567 1.766 4.273
257 HG2 ARG 32 HG2 ARG 32 -12.757 -0.489 5.226
258 HG3 ARG 32 HG3 ARG 32 -12.327 -0.502 3.514
259 HD2 ARG 32 HD2 ARG 32 -10.899 -2.074 4.416
260 HD3 ARG 32 HD3 ARG 32 -9.899 -0.636 4.359
261 HE ARG 32 HE ARG 32 -10.686 -0.430 6.822
262 HH11 ARG 32 HH11 ARG 32 -10.054 -3.418 5.127
263 HH12 ARG 32 HH12 ARG 32 -9.480 -4.258 6.532
264 HH21 ARG 32 HH21 ARG 32 -9.945 -1.544 8.702
265 HH22 ARG 32 HH22 ARG 32 -9.413 -3.196 8.565
266 H SER 33 H SER 33 -11.985 2.568 1.812
267 HA SER 33 HA SER 33 -12.179 0.351 0.120
268 HB2 SER 33 HB2 SER 33 -12.413 3.288 -0.574
269 HB3 SER 33 HB3 SER 33 -12.964 1.956 -1.590
270 HG SER 33 HG SER 33 -13.919 2.671 0.996
271 H ARG 34 H ARG 34 -9.749 2.864 0.332
272 HA ARG 34 HA ARG 34 -8.444 2.085 -2.118
273 HB2 ARG 34 HB2 ARG 34 -7.800 4.024 0.081
274 HB3 ARG 34 HB3 ARG 34 -6.558 3.564 -1.071
275 HG2 ARG 34 HG2 ARG 34 -7.690 5.670 -1.657
276 HG3 ARG 34 HG3 ARG 34 -7.859 4.435 -2.903
277 HD2 ARG 34 HD2 ARG 34 -10.105 4.015 -2.321
278 HD3 ARG 34 HD3 ARG 34 -9.956 4.888 -0.799
279 HE ARG 34 HE ARG 34 -9.713 6.932 -2.224
280 HH11 ARG 34 HH11 ARG 34 -11.317 4.097 -3.514
281 HH12 ARG 34 HH12 ARG 34 -12.431 5.021 -4.479
282 HH21 ARG 34 HH21 ARG 34 -11.185 8.146 -3.513
283 HH22 ARG 34 HH22 ARG 34 -12.356 7.297 -4.487
284 H ILE 35 H ILE 35 -7.948 1.590 1.346
285 HA ILE 35 HA ILE 35 -5.453 0.312 1.163
286 HB ILE 35 HB ILE 35 -7.599 0.126 3.277
287 HG12 ILE 35 HG12 ILE 35 -4.966 1.620 3.154
288 HG13 ILE 35 HG13 ILE 35 -6.566 2.337 2.981
289 HG21 ILE 35 HG21 ILE 35 -4.774 -0.931 3.371
290 HG22 ILE 35 HG22 ILE 35 -6.253 -1.891 3.374
291 HG23 ILE 35 HG23 ILE 35 -5.882 -0.844 4.742
292 HD11 ILE 35 HD11 ILE 35 -7.089 1.683 5.281
293 HD12 ILE 35 HD12 ILE 35 -5.680 2.738 5.189
294 HD13 ILE 35 HD13 ILE 35 -5.469 1.006 5.445
295 H GLU 36 H GLU 36 -8.750 -1.069 1.230
296 HA GLU 36 HA GLU 36 -7.638 -3.733 1.195
297 HB2 GLU 36 HB2 GLU 36 -9.967 -4.504 1.280
298 HB3 GLU 36 HB3 GLU 36 -9.601 -3.340 2.539
299 HG2 GLU 36 HG2 GLU 36 -11.674 -2.653 1.849
300 HG3 GLU 36 HG3 GLU 36 -10.620 -1.617 0.890
301 H LYS 37 H LYS 37 -8.259 -1.482 -1.180
302 HA LYS 37 HA LYS 37 -8.696 -3.583 -3.185
303 HB2 LYS 37 HB2 LYS 37 -10.480 -2.081 -3.359
304 HB3 LYS 37 HB3 LYS 37 -9.447 -0.679 -3.138
305 HG2 LYS 37 HG2 LYS 37 -8.878 -2.295 -5.530
306 HG3 LYS 37 HG3 LYS 37 -10.439 -1.469 -5.510
307 HD2 LYS 37 HD2 LYS 37 -9.383 0.651 -5.147
308 HD3 LYS 37 HD3 LYS 37 -7.812 -0.115 -4.923
309 HE2 LYS 37 HE2 LYS 37 -7.784 -0.810 -7.238
310 HE3 LYS 37 HE3 LYS 37 -9.413 -0.176 -7.471
311 HZ1 LYS 37 HZ1 LYS 37 -7.022 1.448 -6.751
312 HZ2 LYS 37 HZ2 LYS 37 -8.592 2.042 -7.027
313 HZ3 LYS 37 HZ3 LYS 37 -7.719 1.348 -8.297
314 H ASP 38 H ASP 38 -6.808 -0.605 -2.621
315 HA ASP 38 HA ASP 38 -5.185 -1.103 -4.961
316 HB2 ASP 38 HB2 ASP 38 -5.004 1.007 -2.803
317 HB3 ASP 38 HB3 ASP 38 -3.909 0.920 -4.178
318 H ILE 39 H ILE 39 -4.727 -1.196 -1.444
319 HA ILE 39 HA ILE 39 -1.988 -1.989 -1.632
320 HB ILE 39 HB ILE 39 -3.881 -2.169 0.722
321 HG12 ILE 39 HG12 ILE 39 -1.784 -0.108 -0.005
322 HG13 ILE 39 HG13 ILE 39 -3.526 0.127 -0.097
323 HG21 ILE 39 HG21 ILE 39 -1.848 -2.338 2.089
324 HG22 ILE 39 HG22 ILE 39 -0.875 -2.399 0.620
325 HG23 ILE 39 HG23 ILE 39 -2.007 -3.703 0.981
326 HD11 ILE 39 HD11 ILE 39 -2.581 1.184 1.873
327 HD12 ILE 39 HD12 ILE 39 -1.943 -0.369 2.412
328 HD13 ILE 39 HD13 ILE 39 -3.686 -0.115 2.324
329 H LYS 40 H LYS 40 -5.058 -3.659 -1.414
330 HA LYS 40 HA LYS 40 -3.611 -6.203 -1.760
331 HB2 LYS 40 HB2 LYS 40 -6.497 -5.797 -0.949
332 HB3 LYS 40 HB3 LYS 40 -5.679 -7.340 -1.110
333 HG2 LYS 40 HG2 LYS 40 -4.168 -6.655 0.752
334 HG3 LYS 40 HG3 LYS 40 -5.167 -5.213 0.957
335 HD2 LYS 40 HD2 LYS 40 -6.084 -8.081 1.192
336 HD3 LYS 40 HD3 LYS 40 -5.877 -6.933 2.519
337 HE2 LYS 40 HE2 LYS 40 -7.695 -5.625 1.807
338 HE3 LYS 40 HE3 LYS 40 -7.730 -6.385 0.218
339 HZ1 LYS 40 HZ1 LYS 40 -8.441 -8.454 1.297
340 HZ2 LYS 40 HZ2 LYS 40 -9.540 -7.189 1.547
341 HZ3 LYS 40 HZ3 LYS 40 -8.491 -7.656 2.798
342 HA PRO 41 HA PRO 41 -5.448 -5.137 -5.865
343 HB2 PRO 41 HB2 PRO 41 -3.070 -6.443 -6.953
344 HB3 PRO 41 HB3 PRO 41 -3.632 -4.786 -7.186
345 HG2 PRO 41 HG2 PRO 41 -1.419 -5.389 -5.750
346 HG3 PRO 41 HG3 PRO 41 -2.448 -3.994 -5.381
347 HD2 PRO 41 HD2 PRO 41 -2.339 -6.676 -4.054
348 HD3 PRO 41 HD3 PRO 41 -2.497 -5.062 -3.325
349 H ALA 42 H ALA 42 -3.462 -8.041 -5.434
350 HA ALA 42 HA ALA 42 -5.638 -9.854 -5.588
351 HB1 ALA 42 HB1 ALA 42 -3.887 -9.646 -8.041
352 HB2 ALA 42 HB2 ALA 42 -5.600 -9.235 -7.955
353 HB3 ALA 42 HB3 ALA 42 -5.080 -10.908 -7.738
354 H ILE 43 H ILE 43 -3.037 -9.139 -4.208
355 HA ILE 43 HA ILE 43 -1.798 -11.791 -4.344
356 HB ILE 43 HB ILE 43 0.416 -10.541 -3.877
357 HG12 ILE 43 HG12 ILE 43 -1.106 -8.342 -5.291
358 HG13 ILE 43 HG13 ILE 43 -0.706 -8.318 -3.578
359 HG21 ILE 43 HG21 ILE 43 0.008 -11.829 -5.886
360 HG22 ILE 43 HG22 ILE 43 0.856 -10.336 -6.290
361 HG23 ILE 43 HG23 ILE 43 -0.874 -10.481 -6.602
362 HD11 ILE 43 HD11 ILE 43 1.668 -8.335 -4.134
363 HD12 ILE 43 HD12 ILE 43 0.841 -6.967 -4.879
364 HD13 ILE 43 HD13 ILE 43 1.269 -8.377 -5.851
365 H GLY 44 H GLY 44 -2.701 -12.486 -2.458
366 HA2 GLY 44 HA2 GLY 44 -1.680 -11.141 -0.027
367 HA3 GLY 44 HA3 GLY 44 -3.190 -12.048 -0.075
368 H SER 45 H SER 45 -1.018 -13.530 -2.044
369 HA SER 45 HA SER 45 -0.599 -15.691 -0.161
370 HB2 SER 45 HB2 SER 45 0.324 -16.802 -2.286
371 HB3 SER 45 HB3 SER 45 -1.390 -16.381 -2.293
372 HG SER 45 HG SER 45 -0.163 -15.753 -4.219
373 H LEU 46 H LEU 46 0.926 -12.995 -0.310
374 HA LEU 46 HA LEU 46 3.576 -14.173 -0.018
375 HB2 LEU 46 HB2 LEU 46 4.496 -12.112 -1.221
376 HB3 LEU 46 HB3 LEU 46 3.808 -13.393 -2.194
377 HG LEU 46 HG LEU 46 1.670 -11.999 -2.261
378 HD11 LEU 46 HD11 LEU 46 1.907 -9.610 -1.908
379 HD12 LEU 46 HD12 LEU 46 3.560 -9.843 -1.338
380 HD13 LEU 46 HD13 LEU 46 2.207 -10.492 -0.410
381 HD21 LEU 46 HD21 LEU 46 2.547 -10.567 -4.063
382 HD22 LEU 46 HD22 LEU 46 3.110 -12.234 -4.180
383 HD23 LEU 46 HD23 LEU 46 4.187 -10.980 -3.563
384 H LYS 47 H LYS 47 5.097 -12.751 1.127
385 HA LYS 47 HA LYS 47 3.674 -11.312 3.227
386 HB2 LYS 47 HB2 LYS 47 6.583 -12.102 3.027
387 HB3 LYS 47 HB3 LYS 47 5.823 -11.354 4.422
388 HG2 LYS 47 HG2 LYS 47 4.410 -13.305 4.722
389 HG3 LYS 47 HG3 LYS 47 5.130 -14.054 3.293
390 HD2 LYS 47 HD2 LYS 47 6.533 -13.324 5.864
391 HD3 LYS 47 HD3 LYS 47 6.194 -14.948 5.263
392 HE2 LYS 47 HE2 LYS 47 7.625 -14.499 3.311
393 HE3 LYS 47 HE3 LYS 47 7.995 -12.906 3.969
394 HZ1 LYS 47 HZ1 LYS 47 9.767 -14.312 4.540
395 HZ2 LYS 47 HZ2 LYS 47 8.737 -15.547 5.080
396 HZ3 LYS 47 HZ3 LYS 47 8.875 -14.111 5.967
397 H VAL 48 H VAL 48 5.449 -9.561 4.136
398 HA VAL 48 HA VAL 48 5.080 -7.356 2.400
399 HB VAL 48 HB VAL 48 6.938 -7.456 4.779
400 HG11 VAL 48 HG11 VAL 48 6.357 -5.076 4.986
401 HG12 VAL 48 HG12 VAL 48 5.401 -5.194 3.509
402 HG13 VAL 48 HG13 VAL 48 7.146 -5.442 3.452
403 HG21 VAL 48 HG21 VAL 48 3.958 -6.995 4.730
404 HG22 VAL 48 HG22 VAL 48 5.004 -6.722 6.124
405 HG23 VAL 48 HG23 VAL 48 4.804 -8.351 5.477
406 H GLU 49 H GLU 49 7.702 -9.594 2.869
407 HA GLU 49 HA GLU 49 9.602 -7.904 1.475
408 HB2 GLU 49 HB2 GLU 49 11.216 -9.657 1.880
409 HB3 GLU 49 HB3 GLU 49 10.336 -9.318 3.364
410 HG2 GLU 49 HG2 GLU 49 8.987 -11.299 3.057
411 HG3 GLU 49 HG3 GLU 49 9.763 -11.615 1.504
412 H ASP 50 H ASP 50 7.284 -10.279 0.701
413 HA ASP 50 HA ASP 50 8.650 -11.200 -1.686
414 HB2 ASP 50 HB2 ASP 50 5.918 -11.831 -0.566
415 HB3 ASP 50 HB3 ASP 50 6.569 -12.539 -2.042
416 H VAL 51 H VAL 51 6.230 -8.887 -0.792
417 HA VAL 51 HA VAL 51 5.344 -8.459 -3.487
418 HB VAL 51 HB VAL 51 3.822 -7.976 -1.651
419 HG11 VAL 51 HG11 VAL 51 5.421 -7.288 0.044
420 HG12 VAL 51 HG12 VAL 51 4.144 -6.085 -0.147
421 HG13 VAL 51 HG13 VAL 51 5.738 -5.797 -0.844
422 HG21 VAL 51 HG21 VAL 51 3.477 -6.742 -3.700
423 HG22 VAL 51 HG22 VAL 51 4.595 -5.488 -3.166
424 HG23 VAL 51 HG23 VAL 51 3.072 -5.732 -2.312
425 H LYS 52 H LYS 52 7.686 -8.449 -4.106
426 HA LYS 52 HA LYS 52 9.490 -6.435 -3.581
427 HB2 LYS 52 HB2 LYS 52 9.057 -7.967 -6.146
428 HB3 LYS 52 HB3 LYS 52 10.472 -6.978 -5.812
429 HG2 LYS 52 HG2 LYS 52 10.966 -8.412 -3.861
430 HG3 LYS 52 HG3 LYS 52 9.606 -9.442 -4.314
431 HD2 LYS 52 HD2 LYS 52 10.666 -9.908 -6.463
432 HD3 LYS 52 HD3 LYS 52 12.016 -8.856 -6.035
433 HE2 LYS 52 HE2 LYS 52 12.518 -10.328 -4.121
434 HE3 LYS 52 HE3 LYS 52 11.213 -11.400 -4.625
435 HZ1 LYS 52 HZ1 LYS 52 13.405 -12.158 -5.381
436 HZ2 LYS 52 HZ2 LYS 52 13.592 -10.730 -6.279
437 HZ3 LYS 52 HZ3 LYS 52 12.366 -11.833 -6.682
438 HA PRO 53 HA PRO 53 8.506 -2.467 -5.025
439 HB2 PRO 53 HB2 PRO 53 10.675 -2.892 -7.051
440 HB3 PRO 53 HB3 PRO 53 10.349 -1.479 -6.038
441 HG2 PRO 53 HG2 PRO 53 12.243 -3.219 -5.361
442 HG3 PRO 53 HG3 PRO 53 11.199 -2.483 -4.129
443 HD2 PRO 53 HD2 PRO 53 11.228 -5.255 -5.168
444 HD3 PRO 53 HD3 PRO 53 10.664 -4.640 -3.604
445 H ARG 54 H ARG 54 9.144 -4.666 -7.797
446 HA ARG 54 HA ARG 54 7.799 -2.987 -9.640
447 HB2 ARG 54 HB2 ARG 54 9.470 -5.072 -9.943
448 HB3 ARG 54 HB3 ARG 54 7.939 -5.877 -10.266
449 HG2 ARG 54 HG2 ARG 54 8.799 -3.354 -11.662
450 HG3 ARG 54 HG3 ARG 54 9.146 -4.970 -12.274
451 HD2 ARG 54 HD2 ARG 54 6.907 -5.429 -12.694
452 HD3 ARG 54 HD3 ARG 54 6.344 -4.179 -11.587
453 HE ARG 54 HE ARG 54 6.905 -2.526 -13.224
454 HH11 ARG 54 HH11 ARG 54 7.107 -5.840 -14.354
455 HH12 ARG 54 HH12 ARG 54 6.969 -5.415 -16.030
456 HH21 ARG 54 HH21 ARG 54 6.720 -1.963 -15.435
457 HH22 ARG 54 HH22 ARG 54 6.739 -3.215 -16.647
458 H HIS 55 H HIS 55 6.637 -5.331 -7.383
459 HA HIS 55 HA HIS 55 4.112 -5.854 -8.548
460 HB2 HIS 55 HB2 HIS 55 5.128 -5.860 -5.716
461 HB3 HIS 55 HB3 HIS 55 3.419 -6.114 -6.056
462 HD1 HIS 55 HD1 HIS 55 6.570 -7.898 -5.800
463 HD2 HIS 55 HD2 HIS 55 2.988 -8.384 -7.820
464 HE1 HIS 55 HE1 HIS 55 6.502 -10.324 -6.464
465 HE2 HIS 55 HE2 HIS 55 4.411 -10.544 -7.865
466 H ILE 56 H ILE 56 5.192 -3.439 -6.226
467 HA ILE 56 HA ILE 56 2.773 -1.959 -6.155
468 HB ILE 56 HB ILE 56 5.571 -0.964 -5.562
469 HG12 ILE 56 HG12 ILE 56 5.053 -2.958 -4.229
470 HG13 ILE 56 HG13 ILE 56 5.095 -1.520 -3.215
471 HG21 ILE 56 HG21 ILE 56 3.962 0.834 -5.828
472 HG22 ILE 56 HG22 ILE 56 4.438 0.681 -4.138
473 HG23 ILE 56 HG23 ILE 56 2.878 0.058 -4.673
474 HD11 ILE 56 HD11 ILE 56 2.665 -1.441 -3.207
475 HD12 ILE 56 HD12 ILE 56 3.257 -2.992 -2.611
476 HD13 ILE 56 HD13 ILE 56 2.610 -2.866 -4.247
477 H ASP 57 H ASP 57 5.653 -1.867 -8.129
478 HA ASP 57 HA ASP 57 5.308 0.590 -9.427
479 HB2 ASP 57 HB2 ASP 57 7.401 -0.622 -9.534
480 HB3 ASP 57 HB3 ASP 57 6.624 -1.983 -10.331
481 H ASP 58 H ASP 58 4.106 -2.636 -10.167
482 HA ASP 58 HA ASP 58 2.935 -1.874 -12.664
483 HB2 ASP 58 HB2 ASP 58 3.652 -4.208 -12.105
484 HB3 ASP 58 HB3 ASP 58 2.294 -4.308 -10.991
485 H VAL 59 H VAL 59 1.677 -2.354 -9.365
486 HA VAL 59 HA VAL 59 -1.031 -1.967 -10.155
487 HB VAL 59 HB VAL 59 -1.600 -1.836 -7.798
488 HG11 VAL 59 HG11 VAL 59 -1.252 -4.025 -8.779
489 HG12 VAL 59 HG12 VAL 59 -0.735 -4.017 -7.093
490 HG13 VAL 59 HG13 VAL 59 0.467 -3.950 -8.382
491 HG21 VAL 59 HG21 VAL 59 1.374 -1.806 -7.287
492 HG22 VAL 59 HG22 VAL 59 0.122 -1.975 -6.056
493 HG23 VAL 59 HG23 VAL 59 0.249 -0.481 -6.983
494 H LEU 60 H LEU 60 1.507 0.207 -9.033
495 HA LEU 60 HA LEU 60 -0.119 2.498 -8.744
496 HB2 LEU 60 HB2 LEU 60 2.799 2.195 -9.428
497 HB3 LEU 60 HB3 LEU 60 2.032 3.757 -9.224
498 HG LEU 60 HG LEU 60 2.330 1.618 -7.117
499 HD11 LEU 60 HD11 LEU 60 4.386 2.817 -7.591
500 HD12 LEU 60 HD12 LEU 60 3.746 3.285 -6.015
501 HD13 LEU 60 HD13 LEU 60 3.550 4.358 -7.401
502 HD21 LEU 60 HD21 LEU 60 1.325 3.229 -5.582
503 HD22 LEU 60 HD22 LEU 60 0.200 2.791 -6.867
504 HD23 LEU 60 HD23 LEU 60 1.043 4.340 -6.921
505 H LYS 61 H LYS 61 1.653 1.164 -11.506
506 HA LYS 61 HA LYS 61 1.064 3.080 -13.418
507 HB2 LYS 61 HB2 LYS 61 2.641 1.323 -13.808
508 HB3 LYS 61 HB3 LYS 61 1.419 0.090 -13.546
509 HG2 LYS 61 HG2 LYS 61 0.270 1.219 -15.600
510 HG3 LYS 61 HG3 LYS 61 1.908 1.807 -15.920
511 HD2 LYS 61 HD2 LYS 61 1.046 -1.060 -15.579
512 HD3 LYS 61 HD3 LYS 61 1.572 -0.277 -17.060
513 HE2 LYS 61 HE2 LYS 61 3.296 -0.547 -14.618
514 HE3 LYS 61 HE3 LYS 61 3.297 -1.705 -15.941
515 HZ1 LYS 61 HZ1 LYS 61 3.985 1.181 -16.152
516 HZ2 LYS 61 HZ2 LYS 61 3.968 0.080 -17.443
517 HZ3 LYS 61 HZ3 LYS 61 5.083 -0.111 -16.180
518 H ALA 62 H ALA 62 -0.699 0.131 -12.541
519 HA ALA 62 HA ALA 62 -2.848 0.377 -14.288
520 HB1 ALA 62 HB1 ALA 62 -2.856 -0.837 -11.530
521 HB2 ALA 62 HB2 ALA 62 -2.359 -1.649 -13.015
522 HB3 ALA 62 HB3 ALA 62 -4.036 -1.143 -12.806
523 H VAL 63 H VAL 63 -2.634 1.528 -10.896
524 HA VAL 63 HA VAL 63 -5.277 2.574 -10.924
525 HB VAL 63 HB VAL 63 -4.145 1.927 -8.832
526 HG11 VAL 63 HG11 VAL 63 -1.916 2.756 -9.277
527 HG12 VAL 63 HG12 VAL 63 -2.541 3.447 -7.780
528 HG13 VAL 63 HG13 VAL 63 -2.506 4.418 -9.251
529 HG21 VAL 63 HG21 VAL 63 -4.935 3.811 -7.474
530 HG22 VAL 63 HG22 VAL 63 -6.082 3.383 -8.745
531 HG23 VAL 63 HG23 VAL 63 -5.049 4.801 -8.929
532 H MET 64 H MET 64 -2.152 3.947 -11.764
533 HA MET 64 HA MET 64 -3.045 6.650 -11.937
534 HB2 MET 64 HB2 MET 64 -0.754 5.217 -13.296
535 HB3 MET 64 HB3 MET 64 -1.055 6.940 -13.470
536 HG2 MET 64 HG2 MET 64 -0.752 7.234 -11.065
537 HG3 MET 64 HG3 MET 64 -0.453 5.504 -10.893
538 HE1 MET 64 HE1 MET 64 1.841 5.943 -9.667
539 HE2 MET 64 HE2 MET 64 1.561 7.680 -9.777
540 HE3 MET 64 HE3 MET 64 3.104 7.002 -10.296
541 H LYS 65 H LYS 65 -3.065 3.909 -14.114
542 HA LYS 65 HA LYS 65 -3.790 5.383 -16.430
543 HB2 LYS 65 HB2 LYS 65 -2.595 3.276 -16.588
544 HB3 LYS 65 HB3 LYS 65 -3.910 2.436 -15.784
545 HG2 LYS 65 HG2 LYS 65 -4.447 3.890 -18.327
546 HG3 LYS 65 HG3 LYS 65 -3.643 2.318 -18.370
547 HD2 LYS 65 HD2 LYS 65 -6.236 2.822 -16.925
548 HD3 LYS 65 HD3 LYS 65 -6.142 2.265 -18.590
549 HE2 LYS 65 HE2 LYS 65 -4.790 0.826 -16.328
550 HE3 LYS 65 HE3 LYS 65 -6.449 0.486 -16.811
551 HZ1 LYS 65 HZ1 LYS 65 -5.607 0.007 -19.061
552 HZ2 LYS 65 HZ2 LYS 65 -4.975 -1.049 -17.894
553 HZ3 LYS 65 HZ3 LYS 65 -4.019 0.214 -18.501
554 H ARG 66 H ARG 66 -5.614 3.205 -14.266
555 HA ARG 66 HA ARG 66 -8.043 3.807 -15.708
556 HB2 ARG 66 HB2 ARG 66 -9.112 2.184 -14.266
557 HB3 ARG 66 HB3 ARG 66 -7.607 1.537 -14.894
558 HG2 ARG 66 HG2 ARG 66 -6.523 2.115 -12.736
559 HG3 ARG 66 HG3 ARG 66 -8.109 2.585 -12.120
560 HD2 ARG 66 HD2 ARG 66 -7.295 -0.140 -13.118
561 HD3 ARG 66 HD3 ARG 66 -7.594 0.319 -11.443
562 HE ARG 66 HE ARG 66 -9.890 0.864 -12.977
563 HH11 ARG 66 HH11 ARG 66 -8.056 -1.890 -11.813
564 HH12 ARG 66 HH12 ARG 66 -9.460 -2.909 -11.674
565 HH21 ARG 66 HH21 ARG 66 -11.712 -0.501 -12.824
566 HH22 ARG 66 HH22 ARG 66 -11.514 -2.135 -12.256
567 H GLY 67 H GLY 67 -6.428 5.102 -12.992
568 HA2 GLY 67 HA2 GLY 67 -8.892 6.562 -12.264
569 HA3 GLY 67 HA3 GLY 67 -7.707 6.055 -11.067
570 H ALA 68 H ALA 68 -5.890 7.268 -10.733
571 HA ALA 68 HA ALA 68 -5.109 9.374 -12.523
572 HB1 ALA 68 HB1 ALA 68 -5.511 11.232 -10.992
573 HB2 ALA 68 HB2 ALA 68 -6.293 10.138 -9.850
574 HB3 ALA 68 HB3 ALA 68 -7.027 10.442 -11.424
575 HA PRO 69 HA PRO 69 -1.281 8.483 -10.577
576 HB2 PRO 69 HB2 PRO 69 -0.368 11.158 -11.345
577 HB3 PRO 69 HB3 PRO 69 0.165 9.580 -11.921
578 HG2 PRO 69 HG2 PRO 69 -1.255 11.274 -13.467
579 HG3 PRO 69 HG3 PRO 69 -1.382 9.511 -13.609
580 HD2 PRO 69 HD2 PRO 69 -3.225 11.445 -12.262
581 HD3 PRO 69 HD3 PRO 69 -3.607 10.009 -13.237
582 H SER 70 H SER 70 -2.851 11.569 -9.961
583 HA SER 70 HA SER 70 -1.365 12.402 -7.745
584 HB2 SER 70 HB2 SER 70 -4.322 12.875 -8.149
585 HB3 SER 70 HB3 SER 70 -3.159 13.921 -7.330
586 HG SER 70 HG SER 70 -3.625 14.650 -9.459
587 H ILE 71 H ILE 71 -4.083 10.187 -8.031
588 HA ILE 71 HA ILE 71 -4.544 9.835 -5.254
589 HB ILE 71 HB ILE 71 -5.124 7.929 -7.532
590 HG12 ILE 71 HG12 ILE 71 -6.907 9.983 -6.202
591 HG13 ILE 71 HG13 ILE 71 -6.179 10.155 -7.795
592 HG21 ILE 71 HG21 ILE 71 -6.788 6.956 -6.014
593 HG22 ILE 71 HG22 ILE 71 -6.243 8.037 -4.732
594 HG23 ILE 71 HG23 ILE 71 -5.153 6.805 -5.373
595 HD11 ILE 71 HD11 ILE 71 -8.205 8.083 -6.977
596 HD12 ILE 71 HD12 ILE 71 -7.461 8.210 -8.571
597 HD13 ILE 71 HD13 ILE 71 -8.501 9.504 -7.976
598 H ALA 72 H ALA 72 -2.701 7.997 -7.662
599 HA ALA 72 HA ALA 72 -1.790 5.961 -5.977
600 HB1 ALA 72 HB1 ALA 72 -0.077 5.560 -7.672
601 HB2 ALA 72 HB2 ALA 72 -0.448 7.116 -8.417
602 HB3 ALA 72 HB3 ALA 72 -1.658 5.832 -8.403
603 H ASN 73 H ASN 73 -0.515 9.175 -6.608
604 HA ASN 73 HA ASN 73 1.973 8.825 -5.306
605 HB2 ASN 73 HB2 ASN 73 1.595 10.607 -6.923
606 HB3 ASN 73 HB3 ASN 73 0.343 11.307 -5.907
607 HD21 ASN 73 HD21 ASN 73 0.900 12.520 -4.149
608 HD22 ASN 73 HD22 ASN 73 2.516 13.077 -3.887
609 H ASP 74 H ASP 74 -1.241 9.717 -4.186
610 HA ASP 74 HA ASP 74 -0.343 10.355 -1.536
611 HB2 ASP 74 HB2 ASP 74 -2.503 11.195 -2.539
612 HB3 ASP 74 HB3 ASP 74 -3.146 9.565 -2.349
613 H THR 75 H THR 75 -1.738 7.537 -3.148
614 HA THR 75 HA THR 75 -1.974 5.813 -0.986
615 HB THR 75 HB THR 75 -1.129 5.039 -3.787
616 HG1 THR 75 HG1 THR 75 -3.643 4.650 -3.649
617 HG21 THR 75 HG21 THR 75 -0.937 3.222 -2.144
618 HG22 THR 75 HG22 THR 75 -2.244 2.919 -3.289
619 HG23 THR 75 HG23 THR 75 -2.613 3.487 -1.662
620 H LEU 76 H LEU 76 0.865 6.356 -3.089
621 HA LEU 76 HA LEU 76 2.512 4.499 -1.727
622 HB2 LEU 76 HB2 LEU 76 4.398 5.584 -2.886
623 HB3 LEU 76 HB3 LEU 76 3.096 5.139 -3.960
624 HG LEU 76 HG LEU 76 2.397 7.653 -3.680
625 HD11 LEU 76 HD11 LEU 76 4.324 9.136 -3.421
626 HD12 LEU 76 HD12 LEU 76 5.341 7.750 -3.029
627 HD13 LEU 76 HD13 LEU 76 4.024 8.210 -1.951
628 HD21 LEU 76 HD21 LEU 76 3.776 8.209 -5.617
629 HD22 LEU 76 HD22 LEU 76 3.076 6.596 -5.765
630 HD23 LEU 76 HD23 LEU 76 4.772 6.785 -5.319
631 H ARG 77 H ARG 77 1.655 7.792 -1.127
632 HA ARG 77 HA ARG 77 3.694 8.434 0.724
633 HB2 ARG 77 HB2 ARG 77 1.999 9.980 -0.460
634 HB3 ARG 77 HB3 ARG 77 0.895 9.531 0.831
635 HG2 ARG 77 HG2 ARG 77 2.424 10.432 2.483
636 HG3 ARG 77 HG3 ARG 77 3.579 10.837 1.210
637 HD2 ARG 77 HD2 ARG 77 1.649 12.177 0.174
638 HD3 ARG 77 HD3 ARG 77 0.886 12.031 1.757
639 HE ARG 77 HE ARG 77 3.151 13.032 2.541
640 HH11 ARG 77 HH11 ARG 77 1.358 13.871 -0.350
641 HH12 ARG 77 HH12 ARG 77 2.019 15.474 -0.447
642 HH21 ARG 77 HH21 ARG 77 4.034 15.143 2.403
643 HH22 ARG 77 HH22 ARG 77 3.526 16.194 1.103
644 H TRP 78 H TRP 78 0.565 6.824 1.031
645 HA TRP 78 HA TRP 78 0.657 6.605 3.878
646 HB2 TRP 78 HB2 TRP 78 -0.872 5.009 1.816
647 HB3 TRP 78 HB3 TRP 78 -1.062 4.798 3.550
648 HD1 TRP 78 HD1 TRP 78 -2.174 6.942 0.678
649 HE1 TRP 78 HE1 TRP 78 -3.847 8.713 1.502
650 HE3 TRP 78 HE3 TRP 78 -1.592 6.304 5.719
651 HZ2 TRP 78 HZ2 TRP 78 -4.802 9.698 3.971
652 HZ3 TRP 78 HZ3 TRP 78 -2.930 7.699 7.243
653 HH2 TRP 78 HH2 TRP 78 -4.500 9.361 6.385
654 H LEU 79 H LEU 79 1.778 4.628 1.200
655 HA LEU 79 HA LEU 79 2.429 2.276 2.554
656 HB2 LEU 79 HB2 LEU 79 3.901 3.528 0.231
657 HB3 LEU 79 HB3 LEU 79 4.021 1.854 0.734
658 HG LEU 79 HG LEU 79 1.562 3.196 -0.394
659 HD11 LEU 79 HD11 LEU 79 3.273 2.782 -2.064
660 HD12 LEU 79 HD12 LEU 79 1.920 1.673 -2.281
661 HD13 LEU 79 HD13 LEU 79 3.412 1.106 -1.532
662 HD21 LEU 79 HD21 LEU 79 1.990 0.326 0.433
663 HD22 LEU 79 HD22 LEU 79 0.548 0.984 -0.342
664 HD23 LEU 79 HD23 LEU 79 0.989 1.504 1.285
665 H LYS 80 H LYS 80 4.195 5.290 2.216
666 HA LYS 80 HA LYS 80 6.653 4.801 3.230
667 HB2 LYS 80 HB2 LYS 80 6.027 6.981 2.519
668 HB3 LYS 80 HB3 LYS 80 4.707 7.056 3.673
669 HG2 LYS 80 HG2 LYS 80 6.236 8.423 4.656
670 HG3 LYS 80 HG3 LYS 80 6.615 6.886 5.433
671 HD2 LYS 80 HD2 LYS 80 8.027 7.866 2.972
672 HD3 LYS 80 HD3 LYS 80 8.550 8.245 4.598
673 HE2 LYS 80 HE2 LYS 80 8.689 5.793 5.054
674 HE3 LYS 80 HE3 LYS 80 8.367 5.524 3.339
675 HZ1 LYS 80 HZ1 LYS 80 10.702 5.465 3.636
676 HZ2 LYS 80 HZ2 LYS 80 10.706 6.897 4.542
677 HZ3 LYS 80 HZ3 LYS 80 10.352 6.945 2.881
678 H ARG 81 H ARG 81 3.741 5.490 5.157
679 HA ARG 81 HA ARG 81 5.069 5.130 7.658
680 HB2 ARG 81 HB2 ARG 81 2.089 4.995 7.262
681 HB3 ARG 81 HB3 ARG 81 2.981 5.577 8.659
682 HG2 ARG 81 HG2 ARG 81 3.733 7.514 7.366
683 HG3 ARG 81 HG3 ARG 81 2.817 6.934 5.976
684 HD2 ARG 81 HD2 ARG 81 0.776 6.989 7.476
685 HD3 ARG 81 HD3 ARG 81 1.770 7.877 8.627
686 HE ARG 81 HE ARG 81 1.317 8.856 5.879
687 HH11 ARG 81 HH11 ARG 81 1.338 9.399 9.351
688 HH12 ARG 81 HH12 ARG 81 0.908 11.082 9.200
689 HH21 ARG 81 HH21 ARG 81 0.751 11.036 5.694
690 HH22 ARG 81 HH22 ARG 81 0.570 12.008 7.123
691 H MET 82 H MET 82 2.776 3.189 5.770
692 HA MET 82 HA MET 82 2.313 1.181 7.643
693 HB2 MET 82 HB2 MET 82 0.990 1.525 5.573
694 HB3 MET 82 HB3 MET 82 2.318 0.852 4.641
695 HG2 MET 82 HG2 MET 82 2.084 -1.266 5.836
696 HG3 MET 82 HG3 MET 82 0.748 -0.590 6.766
697 HE1 MET 82 HE1 MET 82 0.627 -1.458 2.236
698 HE2 MET 82 HE2 MET 82 1.948 -1.948 3.296
699 HE3 MET 82 HE3 MET 82 1.685 -0.238 2.948
700 H PHE 83 H PHE 83 4.768 1.242 5.051
701 HA PHE 83 HA PHE 83 5.682 -1.390 5.625
702 HB2 PHE 83 HB2 PHE 83 6.833 0.848 3.976
703 HB3 PHE 83 HB3 PHE 83 7.689 -0.675 4.203
704 HD1 PHE 83 HD2 PHE 83 6.002 -2.786 3.876
705 HD2 PHE 83 HD1 PHE 83 5.679 1.018 2.001
706 HE1 PHE 83 HE2 PHE 83 4.711 -3.804 2.046
707 HE2 PHE 83 HE1 PHE 83 4.385 0.009 0.169
708 HZ PHE 83 HZ PHE 83 3.901 -2.405 0.187
709 H ASN 84 H ASN 84 6.428 1.706 6.964
710 HA ASN 84 HA ASN 84 8.945 1.149 8.096
711 HB2 ASN 84 HB2 ASN 84 8.081 3.421 8.039
712 HB3 ASN 84 HB3 ASN 84 6.724 2.966 9.064
713 HD21 ASN 84 HD21 ASN 84 10.118 3.618 8.933
714 HD22 ASN 84 HD22 ASN 84 10.359 3.722 10.636
715 H TYR 85 H TYR 85 5.672 0.780 9.362
716 HA TYR 85 HA TYR 85 6.209 -0.289 11.857
717 HB2 TYR 85 HB2 TYR 85 3.937 -0.756 9.939
718 HB3 TYR 85 HB3 TYR 85 3.994 -1.565 11.499
719 HD1 TYR 85 HD1 TYR 85 3.917 1.781 9.894
720 HD2 TYR 85 HD2 TYR 85 3.285 -0.473 13.443
721 HE1 TYR 85 HE1 TYR 85 2.856 3.738 10.938
722 HE2 TYR 85 HE2 TYR 85 2.224 1.476 14.502
723 HH TYR 85 HH TYR 85 1.374 4.303 12.715
724 H ALA 86 H ALA 86 6.149 -1.921 8.723
725 HA ALA 86 HA ALA 86 6.302 -4.562 9.696
726 HB1 ALA 86 HB1 ALA 86 6.987 -5.169 7.437
727 HB2 ALA 86 HB2 ALA 86 7.280 -3.472 7.060
728 HB3 ALA 86 HB3 ALA 86 5.642 -4.028 7.405
729 H ILE 87 H ILE 87 8.764 -2.153 8.995
730 HA ILE 87 HA ILE 87 10.993 -3.898 9.366
731 HB ILE 87 HB ILE 87 10.891 -0.882 9.630
732 HG12 ILE 87 HG12 ILE 87 11.627 -2.593 7.241
733 HG13 ILE 87 HG13 ILE 87 10.116 -1.708 7.420
734 HG21 ILE 87 HG21 ILE 87 13.304 -0.994 9.180
735 HG22 ILE 87 HG22 ILE 87 13.218 -2.756 9.191
736 HG23 ILE 87 HG23 ILE 87 12.872 -1.847 10.662
737 HD11 ILE 87 HD11 ILE 87 11.672 -0.532 5.976
738 HD12 ILE 87 HD12 ILE 87 12.864 -0.491 7.275
739 HD13 ILE 87 HD13 ILE 87 11.347 0.395 7.441
740 H LYS 88 H LYS 88 9.161 -1.699 11.440
741 HA LYS 88 HA LYS 88 10.779 -2.002 13.741
742 HB2 LYS 88 HB2 LYS 88 9.340 -0.106 13.580
743 HB3 LYS 88 HB3 LYS 88 7.923 -1.114 13.334
744 HG2 LYS 88 HG2 LYS 88 9.318 -1.616 15.856
745 HG3 LYS 88 HG3 LYS 88 8.665 0.016 15.694
746 HD2 LYS 88 HD2 LYS 88 6.992 -2.377 15.021
747 HD3 LYS 88 HD3 LYS 88 7.167 -1.839 16.687
748 HE2 LYS 88 HE2 LYS 88 6.267 -0.048 14.441
749 HE3 LYS 88 HE3 LYS 88 5.156 -0.940 15.480
750 HZ1 LYS 88 HZ1 LYS 88 6.032 0.245 17.390
751 HZ2 LYS 88 HZ2 LYS 88 5.465 1.349 16.236
752 HZ3 LYS 88 HZ3 LYS 88 7.133 1.085 16.412
753 H ARG 89 H ARG 89 8.170 -3.863 12.377
754 HA ARG 89 HA ARG 89 7.847 -5.572 14.667
755 HB2 ARG 89 HB2 ARG 89 6.927 -5.782 11.801
756 HB3 ARG 89 HB3 ARG 89 6.589 -7.019 13.002
757 HG2 ARG 89 HG2 ARG 89 5.806 -4.164 13.459
758 HG3 ARG 89 HG3 ARG 89 4.794 -5.255 12.512
759 HD2 ARG 89 HD2 ARG 89 4.061 -5.181 14.834
760 HD3 ARG 89 HD3 ARG 89 4.654 -6.785 14.409
761 HE ARG 89 HE ARG 89 6.710 -5.205 15.573
762 HH11 ARG 89 HH11 ARG 89 3.811 -6.990 16.419
763 HH12 ARG 89 HH12 ARG 89 4.404 -7.434 17.989
764 HH21 ARG 89 HH21 ARG 89 7.467 -5.784 17.661
765 HH22 ARG 89 HH22 ARG 89 6.471 -6.773 18.690
766 H HIS 90 H HIS 90 10.255 -5.207 12.425
767 HA HIS 90 HA HIS 90 12.133 -6.363 11.919
768 HB2 HIS 90 HB2 HIS 90 11.180 -8.107 14.191
769 HB3 HIS 90 HB3 HIS 90 12.694 -8.391 13.337
770 HD1 HIS 90 HD1 HIS 90 11.688 -7.038 16.368
771 HD2 HIS 90 HD2 HIS 90 14.140 -5.608 13.326
772 HE1 HIS 90 HE1 HIS 90 13.141 -5.289 17.434
773 HE2 HIS 90 HE2 HIS 90 14.746 -4.580 15.627
774 H ILE 91 H ILE 91 9.533 -6.927 10.640
775 HA ILE 91 HA ILE 91 9.704 -9.708 9.845
776 HB ILE 91 HB ILE 91 7.990 -7.469 8.745
777 HG12 ILE 91 HG12 ILE 91 7.310 -9.700 10.672
778 HG13 ILE 91 HG13 ILE 91 7.522 -8.007 11.106
779 HG21 ILE 91 HG21 ILE 91 8.327 -9.254 7.118
780 HG22 ILE 91 HG22 ILE 91 6.665 -9.236 7.706
781 HG23 ILE 91 HG23 ILE 91 7.800 -10.447 8.306
782 HD11 ILE 91 HD11 ILE 91 5.395 -9.099 9.277
783 HD12 ILE 91 HD12 ILE 91 5.603 -7.407 9.734
784 HD13 ILE 91 HD13 ILE 91 5.171 -8.605 10.955
785 H ILE 92 H ILE 92 10.401 -6.523 8.496
786 HA ILE 92 HA ILE 92 12.022 -7.828 6.422
787 HB ILE 92 HB ILE 92 11.443 -6.044 4.836
788 HG12 ILE 92 HG12 ILE 92 9.354 -5.199 6.859
789 HG13 ILE 92 HG13 ILE 92 10.859 -4.333 6.568
790 HG21 ILE 92 HG21 ILE 92 9.148 -6.763 4.331
791 HG22 ILE 92 HG22 ILE 92 9.047 -7.514 5.924
792 HG23 ILE 92 HG23 ILE 92 10.199 -8.121 4.734
793 HD11 ILE 92 HD11 ILE 92 10.172 -3.916 4.263
794 HD12 ILE 92 HD12 ILE 92 8.999 -3.284 5.420
795 HD13 ILE 92 HD13 ILE 92 8.667 -4.786 4.558
796 H GLU 93 H GLU 93 13.638 -6.269 5.476
797 HA GLU 93 HA GLU 93 14.659 -4.479 7.582
798 HB2 GLU 93 HB2 GLU 93 16.108 -6.404 7.140
799 HB3 GLU 93 HB3 GLU 93 16.161 -5.987 5.435
800 HG2 GLU 93 HG2 GLU 93 17.343 -3.939 5.948
801 HG3 GLU 93 HG3 GLU 93 17.233 -4.289 7.673
802 H TYR 94 H TYR 94 14.215 -4.919 4.109
803 HA TYR 94 HA TYR 94 14.317 -1.990 3.807
804 HB2 TYR 94 HB2 TYR 94 14.867 -4.111 1.717
805 HB3 TYR 94 HB3 TYR 94 14.878 -2.375 1.435
806 HD1 TYR 94 HD2 TYR 94 16.587 -0.982 2.765
807 HD2 TYR 94 HD1 TYR 94 16.813 -5.212 2.370
808 HE1 TYR 94 HE2 TYR 94 18.975 -0.905 3.347
809 HE2 TYR 94 HE1 TYR 94 19.199 -5.147 2.953
810 HH TYR 94 HH TYR 94 20.678 -2.443 4.321
811 H ASN 95 H ASN 95 12.649 -1.007 2.631
812 HA ASN 95 HA ASN 95 10.239 -2.648 2.432
813 HB2 ASN 95 HB2 ASN 95 9.024 -0.495 2.280
814 HB3 ASN 95 HB3 ASN 95 9.996 -0.611 3.739
815 HD21 ASN 95 HD21 ASN 95 8.956 1.737 2.320
816 HD22 ASN 95 HD22 ASN 95 10.334 2.724 1.975
817 HA PRO 96 HA PRO 96 10.434 -2.803 -1.981
818 HB2 PRO 96 HB2 PRO 96 7.767 -3.072 -2.514
819 HB3 PRO 96 HB3 PRO 96 8.796 -4.395 -1.955
820 HG2 PRO 96 HG2 PRO 96 6.900 -2.680 -0.409
821 HG3 PRO 96 HG3 PRO 96 7.203 -4.422 -0.276
822 HD2 PRO 96 HD2 PRO 96 8.232 -2.628 1.468
823 HD3 PRO 96 HD3 PRO 96 9.083 -4.121 1.025
824 H ALA 97 H ALA 97 8.603 -0.455 -0.265
825 HA ALA 97 HA ALA 97 7.961 1.097 -2.634
826 HB1 ALA 97 HB1 ALA 97 7.467 1.706 0.279
827 HB2 ALA 97 HB2 ALA 97 6.318 0.958 -0.830
828 HB3 ALA 97 HB3 ALA 97 6.841 2.620 -1.094
829 H ALA 98 H ALA 98 10.766 0.574 -1.407
830 HA ALA 98 HA ALA 98 11.806 3.020 -0.500
831 HB1 ALA 98 HB1 ALA 98 13.230 0.817 -1.992
832 HB2 ALA 98 HB2 ALA 98 12.996 0.903 -0.245
833 HB3 ALA 98 HB3 ALA 98 13.999 2.103 -1.061
834 H ALA 99 H ALA 99 11.208 1.789 -3.711
835 HA ALA 99 HA ALA 99 12.619 3.966 -5.005
836 HB1 ALA 99 HB1 ALA 99 12.673 1.725 -5.984
837 HB2 ALA 99 HB2 ALA 99 11.945 2.894 -7.087
838 HB3 ALA 99 HB3 ALA 99 10.922 1.771 -6.190
839 H PHE 100 H PHE 100 9.672 3.634 -3.559
840 HA PHE 100 HA PHE 100 8.416 5.659 -5.304
841 HB2 PHE 100 HB2 PHE 100 6.936 3.628 -3.612
842 HB3 PHE 100 HB3 PHE 100 6.257 4.709 -4.826
843 HD1 PHE 100 HD2 PHE 100 6.956 4.366 -7.246
844 HD2 PHE 100 HD1 PHE 100 7.648 1.493 -4.186
845 HE1 PHE 100 HE2 PHE 100 7.254 2.621 -8.956
846 HE2 PHE 100 HE1 PHE 100 7.944 -0.257 -5.886
847 HZ PHE 100 HZ PHE 100 7.750 0.307 -8.273
848 H ASP 101 H ASP 101 10.181 5.724 -2.930
849 HA ASP 101 HA ASP 101 8.501 6.689 -0.772
850 HB2 ASP 101 HB2 ASP 101 10.254 5.220 -0.112
851 HB3 ASP 101 HB3 ASP 101 11.447 6.114 -1.043
852 HA PRO 102 HA PRO 102 9.152 10.877 -2.216
853 HB2 PRO 102 HB2 PRO 102 7.495 11.658 0.044
854 HB3 PRO 102 HB3 PRO 102 7.142 11.770 -1.681
855 HG2 PRO 102 HG2 PRO 102 5.858 10.050 -0.011
856 HG3 PRO 102 HG3 PRO 102 6.108 9.728 -1.737
857 HD2 PRO 102 HD2 PRO 102 7.616 8.681 0.629
858 HD3 PRO 102 HD3 PRO 102 7.115 7.837 -0.852
859 H GLY 103 H GLY 103 9.745 9.524 0.920
860 HA2 GLY 103 HA2 GLY 103 11.238 10.090 2.573
861 HA3 GLY 103 HA3 GLY 103 11.962 11.218 1.437
862 H ASP 104 H ASP 104 8.644 11.724 1.853
863 HA ASP 104 HA ASP 104 9.130 14.270 3.060
864 HB2 ASP 104 HB2 ASP 104 7.380 14.066 1.384
865 HB3 ASP 104 HB3 ASP 104 6.525 12.892 2.380
866 H ALA 105 H ALA 105 9.925 13.974 5.062
867 HA ALA 105 HA ALA 105 8.008 12.968 7.054
868 HB1 ALA 105 HB1 ALA 105 9.927 11.453 6.884
869 HB2 ALA 105 HB2 ALA 105 9.903 12.278 8.444
870 HB3 ALA 105 HB3 ALA 105 11.022 12.802 7.186
871 H GLY 106 H GLY 106 8.362 14.001 9.227
872 HA2 GLY 106 HA2 GLY 106 9.105 16.836 8.838
873 HA3 GLY 106 HA3 GLY 106 7.839 16.287 9.927
874 H GLY 107 H GLY 107 9.766 13.975 10.593
875 HA2 GLY 107 HA2 GLY 107 11.884 13.925 11.813
876 HA3 GLY 107 HA3 GLY 107 11.497 15.534 12.409
877 H LYS 108 H LYS 108 8.695 13.832 12.335
878 HA LYS 108 HA LYS 108 8.612 13.523 15.169
879 HB2 LYS 108 HB2 LYS 108 6.680 12.955 12.946
880 HB3 LYS 108 HB3 LYS 108 6.350 12.421 14.591
881 HG2 LYS 108 HG2 LYS 108 6.835 15.250 13.699
882 HG3 LYS 108 HG3 LYS 108 5.285 14.541 14.173
883 HD2 LYS 108 HD2 LYS 108 6.137 14.134 16.415
884 HD3 LYS 108 HD3 LYS 108 7.711 14.787 15.951
885 HE2 LYS 108 HE2 LYS 108 6.744 16.948 15.561
886 HE3 LYS 108 HE3 LYS 108 5.133 16.308 15.856
887 HZ1 LYS 108 HZ1 LYS 108 5.750 15.868 18.142
888 HZ2 LYS 108 HZ2 LYS 108 5.988 17.505 17.773
889 HZ3 LYS 108 HZ3 LYS 108 7.318 16.459 17.862
890 H LEU 109 H LEU 109 8.319 11.685 16.351
891 HA LEU 109 HA LEU 109 9.070 9.181 15.007
892 HB2 LEU 109 HB2 LEU 109 10.170 8.561 17.239
893 HB3 LEU 109 HB3 LEU 109 11.018 9.658 16.170
894 HG LEU 109 HG LEU 109 9.985 11.534 17.622
895 HD11 LEU 109 HD11 LEU 109 9.760 9.229 19.551
896 HD12 LEU 109 HD12 LEU 109 8.405 10.105 18.837
897 HD13 LEU 109 HD13 LEU 109 9.519 10.937 19.921
898 HD21 LEU 109 HD21 LEU 109 12.125 9.697 18.686
899 HD22 LEU 109 HD22 LEU 109 11.845 11.355 19.221
900 HD23 LEU 109 HD23 LEU 109 12.350 11.038 17.561
901 H GLU 110 H GLU 110 8.111 7.298 15.747
902 HA GLU 110 HA GLU 110 5.844 7.650 17.583
903 HB2 GLU 110 HB2 GLU 110 5.527 7.522 14.872
904 HB3 GLU 110 HB3 GLU 110 5.421 5.821 15.298
905 HG2 GLU 110 HG2 GLU 110 3.686 8.063 16.305
906 HG3 GLU 110 HG3 GLU 110 3.220 6.742 15.234
907 H HIS 111 H HIS 111 5.456 5.943 18.906
908 HA HIS 111 HA HIS 111 6.499 3.322 18.401
909 HB2 HIS 111 HB2 HIS 111 7.784 3.298 20.622
910 HB3 HIS 111 HB3 HIS 111 8.550 4.098 19.258
911 HD1 HIS 111 HD1 HIS 111 9.368 6.406 19.657
912 HD2 HIS 111 HD2 HIS 111 6.576 5.226 22.509
913 HE1 HIS 111 HE1 HIS 111 9.319 8.251 21.369
914 HE2 HIS 111 HE2 HIS 111 7.643 7.506 23.100
915 H HIS 112 H HIS 112 3.951 4.145 18.628
916 HA HIS 112 HA HIS 112 2.760 4.144 21.142
917 HB2 HIS 112 HB2 HIS 112 1.902 3.894 18.402
918 HB3 HIS 112 HB3 HIS 112 0.986 2.796 19.427
919 HD1 HIS 112 HD1 HIS 112 1.748 6.467 18.995
920 HD2 HIS 112 HD2 HIS 112 -0.911 3.981 21.019
921 HE1 HIS 112 HE1 HIS 112 -0.011 7.992 19.968
922 HE2 HIS 112 HE2 HIS 112 -1.519 6.481 21.322
923 H HIS 113 H HIS 113 2.917 2.706 22.670
924 HA HIS 113 HA HIS 113 2.175 -0.029 22.161
925 HB2 HIS 113 HB2 HIS 113 4.164 -0.929 23.432
926 HB3 HIS 113 HB3 HIS 113 4.520 -0.322 21.823
927 HD1 HIS 113 HD1 HIS 113 6.880 0.449 22.039
928 HD2 HIS 113 HD2 HIS 113 4.490 1.829 25.155
929 HE1 HIS 113 HE1 HIS 113 8.327 2.022 23.362
930 HE2 HIS 113 HE2 HIS 113 6.913 2.715 25.333
931 H HIS 114 H HIS 114 1.683 -1.185 24.119
932 HA HIS 114 HA HIS 114 0.647 -1.375 26.126
933 HB2 HIS 114 HB2 HIS 114 2.885 -0.919 26.984
934 HB3 HIS 114 HB3 HIS 114 2.612 0.812 26.862
935 HD1 HIS 114 HD1 HIS 114 1.422 -2.192 28.835
936 HD2 HIS 114 HD2 HIS 114 1.552 1.956 29.093
937 HE1 HIS 114 HE1 HIS 114 0.662 -1.635 31.168
938 HE2 HIS 114 HE2 HIS 114 0.998 0.859 31.369
939 H HIS 115 H HIS 115 -1.240 -0.478 24.892
940 HA HIS 115 HA HIS 115 -2.594 1.342 26.599
941 HB2 HIS 115 HB2 HIS 115 -1.168 2.873 25.095
942 HB3 HIS 115 HB3 HIS 115 -2.249 2.390 23.791
943 HD1 HIS 115 HD1 HIS 115 -2.059 4.510 26.844
944 HD2 HIS 115 HD2 HIS 115 -4.890 3.407 23.994
945 HE1 HIS 115 HE1 HIS 115 -3.994 6.091 27.154
946 HE2 HIS 115 HE2 HIS 115 -5.754 5.308 25.533
947 H HIS 116 H HIS 116 -4.520 0.417 26.696
948 HA HIS 116 HA HIS 116 -6.030 -0.099 24.293
949 HB2 HIS 116 HB2 HIS 116 -6.435 -2.465 24.670
950 HB3 HIS 116 HB3 HIS 116 -4.709 -2.190 24.497
951 HD1 HIS 116 HD1 HIS 116 -7.282 -3.405 26.875
952 HD2 HIS 116 HD2 HIS 116 -3.202 -2.579 26.881
953 HE1 HIS 116 HE1 HIS 116 -6.376 -4.472 28.961
954 HE2 HIS 116 HE2 HIS 116 -3.884 -4.117 28.854
Start of MODEL 8
1 H1 MET 1 H1 MET 1 -1.870 -18.285 13.909
2 H2 MET 1 H2 MET 1 -3.361 -17.597 14.332
3 H3 MET 1 H3 MET 1 -2.160 -16.643 13.615
4 HA MET 1 HA MET 1 -3.608 -18.897 12.349
5 HB2 MET 1 HB2 MET 1 -4.619 -17.226 10.911
6 HB3 MET 1 HB3 MET 1 -4.943 -16.827 12.593
7 HG2 MET 1 HG2 MET 1 -3.246 -15.123 12.563
8 HG3 MET 1 HG3 MET 1 -2.775 -15.573 10.925
9 HE1 MET 1 HE1 MET 1 -5.605 -14.061 13.181
10 HE2 MET 1 HE2 MET 1 -6.451 -15.369 12.352
11 HE3 MET 1 HE3 MET 1 -6.856 -13.690 11.995
12 H ALA 2 H ALA 2 -0.801 -16.906 12.403
13 HA ALA 2 HA ALA 2 0.254 -18.315 10.103
14 HB1 ALA 2 HB1 ALA 2 0.102 -15.300 10.095
15 HB2 ALA 2 HB2 ALA 2 -0.865 -16.376 9.087
16 HB3 ALA 2 HB3 ALA 2 0.885 -16.309 8.880
17 H GLU 3 H GLU 3 1.599 -19.187 11.718
18 HA GLU 3 HA GLU 3 3.500 -19.394 12.916
19 HB2 GLU 3 HB2 GLU 3 4.121 -17.154 11.076
20 HB3 GLU 3 HB3 GLU 3 5.202 -17.381 12.445
21 HG2 GLU 3 HG2 GLU 3 4.513 -19.438 10.360
22 HG3 GLU 3 HG3 GLU 3 6.035 -18.555 10.507
23 H LYS 4 H LYS 4 5.156 -17.792 14.254
24 HA LYS 4 HA LYS 4 3.547 -16.797 16.399
25 HB2 LYS 4 HB2 LYS 4 5.726 -16.222 17.440
26 HB3 LYS 4 HB3 LYS 4 5.641 -17.896 16.908
27 HG2 LYS 4 HG2 LYS 4 6.949 -17.339 14.927
28 HG3 LYS 4 HG3 LYS 4 7.019 -15.653 15.443
29 HD2 LYS 4 HD2 LYS 4 8.174 -16.368 17.507
30 HD3 LYS 4 HD3 LYS 4 8.166 -18.029 16.909
31 HE2 LYS 4 HE2 LYS 4 9.522 -17.383 15.010
32 HE3 LYS 4 HE3 LYS 4 9.464 -15.694 15.513
33 HZ1 LYS 4 HZ1 LYS 4 10.612 -16.351 17.573
34 HZ2 LYS 4 HZ2 LYS 4 11.538 -16.650 16.185
35 HZ3 LYS 4 HZ3 LYS 4 10.759 -17.935 16.976
36 H ASN 5 H ASN 5 5.250 -15.451 13.685
37 HA ASN 5 HA ASN 5 3.718 -13.082 13.750
38 HB2 ASN 5 HB2 ASN 5 5.386 -12.519 15.539
39 HB3 ASN 5 HB3 ASN 5 6.663 -12.668 14.338
40 HD21 ASN 5 HD21 ASN 5 3.899 -10.808 15.376
41 HD22 ASN 5 HD22 ASN 5 4.265 -9.389 14.452
42 H ALA 6 H ALA 6 3.404 -14.173 11.699
43 HA ALA 6 HA ALA 6 5.007 -12.920 9.664
44 HB1 ALA 6 HB1 ALA 6 4.890 -15.938 9.758
45 HB2 ALA 6 HB2 ALA 6 6.325 -14.956 10.051
46 HB3 ALA 6 HB3 ALA 6 5.576 -14.968 8.455
47 H TYR 7 H TYR 7 2.819 -11.989 9.651
48 HA TYR 7 HA TYR 7 0.727 -13.755 8.629
49 HB2 TYR 7 HB2 TYR 7 -0.742 -11.703 9.113
50 HB3 TYR 7 HB3 TYR 7 -0.087 -12.589 10.484
51 HD1 TYR 7 HD2 TYR 7 0.153 -9.475 8.526
52 HD2 TYR 7 HD1 TYR 7 1.509 -11.581 11.965
53 HE1 TYR 7 HE2 TYR 7 1.128 -7.399 9.412
54 HE2 TYR 7 HE1 TYR 7 2.483 -9.509 12.858
55 HH TYR 7 HH TYR 7 1.763 -6.460 11.618
56 H THR 8 H THR 8 -0.843 -12.692 7.109
57 HA THR 8 HA THR 8 0.496 -12.048 4.689
58 HB THR 8 HB THR 8 -2.455 -11.731 5.233
59 HG1 THR 8 HG1 THR 8 -2.296 -14.104 4.437
60 HG21 THR 8 HG21 THR 8 -1.745 -11.039 3.025
61 HG22 THR 8 HG22 THR 8 -2.631 -12.558 2.902
62 HG23 THR 8 HG23 THR 8 -0.870 -12.554 2.799
63 H VAL 9 H VAL 9 0.210 -10.104 3.403
64 HA VAL 9 HA VAL 9 0.570 -7.690 4.789
65 HB VAL 9 HB VAL 9 1.320 -8.090 2.447
66 HG11 VAL 9 HG11 VAL 9 -0.650 -9.190 1.564
67 HG12 VAL 9 HG12 VAL 9 -0.261 -7.765 0.603
68 HG13 VAL 9 HG13 VAL 9 -1.592 -7.710 1.761
69 HG21 VAL 9 HG21 VAL 9 1.261 -5.825 3.324
70 HG22 VAL 9 HG22 VAL 9 -0.422 -5.656 2.823
71 HG23 VAL 9 HG23 VAL 9 0.845 -5.837 1.610
72 H ALA 10 H ALA 10 -2.295 -9.310 3.656
73 HA ALA 10 HA ALA 10 -4.151 -7.224 3.823
74 HB1 ALA 10 HB1 ALA 10 -5.837 -8.968 4.047
75 HB2 ALA 10 HB2 ALA 10 -4.580 -10.153 4.412
76 HB3 ALA 10 HB3 ALA 10 -4.647 -9.398 2.819
77 H GLN 11 H GLN 11 -2.910 -9.429 6.290
78 HA GLN 11 HA GLN 11 -4.584 -8.393 8.367
79 HB2 GLN 11 HB2 GLN 11 -2.306 -10.327 8.250
80 HB3 GLN 11 HB3 GLN 11 -2.771 -9.661 9.809
81 HG2 GLN 11 HG2 GLN 11 -3.834 -11.809 9.411
82 HG3 GLN 11 HG3 GLN 11 -5.030 -10.520 9.518
83 HE21 GLN 11 HE21 GLN 11 -3.486 -12.838 7.450
84 HE22 GLN 11 HE22 GLN 11 -4.581 -12.675 6.110
85 H LEU 12 H LEU 12 -1.424 -7.667 7.097
86 HA LEU 12 HA LEU 12 -0.518 -6.012 9.209
87 HB2 LEU 12 HB2 LEU 12 0.995 -6.850 7.484
88 HB3 LEU 12 HB3 LEU 12 0.129 -5.946 6.257
89 HG LEU 12 HG LEU 12 0.819 -3.837 7.399
90 HD11 LEU 12 HD11 LEU 12 2.626 -3.930 9.040
91 HD12 LEU 12 HD12 LEU 12 2.546 -5.692 9.036
92 HD13 LEU 12 HD13 LEU 12 1.182 -4.747 9.634
93 HD21 LEU 12 HD21 LEU 12 3.065 -5.658 6.540
94 HD22 LEU 12 HD22 LEU 12 3.118 -3.895 6.592
95 HD23 LEU 12 HD23 LEU 12 2.034 -4.712 5.465
96 H ALA 13 H ALA 13 -2.127 -5.280 6.130
97 HA ALA 13 HA ALA 13 -2.481 -2.523 6.615
98 HB1 ALA 13 HB1 ALA 13 -4.064 -2.583 4.766
99 HB2 ALA 13 HB2 ALA 13 -4.095 -4.346 4.834
100 HB3 ALA 13 HB3 ALA 13 -2.612 -3.505 4.380
101 H ASP 14 H ASP 14 -4.297 -5.345 7.541
102 HA ASP 14 HA ASP 14 -6.699 -4.108 8.316
103 HB2 ASP 14 HB2 ASP 14 -6.522 -6.529 8.115
104 HB3 ASP 14 HB3 ASP 14 -5.361 -6.577 9.439
105 H GLU 15 H GLU 15 -3.761 -4.846 10.195
106 HA GLU 15 HA GLU 15 -4.755 -3.561 12.547
107 HB2 GLU 15 HB2 GLU 15 -2.970 -5.329 12.581
108 HB3 GLU 15 HB3 GLU 15 -1.866 -4.149 11.883
109 HG2 GLU 15 HG2 GLU 15 -2.507 -2.676 13.888
110 HG3 GLU 15 HG3 GLU 15 -3.131 -4.163 14.595
111 H TYR 16 H TYR 16 -2.699 -2.619 9.848
112 HA TYR 16 HA TYR 16 -1.857 -0.123 10.786
113 HB2 TYR 16 HB2 TYR 16 -0.966 -1.225 8.751
114 HB3 TYR 16 HB3 TYR 16 -2.488 -0.902 7.927
115 HD1 TYR 16 HD1 TYR 16 0.357 0.805 9.618
116 HD2 TYR 16 HD2 TYR 16 -2.777 1.100 6.758
117 HE1 TYR 16 HE1 TYR 16 1.223 2.994 8.904
118 HE2 TYR 16 HE2 TYR 16 -1.918 3.286 6.037
119 HH TYR 16 HH TYR 16 -0.566 5.086 6.854
120 H PHE 17 H PHE 17 -4.838 -1.138 9.235
121 HA PHE 17 HA PHE 17 -6.100 1.341 8.947
122 HB2 PHE 17 HB2 PHE 17 -6.951 -0.845 8.084
123 HB3 PHE 17 HB3 PHE 17 -7.369 -1.297 9.731
124 HD1 PHE 17 HD1 PHE 17 -9.190 -0.094 10.912
125 HD2 PHE 17 HD2 PHE 17 -8.322 0.587 6.805
126 HE1 PHE 17 HE1 PHE 17 -11.400 0.946 10.622
127 HE2 PHE 17 HE2 PHE 17 -10.530 1.629 6.507
128 HZ PHE 17 HZ PHE 17 -12.071 1.813 8.417
129 H GLU 18 H GLU 18 -6.165 -0.940 11.679
130 HA GLU 18 HA GLU 18 -7.633 0.730 13.415
131 HB2 GLU 18 HB2 GLU 18 -6.212 -1.811 13.585
132 HB3 GLU 18 HB3 GLU 18 -6.111 -0.877 15.070
133 HG2 GLU 18 HG2 GLU 18 -7.990 -2.402 15.130
134 HG3 GLU 18 HG3 GLU 18 -8.535 -0.727 15.161
135 H ARG 19 H ARG 19 -4.304 0.733 12.508
136 HA ARG 19 HA ARG 19 -3.341 2.139 14.813
137 HB2 ARG 19 HB2 ARG 19 -2.137 1.781 12.062
138 HB3 ARG 19 HB3 ARG 19 -1.311 2.545 13.411
139 HG2 ARG 19 HG2 ARG 19 -2.256 -0.311 13.295
140 HG3 ARG 19 HG3 ARG 19 -0.592 0.248 13.112
141 HD2 ARG 19 HD2 ARG 19 -0.682 1.173 15.396
142 HD3 ARG 19 HD3 ARG 19 -2.317 0.539 15.569
143 HE ARG 19 HE ARG 19 -0.375 -1.463 14.849
144 HH11 ARG 19 HH11 ARG 19 -1.853 0.279 17.506
145 HH12 ARG 19 HH12 ARG 19 -1.533 -0.968 18.670
146 HH21 ARG 19 HH21 ARG 19 0.092 -3.075 16.372
147 HH22 ARG 19 HH22 ARG 19 -0.371 -2.862 18.039
148 H MET 20 H MET 20 -3.950 3.132 11.435
149 HA MET 20 HA MET 20 -3.369 5.884 12.175
150 HB2 MET 20 HB2 MET 20 -3.883 4.553 9.523
151 HB3 MET 20 HB3 MET 20 -3.657 6.288 9.696
152 HG2 MET 20 HG2 MET 20 -1.653 4.187 10.495
153 HG3 MET 20 HG3 MET 20 -1.614 5.125 9.002
154 HE1 MET 20 HE1 MET 20 1.362 6.620 11.079
155 HE2 MET 20 HE2 MET 20 0.886 5.853 9.564
156 HE3 MET 20 HE3 MET 20 0.833 4.938 11.070
157 H ILE 21 H ILE 21 -6.167 3.947 11.411
158 HA ILE 21 HA ILE 21 -7.837 6.229 10.854
159 HB ILE 21 HB ILE 21 -8.385 3.283 11.133
160 HG12 ILE 21 HG12 ILE 21 -9.244 3.612 8.799
161 HG13 ILE 21 HG13 ILE 21 -8.710 5.283 8.885
162 HG21 ILE 21 HG21 ILE 21 -10.474 5.431 10.807
163 HG22 ILE 21 HG22 ILE 21 -10.281 4.355 12.193
164 HG23 ILE 21 HG23 ILE 21 -10.746 3.698 10.624
165 HD11 ILE 21 HD11 ILE 21 -6.935 2.862 9.073
166 HD12 ILE 21 HD12 ILE 21 -6.406 4.544 9.122
167 HD13 ILE 21 HD13 ILE 21 -7.141 3.893 7.656
168 H ALA 22 H ALA 22 -6.870 4.451 13.657
169 HA ALA 22 HA ALA 22 -8.980 5.445 15.340
170 HB1 ALA 22 HB1 ALA 22 -7.684 4.523 17.189
171 HB2 ALA 22 HB2 ALA 22 -6.332 4.220 16.098
172 HB3 ALA 22 HB3 ALA 22 -7.851 3.349 15.884
173 H GLY 23 H GLY 23 -9.027 7.639 15.214
174 HA2 GLY 23 HA2 GLY 23 -7.743 9.227 16.968
175 HA3 GLY 23 HA3 GLY 23 -6.641 9.227 15.598
176 H ARG 24 H ARG 24 -7.445 9.960 13.550
177 HA ARG 24 HA ARG 24 -9.921 11.529 13.635
178 HB2 ARG 24 HB2 ARG 24 -7.555 12.794 13.942
179 HB3 ARG 24 HB3 ARG 24 -7.610 12.721 12.189
180 HG2 ARG 24 HG2 ARG 24 -8.503 14.819 12.906
181 HG3 ARG 24 HG3 ARG 24 -9.820 13.838 12.257
182 HD2 ARG 24 HD2 ARG 24 -10.683 13.383 14.387
183 HD3 ARG 24 HD3 ARG 24 -9.198 13.888 15.192
184 HE ARG 24 HE ARG 24 -10.165 16.119 13.865
185 HH11 ARG 24 HH11 ARG 24 -11.296 13.957 16.384
186 HH12 ARG 24 HH12 ARG 24 -12.157 15.200 17.245
187 HH21 ARG 24 HH21 ARG 24 -11.319 17.756 14.981
188 HH22 ARG 24 HH22 ARG 24 -12.181 17.356 16.439
189 H TRP 25 H TRP 25 -11.002 10.181 12.256
190 HA TRP 25 HA TRP 25 -9.652 9.448 9.745
191 HB2 TRP 25 HB2 TRP 25 -10.816 7.308 9.824
192 HB3 TRP 25 HB3 TRP 25 -9.890 7.550 11.301
193 HD1 TRP 25 HD1 TRP 25 -13.302 6.742 10.092
194 HE1 TRP 25 HE1 TRP 25 -14.981 6.659 12.044
195 HE3 TRP 25 HE3 TRP 25 -10.393 8.823 13.748
196 HZ2 TRP 25 HZ2 TRP 25 -15.052 7.380 14.763
197 HZ3 TRP 25 HZ3 TRP 25 -11.347 9.088 15.999
198 HH2 TRP 25 HH2 TRP 25 -13.628 8.381 16.491
199 H LYS 26 H LYS 26 -12.834 9.980 11.230
200 HA LYS 26 HA LYS 26 -14.745 10.882 10.491
201 HB2 LYS 26 HB2 LYS 26 -13.116 12.551 9.483
202 HB3 LYS 26 HB3 LYS 26 -13.361 11.710 7.959
203 HG2 LYS 26 HG2 LYS 26 -14.800 13.584 7.969
204 HG3 LYS 26 HG3 LYS 26 -15.810 12.158 8.206
205 HD2 LYS 26 HD2 LYS 26 -14.787 13.790 10.513
206 HD3 LYS 26 HD3 LYS 26 -16.274 14.196 9.675
207 HE2 LYS 26 HE2 LYS 26 -17.097 11.888 10.173
208 HE3 LYS 26 HE3 LYS 26 -15.660 11.657 11.166
209 HZ1 LYS 26 HZ1 LYS 26 -17.383 12.304 12.609
210 HZ2 LYS 26 HZ2 LYS 26 -17.876 13.571 11.599
211 HZ3 LYS 26 HZ3 LYS 26 -16.400 13.676 12.435
212 H HIS 27 H HIS 27 -13.068 8.890 8.093
213 HA HIS 27 HA HIS 27 -15.630 7.776 7.282
214 HB2 HIS 27 HB2 HIS 27 -14.884 7.986 4.826
215 HB3 HIS 27 HB3 HIS 27 -15.550 9.406 5.618
216 HD1 HIS 27 HD1 HIS 27 -12.097 7.969 4.850
217 HD2 HIS 27 HD2 HIS 27 -14.032 11.612 5.317
218 HE1 HIS 27 HE1 HIS 27 -10.390 9.720 4.262
219 HE2 HIS 27 HE2 HIS 27 -11.660 11.896 4.329
220 HA PRO 28 HA PRO 28 -12.465 4.514 7.811
221 HB2 PRO 28 HB2 PRO 28 -14.773 2.913 8.638
222 HB3 PRO 28 HB3 PRO 28 -13.317 3.326 9.546
223 HG2 PRO 28 HG2 PRO 28 -15.726 4.363 10.157
224 HG3 PRO 28 HG3 PRO 28 -14.223 5.267 10.377
225 HD2 PRO 28 HD2 PRO 28 -16.242 5.446 8.171
226 HD3 PRO 28 HD3 PRO 28 -15.402 6.753 9.038
227 H ASN 29 H ASN 29 -15.617 4.378 6.274
228 HA ASN 29 HA ASN 29 -15.232 1.938 4.904
229 HB2 ASN 29 HB2 ASN 29 -17.081 2.898 3.372
230 HB3 ASN 29 HB3 ASN 29 -17.471 2.578 5.056
231 HD21 ASN 29 HD21 ASN 29 -19.217 4.029 4.883
232 HD22 ASN 29 HD22 ASN 29 -18.968 5.738 4.927
233 H ILE 30 H ILE 30 -14.795 5.309 3.896
234 HA ILE 30 HA ILE 30 -14.049 4.822 1.250
235 HB ILE 30 HB ILE 30 -13.144 7.085 3.040
236 HG12 ILE 30 HG12 ILE 30 -15.584 6.931 2.916
237 HG13 ILE 30 HG13 ILE 30 -15.008 8.343 2.039
238 HG21 ILE 30 HG21 ILE 30 -11.755 6.911 1.059
239 HG22 ILE 30 HG22 ILE 30 -12.797 8.333 0.963
240 HG23 ILE 30 HG23 ILE 30 -13.189 6.885 0.033
241 HD11 ILE 30 HD11 ILE 30 -15.849 5.726 0.809
242 HD12 ILE 30 HD12 ILE 30 -15.279 7.147 -0.069
243 HD13 ILE 30 HD13 ILE 30 -16.792 7.217 0.836
244 H VAL 31 H VAL 31 -12.001 5.159 4.149
245 HA VAL 31 HA VAL 31 -9.576 4.915 2.701
246 HB VAL 31 HB VAL 31 -9.641 6.013 4.891
247 HG11 VAL 31 HG11 VAL 31 -10.116 3.263 6.014
248 HG12 VAL 31 HG12 VAL 31 -11.260 4.605 6.015
249 HG13 VAL 31 HG13 VAL 31 -9.771 4.717 6.953
250 HG21 VAL 31 HG21 VAL 31 -7.520 5.157 4.078
251 HG22 VAL 31 HG22 VAL 31 -7.845 3.592 4.825
252 HG23 VAL 31 HG23 VAL 31 -7.610 5.020 5.834
253 H ARG 32 H ARG 32 -11.661 2.568 4.333
254 HA ARG 32 HA ARG 32 -9.889 0.374 4.171
255 HB2 ARG 32 HB2 ARG 32 -11.891 0.367 5.595
256 HB3 ARG 32 HB3 ARG 32 -12.911 0.372 4.166
257 HG2 ARG 32 HG2 ARG 32 -12.764 -1.850 5.144
258 HG3 ARG 32 HG3 ARG 32 -12.057 -1.820 3.527
259 HD2 ARG 32 HD2 ARG 32 -9.830 -1.757 4.450
260 HD3 ARG 32 HD3 ARG 32 -10.472 -1.606 6.083
261 HE ARG 32 HE ARG 32 -11.356 -3.973 4.707
262 HH11 ARG 32 HH11 ARG 32 -8.798 -2.595 6.667
263 HH12 ARG 32 HH12 ARG 32 -8.307 -4.120 7.323
264 HH21 ARG 32 HH21 ARG 32 -10.730 -5.968 5.572
265 HH22 ARG 32 HH22 ARG 32 -9.405 -6.058 6.695
266 H SER 33 H SER 33 -12.448 1.516 1.991
267 HA SER 33 HA SER 33 -12.175 -0.492 0.054
268 HB2 SER 33 HB2 SER 33 -13.055 2.387 -0.260
269 HB3 SER 33 HB3 SER 33 -13.294 1.121 -1.465
270 HG SER 33 HG SER 33 -14.425 -0.034 0.296
271 H ARG 34 H ARG 34 -10.584 2.665 0.381
272 HA ARG 34 HA ARG 34 -9.164 2.542 -2.047
273 HB2 ARG 34 HB2 ARG 34 -8.808 4.106 0.481
274 HB3 ARG 34 HB3 ARG 34 -7.596 4.190 -0.794
275 HG2 ARG 34 HG2 ARG 34 -10.518 4.879 -1.046
276 HG3 ARG 34 HG3 ARG 34 -9.156 6.007 -1.044
277 HD2 ARG 34 HD2 ARG 34 -8.296 4.984 -3.080
278 HD3 ARG 34 HD3 ARG 34 -9.621 3.828 -3.075
279 HE ARG 34 HE ARG 34 -10.940 6.157 -3.141
280 HH11 ARG 34 HH11 ARG 34 -8.220 4.944 -5.007
281 HH12 ARG 34 HH12 ARG 34 -8.638 5.861 -6.426
282 HH21 ARG 34 HH21 ARG 34 -11.492 7.341 -5.014
283 HH22 ARG 34 HH22 ARG 34 -10.517 7.198 -6.447
284 H ILE 35 H ILE 35 -8.288 1.509 1.225
285 HA ILE 35 HA ILE 35 -5.666 0.707 0.670
286 HB ILE 35 HB ILE 35 -7.645 -0.407 2.665
287 HG12 ILE 35 HG12 ILE 35 -5.259 1.427 3.001
288 HG13 ILE 35 HG13 ILE 35 -6.941 1.947 2.976
289 HG21 ILE 35 HG21 ILE 35 -5.962 -2.105 2.114
290 HG22 ILE 35 HG22 ILE 35 -5.768 -1.504 3.762
291 HG23 ILE 35 HG23 ILE 35 -4.683 -0.951 2.485
292 HD11 ILE 35 HD11 ILE 35 -5.680 0.129 5.018
293 HD12 ILE 35 HD12 ILE 35 -7.369 0.637 4.992
294 HD13 ILE 35 HD13 ILE 35 -6.093 1.829 5.243
295 H GLU 36 H GLU 36 -8.722 -1.101 0.381
296 HA GLU 36 HA GLU 36 -7.315 -3.486 -0.424
297 HB2 GLU 36 HB2 GLU 36 -10.271 -2.906 -0.319
298 HB3 GLU 36 HB3 GLU 36 -9.556 -4.483 -0.635
299 HG2 GLU 36 HG2 GLU 36 -8.353 -4.095 1.632
300 HG3 GLU 36 HG3 GLU 36 -9.628 -2.907 1.896
301 H LYS 37 H LYS 37 -8.185 -0.748 -2.079
302 HA LYS 37 HA LYS 37 -8.504 -2.249 -4.584
303 HB2 LYS 37 HB2 LYS 37 -10.394 -0.825 -4.193
304 HB3 LYS 37 HB3 LYS 37 -9.358 0.552 -3.852
305 HG2 LYS 37 HG2 LYS 37 -9.074 -0.691 -6.514
306 HG3 LYS 37 HG3 LYS 37 -10.572 0.183 -6.194
307 HD2 LYS 37 HD2 LYS 37 -9.468 2.200 -5.850
308 HD3 LYS 37 HD3 LYS 37 -7.925 1.410 -5.529
309 HE2 LYS 37 HE2 LYS 37 -7.726 0.789 -7.859
310 HE3 LYS 37 HE3 LYS 37 -9.309 1.485 -8.198
311 HZ1 LYS 37 HZ1 LYS 37 -8.506 3.644 -7.771
312 HZ2 LYS 37 HZ2 LYS 37 -7.344 2.913 -8.762
313 HZ3 LYS 37 HZ3 LYS 37 -7.054 3.071 -7.101
314 H ASP 38 H ASP 38 -6.877 0.645 -3.257
315 HA ASP 38 HA ASP 38 -5.137 0.754 -5.585
316 HB2 ASP 38 HB2 ASP 38 -5.462 2.550 -3.183
317 HB3 ASP 38 HB3 ASP 38 -4.167 2.774 -4.352
318 H ILE 39 H ILE 39 -4.895 0.055 -2.126
319 HA ILE 39 HA ILE 39 -2.022 -0.123 -2.229
320 HB ILE 39 HB ILE 39 -4.011 -0.650 -0.030
321 HG12 ILE 39 HG12 ILE 39 -2.626 1.169 1.078
322 HG13 ILE 39 HG13 ILE 39 -1.823 1.389 -0.470
323 HG21 ILE 39 HG21 ILE 39 -1.033 -1.100 0.096
324 HG22 ILE 39 HG22 ILE 39 -2.288 -2.329 0.240
325 HG23 ILE 39 HG23 ILE 39 -2.123 -1.090 1.483
326 HD11 ILE 39 HD11 ILE 39 -3.543 3.046 -0.166
327 HD12 ILE 39 HD12 ILE 39 -4.751 1.788 0.096
328 HD13 ILE 39 HD13 ILE 39 -3.985 1.960 -1.484
329 H LYS 40 H LYS 40 -4.677 -2.473 -1.824
330 HA LYS 40 HA LYS 40 -2.759 -4.572 -2.606
331 HB2 LYS 40 HB2 LYS 40 -4.442 -6.141 -1.423
332 HB3 LYS 40 HB3 LYS 40 -3.351 -5.180 -0.436
333 HG2 LYS 40 HG2 LYS 40 -5.044 -3.684 0.180
334 HG3 LYS 40 HG3 LYS 40 -6.121 -4.250 -1.093
335 HD2 LYS 40 HD2 LYS 40 -5.235 -5.968 1.220
336 HD3 LYS 40 HD3 LYS 40 -6.711 -5.003 1.229
337 HE2 LYS 40 HE2 LYS 40 -7.272 -6.223 -0.963
338 HE3 LYS 40 HE3 LYS 40 -6.017 -7.365 -0.484
339 HZ1 LYS 40 HZ1 LYS 40 -8.153 -8.150 0.242
340 HZ2 LYS 40 HZ2 LYS 40 -8.480 -6.696 1.049
341 HZ3 LYS 40 HZ3 LYS 40 -7.248 -7.716 1.609
342 HA PRO 41 HA PRO 41 -6.078 -4.517 -5.848
343 HB2 PRO 41 HB2 PRO 41 -4.026 -4.201 -7.844
344 HB3 PRO 41 HB3 PRO 41 -5.325 -3.084 -7.424
345 HG2 PRO 41 HG2 PRO 41 -2.664 -2.593 -6.966
346 HG3 PRO 41 HG3 PRO 41 -3.987 -1.853 -6.049
347 HD2 PRO 41 HD2 PRO 41 -2.236 -4.169 -5.320
348 HD3 PRO 41 HD3 PRO 41 -2.844 -2.847 -4.299
349 H ALA 42 H ALA 42 -2.776 -5.773 -6.380
350 HA ALA 42 HA ALA 42 -3.974 -8.379 -7.057
351 HB1 ALA 42 HB1 ALA 42 -2.187 -8.742 -8.677
352 HB2 ALA 42 HB2 ALA 42 -1.509 -7.158 -8.303
353 HB3 ALA 42 HB3 ALA 42 -3.092 -7.280 -9.070
354 H ILE 43 H ILE 43 -2.743 -7.063 -4.610
355 HA ILE 43 HA ILE 43 -1.017 -9.307 -3.880
356 HB ILE 43 HB ILE 43 0.436 -7.596 -2.611
357 HG12 ILE 43 HG12 ILE 43 -0.594 -5.791 -4.805
358 HG13 ILE 43 HG13 ILE 43 -1.111 -5.680 -3.128
359 HG21 ILE 43 HG21 ILE 43 1.924 -7.332 -4.538
360 HG22 ILE 43 HG22 ILE 43 0.609 -7.809 -5.613
361 HG23 ILE 43 HG23 ILE 43 1.256 -8.960 -4.444
362 HD11 ILE 43 HD11 ILE 43 0.576 -4.019 -3.632
363 HD12 ILE 43 HD12 ILE 43 1.690 -5.280 -4.160
364 HD13 ILE 43 HD13 ILE 43 1.199 -5.190 -2.468
365 H GLY 44 H GLY 44 -3.130 -9.812 -2.879
366 HA2 GLY 44 HA2 GLY 44 -3.549 -8.287 -0.379
367 HA3 GLY 44 HA3 GLY 44 -4.812 -9.172 -1.221
368 H SER 45 H SER 45 -3.402 -11.525 -1.779
369 HA SER 45 HA SER 45 -3.334 -12.714 0.890
370 HB2 SER 45 HB2 SER 45 -3.193 -14.139 -1.776
371 HB3 SER 45 HB3 SER 45 -3.656 -14.814 -0.211
372 HG SER 45 HG SER 45 -5.283 -12.808 -0.596
373 H LEU 46 H LEU 46 -1.203 -11.050 -0.453
374 HA LEU 46 HA LEU 46 1.021 -12.901 -0.743
375 HB2 LEU 46 HB2 LEU 46 0.682 -10.943 -2.264
376 HB3 LEU 46 HB3 LEU 46 0.969 -9.882 -0.900
377 HG LEU 46 HG LEU 46 3.244 -11.015 -0.701
378 HD11 LEU 46 HD11 LEU 46 2.776 -12.959 -2.076
379 HD12 LEU 46 HD12 LEU 46 4.104 -12.024 -2.761
380 HD13 LEU 46 HD13 LEU 46 2.494 -11.922 -3.473
381 HD21 LEU 46 HD21 LEU 46 2.958 -8.750 -1.532
382 HD22 LEU 46 HD22 LEU 46 2.622 -9.373 -3.147
383 HD23 LEU 46 HD23 LEU 46 4.220 -9.591 -2.431
384 H LYS 47 H LYS 47 2.503 -13.278 0.845
385 HA LYS 47 HA LYS 47 2.148 -12.183 3.440
386 HB2 LYS 47 HB2 LYS 47 4.365 -13.833 2.231
387 HB3 LYS 47 HB3 LYS 47 4.355 -13.325 3.915
388 HG2 LYS 47 HG2 LYS 47 2.200 -14.969 2.609
389 HG3 LYS 47 HG3 LYS 47 3.521 -15.619 3.589
390 HD2 LYS 47 HD2 LYS 47 2.714 -14.650 5.541
391 HD3 LYS 47 HD3 LYS 47 1.740 -13.467 4.666
392 HE2 LYS 47 HE2 LYS 47 0.303 -15.124 5.653
393 HE3 LYS 47 HE3 LYS 47 0.271 -15.274 3.903
394 HZ1 LYS 47 HZ1 LYS 47 1.881 -17.114 4.111
395 HZ2 LYS 47 HZ2 LYS 47 0.404 -17.439 4.876
396 HZ3 LYS 47 HZ3 LYS 47 1.759 -17.010 5.802
397 H VAL 48 H VAL 48 3.626 -10.886 4.613
398 HA VAL 48 HA VAL 48 4.247 -8.518 3.231
399 HB VAL 48 HB VAL 48 5.306 -9.311 5.946
400 HG11 VAL 48 HG11 VAL 48 6.324 -7.299 4.991
401 HG12 VAL 48 HG12 VAL 48 5.321 -6.917 6.390
402 HG13 VAL 48 HG13 VAL 48 4.721 -6.601 4.762
403 HG21 VAL 48 HG21 VAL 48 3.304 -8.240 6.870
404 HG22 VAL 48 HG22 VAL 48 2.902 -9.653 5.894
405 HG23 VAL 48 HG23 VAL 48 2.669 -8.032 5.238
406 H GLU 49 H GLU 49 6.162 -11.346 3.876
407 HA GLU 49 HA GLU 49 8.693 -10.013 3.475
408 HB2 GLU 49 HB2 GLU 49 8.327 -12.038 4.965
409 HB3 GLU 49 HB3 GLU 49 8.179 -12.991 3.494
410 HG2 GLU 49 HG2 GLU 49 10.478 -12.043 2.881
411 HG3 GLU 49 HG3 GLU 49 10.579 -11.562 4.574
412 H ASP 50 H ASP 50 6.272 -10.935 1.411
413 HA ASP 50 HA ASP 50 8.112 -11.853 -0.688
414 HB2 ASP 50 HB2 ASP 50 5.120 -12.118 -0.421
415 HB3 ASP 50 HB3 ASP 50 6.002 -12.551 -1.880
416 H VAL 51 H VAL 51 6.977 -8.988 0.279
417 HA VAL 51 HA VAL 51 5.979 -8.049 -2.260
418 HB VAL 51 HB VAL 51 4.974 -7.090 -0.297
419 HG11 VAL 51 HG11 VAL 51 6.792 -7.304 1.286
420 HG12 VAL 51 HG12 VAL 51 6.197 -5.644 1.251
421 HG13 VAL 51 HG13 VAL 51 7.704 -6.058 0.435
422 HG21 VAL 51 HG21 VAL 51 5.241 -4.700 -0.777
423 HG22 VAL 51 HG22 VAL 51 5.096 -5.663 -2.246
424 HG23 VAL 51 HG23 VAL 51 6.674 -5.064 -1.737
425 H LYS 52 H LYS 52 7.462 -8.065 -3.805
426 HA LYS 52 HA LYS 52 10.079 -6.879 -3.405
427 HB2 LYS 52 HB2 LYS 52 8.765 -8.130 -5.813
428 HB3 LYS 52 HB3 LYS 52 10.432 -7.579 -5.762
429 HG2 LYS 52 HG2 LYS 52 10.993 -9.237 -4.126
430 HG3 LYS 52 HG3 LYS 52 9.300 -9.707 -3.961
431 HD2 LYS 52 HD2 LYS 52 10.617 -11.266 -5.363
432 HD3 LYS 52 HD3 LYS 52 9.264 -10.532 -6.223
433 HE2 LYS 52 HE2 LYS 52 10.817 -8.881 -7.197
434 HE3 LYS 52 HE3 LYS 52 12.151 -9.696 -6.385
435 HZ1 LYS 52 HZ1 LYS 52 11.890 -10.359 -8.726
436 HZ2 LYS 52 HZ2 LYS 52 10.350 -10.973 -8.369
437 HZ3 LYS 52 HZ3 LYS 52 11.725 -11.673 -7.664
438 HA PRO 53 HA PRO 53 9.206 -2.809 -4.769
439 HB2 PRO 53 HB2 PRO 53 11.275 -2.422 -6.588
440 HB3 PRO 53 HB3 PRO 53 11.364 -2.169 -4.843
441 HG2 PRO 53 HG2 PRO 53 12.251 -4.503 -6.474
442 HG3 PRO 53 HG3 PRO 53 12.999 -3.786 -5.036
443 HD2 PRO 53 HD2 PRO 53 11.607 -6.074 -4.908
444 HD3 PRO 53 HD3 PRO 53 11.563 -4.884 -3.588
445 H ARG 54 H ARG 54 9.746 -5.191 -7.348
446 HA ARG 54 HA ARG 54 8.855 -3.629 -9.507
447 HB2 ARG 54 HB2 ARG 54 9.955 -5.876 -9.710
448 HB3 ARG 54 HB3 ARG 54 8.436 -6.607 -9.203
449 HG2 ARG 54 HG2 ARG 54 7.364 -5.417 -11.163
450 HG3 ARG 54 HG3 ARG 54 9.000 -5.058 -11.714
451 HD2 ARG 54 HD2 ARG 54 9.478 -7.501 -11.665
452 HD3 ARG 54 HD3 ARG 54 7.780 -7.780 -11.287
453 HE ARG 54 HE ARG 54 8.834 -6.710 -13.817
454 HH11 ARG 54 HH11 ARG 54 6.174 -8.017 -11.951
455 HH12 ARG 54 HH12 ARG 54 5.160 -8.271 -13.337
456 HH21 ARG 54 HH21 ARG 54 7.509 -7.055 -15.641
457 HH22 ARG 54 HH22 ARG 54 5.921 -7.723 -15.432
458 H HIS 55 H HIS 55 7.104 -5.456 -7.092
459 HA HIS 55 HA HIS 55 4.590 -5.588 -8.304
460 HB2 HIS 55 HB2 HIS 55 5.188 -5.280 -5.353
461 HB3 HIS 55 HB3 HIS 55 3.669 -5.836 -6.038
462 HD1 HIS 55 HD1 HIS 55 5.827 -7.560 -8.123
463 HD2 HIS 55 HD2 HIS 55 4.993 -7.882 -4.058
464 HE1 HIS 55 HE1 HIS 55 6.591 -9.861 -7.444
465 HE2 HIS 55 HE2 HIS 55 5.856 -10.119 -5.050
466 H ILE 56 H ILE 56 6.148 -3.031 -6.486
467 HA ILE 56 HA ILE 56 3.899 -1.360 -6.128
468 HB ILE 56 HB ILE 56 6.805 -0.536 -6.336
469 HG12 ILE 56 HG12 ILE 56 6.473 -2.285 -4.640
470 HG13 ILE 56 HG13 ILE 56 6.864 -0.739 -3.895
471 HG21 ILE 56 HG21 ILE 56 5.280 1.351 -6.512
472 HG22 ILE 56 HG22 ILE 56 6.131 1.382 -4.967
473 HG23 ILE 56 HG23 ILE 56 4.456 0.840 -5.038
474 HD11 ILE 56 HD11 ILE 56 4.127 -1.976 -4.093
475 HD12 ILE 56 HD12 ILE 56 4.493 -0.406 -3.379
476 HD13 ILE 56 HD13 ILE 56 5.134 -1.877 -2.649
477 H ASP 57 H ASP 57 6.197 -1.723 -8.775
478 HA ASP 57 HA ASP 57 5.410 0.609 -10.199
479 HB2 ASP 57 HB2 ASP 57 7.536 -0.477 -10.689
480 HB3 ASP 57 HB3 ASP 57 6.702 -1.945 -11.185
481 H ASP 58 H ASP 58 4.452 -2.790 -10.364
482 HA ASP 58 HA ASP 58 2.721 -2.546 -12.572
483 HB2 ASP 58 HB2 ASP 58 2.675 -4.541 -10.293
484 HB3 ASP 58 HB3 ASP 58 1.691 -4.673 -11.744
485 H VAL 59 H VAL 59 2.096 -2.327 -9.076
486 HA VAL 59 HA VAL 59 -0.706 -2.074 -9.399
487 HB VAL 59 HB VAL 59 -0.783 -1.317 -7.062
488 HG11 VAL 59 HG11 VAL 59 0.155 -3.338 -6.047
489 HG12 VAL 59 HG12 VAL 59 1.058 -3.656 -7.528
490 HG13 VAL 59 HG13 VAL 59 -0.705 -3.693 -7.547
491 HG21 VAL 59 HG21 VAL 59 1.236 0.044 -6.988
492 HG22 VAL 59 HG22 VAL 59 2.229 -1.402 -7.173
493 HG23 VAL 59 HG23 VAL 59 1.255 -1.182 -5.719
494 H LEU 60 H LEU 60 1.887 0.332 -9.085
495 HA LEU 60 HA LEU 60 0.203 2.575 -8.860
496 HB2 LEU 60 HB2 LEU 60 3.031 2.291 -9.857
497 HB3 LEU 60 HB3 LEU 60 2.228 3.842 -9.726
498 HG LEU 60 HG LEU 60 2.809 1.955 -7.443
499 HD11 LEU 60 HD11 LEU 60 4.802 3.049 -8.293
500 HD12 LEU 60 HD12 LEU 60 4.352 3.721 -6.727
501 HD13 LEU 60 HD13 LEU 60 4.001 4.617 -8.206
502 HD21 LEU 60 HD21 LEU 60 2.010 3.773 -6.015
503 HD22 LEU 60 HD22 LEU 60 0.734 3.185 -7.081
504 HD23 LEU 60 HD23 LEU 60 1.557 4.701 -7.446
505 H LYS 61 H LYS 61 1.731 1.129 -11.746
506 HA LYS 61 HA LYS 61 0.876 3.126 -13.519
507 HB2 LYS 61 HB2 LYS 61 1.333 1.512 -15.317
508 HB3 LYS 61 HB3 LYS 61 2.633 1.592 -14.147
509 HG2 LYS 61 HG2 LYS 61 1.708 -0.474 -13.106
510 HG3 LYS 61 HG3 LYS 61 0.577 -0.573 -14.459
511 HD2 LYS 61 HD2 LYS 61 2.389 -0.755 -16.033
512 HD3 LYS 61 HD3 LYS 61 3.576 -0.465 -14.761
513 HE2 LYS 61 HE2 LYS 61 2.584 -2.545 -13.642
514 HE3 LYS 61 HE3 LYS 61 1.852 -2.874 -15.210
515 HZ1 LYS 61 HZ1 LYS 61 3.867 -3.281 -16.173
516 HZ2 LYS 61 HZ2 LYS 61 4.172 -3.841 -14.597
517 HZ3 LYS 61 HZ3 LYS 61 4.728 -2.313 -15.082
518 H ALA 62 H ALA 62 -0.770 0.319 -12.254
519 HA ALA 62 HA ALA 62 -2.990 0.558 -14.081
520 HB1 ALA 62 HB1 ALA 62 -4.009 -1.215 -12.764
521 HB2 ALA 62 HB2 ALA 62 -2.752 -1.053 -11.538
522 HB3 ALA 62 HB3 ALA 62 -2.338 -1.622 -13.155
523 H VAL 63 H VAL 63 -2.414 1.328 -10.628
524 HA VAL 63 HA VAL 63 -5.072 2.204 -10.163
525 HB VAL 63 HB VAL 63 -4.254 3.210 -8.088
526 HG11 VAL 63 HG11 VAL 63 -4.750 0.848 -8.088
527 HG12 VAL 63 HG12 VAL 63 -3.362 1.166 -7.047
528 HG13 VAL 63 HG13 VAL 63 -3.121 0.477 -8.653
529 HG21 VAL 63 HG21 VAL 63 -1.506 2.468 -9.067
530 HG22 VAL 63 HG22 VAL 63 -1.900 3.079 -7.460
531 HG23 VAL 63 HG23 VAL 63 -2.137 4.104 -8.876
532 H MET 64 H MET 64 -2.333 3.760 -11.585
533 HA MET 64 HA MET 64 -3.306 6.432 -11.235
534 HB2 MET 64 HB2 MET 64 -1.214 5.244 -13.050
535 HB3 MET 64 HB3 MET 64 -1.622 6.954 -13.064
536 HG2 MET 64 HG2 MET 64 -0.959 7.154 -10.740
537 HG3 MET 64 HG3 MET 64 -0.606 5.427 -10.677
538 HE1 MET 64 HE1 MET 64 0.391 8.884 -12.254
539 HE2 MET 64 HE2 MET 64 0.123 7.879 -13.679
540 HE3 MET 64 HE3 MET 64 1.750 8.431 -13.283
541 H LYS 65 H LYS 65 -3.707 3.929 -13.668
542 HA LYS 65 HA LYS 65 -4.886 5.835 -15.512
543 HB2 LYS 65 HB2 LYS 65 -5.019 3.975 -17.096
544 HB3 LYS 65 HB3 LYS 65 -3.405 4.193 -16.461
545 HG2 LYS 65 HG2 LYS 65 -3.670 2.283 -15.014
546 HG3 LYS 65 HG3 LYS 65 -5.345 2.091 -15.544
547 HD2 LYS 65 HD2 LYS 65 -3.888 0.530 -16.712
548 HD3 LYS 65 HD3 LYS 65 -4.567 1.708 -17.838
549 HE2 LYS 65 HE2 LYS 65 -2.429 3.025 -17.535
550 HE3 LYS 65 HE3 LYS 65 -1.781 1.615 -16.698
551 HZ1 LYS 65 HZ1 LYS 65 -2.663 1.801 -19.523
552 HZ2 LYS 65 HZ2 LYS 65 -2.351 0.326 -18.748
553 HZ3 LYS 65 HZ3 LYS 65 -1.105 1.459 -18.939
554 H ARG 66 H ARG 66 -5.946 2.892 -13.797
555 HA ARG 66 HA ARG 66 -8.688 3.459 -14.590
556 HB2 ARG 66 HB2 ARG 66 -9.284 1.358 -13.507
557 HB3 ARG 66 HB3 ARG 66 -7.936 1.133 -14.605
558 HG2 ARG 66 HG2 ARG 66 -7.280 -0.129 -12.816
559 HG3 ARG 66 HG3 ARG 66 -6.496 1.407 -12.447
560 HD2 ARG 66 HD2 ARG 66 -7.513 0.585 -10.445
561 HD3 ARG 66 HD3 ARG 66 -8.440 1.977 -11.001
562 HE ARG 66 HE ARG 66 -9.343 -0.755 -11.627
563 HH11 ARG 66 HH11 ARG 66 -9.919 2.388 -10.193
564 HH12 ARG 66 HH12 ARG 66 -11.536 2.017 -9.689
565 HH21 ARG 66 HH21 ARG 66 -11.492 -1.248 -11.005
566 HH22 ARG 66 HH22 ARG 66 -12.438 -0.054 -10.173
567 H GLY 67 H GLY 67 -6.734 4.697 -12.353
568 HA2 GLY 67 HA2 GLY 67 -9.020 5.323 -10.596
569 HA3 GLY 67 HA3 GLY 67 -7.401 5.074 -9.951
570 H ALA 68 H ALA 68 -5.916 6.695 -10.049
571 HA ALA 68 HA ALA 68 -6.213 8.956 -11.776
572 HB1 ALA 68 HB1 ALA 68 -7.873 9.569 -10.086
573 HB2 ALA 68 HB2 ALA 68 -6.485 10.656 -10.033
574 HB3 ALA 68 HB3 ALA 68 -6.660 9.388 -8.820
575 HA PRO 69 HA PRO 69 -1.850 8.909 -10.997
576 HB2 PRO 69 HB2 PRO 69 -1.221 11.392 -11.933
577 HB3 PRO 69 HB3 PRO 69 -1.565 10.015 -12.985
578 HG2 PRO 69 HG2 PRO 69 -3.353 12.268 -12.161
579 HG3 PRO 69 HG3 PRO 69 -3.166 11.513 -13.754
580 HD2 PRO 69 HD2 PRO 69 -5.233 10.932 -12.109
581 HD3 PRO 69 HD3 PRO 69 -4.526 9.734 -13.214
582 H SER 70 H SER 70 -3.768 11.688 -9.980
583 HA SER 70 HA SER 70 -1.874 12.908 -8.325
584 HB2 SER 70 HB2 SER 70 -4.871 12.956 -7.953
585 HB3 SER 70 HB3 SER 70 -3.711 14.194 -7.471
586 HG SER 70 HG SER 70 -3.207 14.108 -9.911
587 H ILE 71 H ILE 71 -4.226 10.372 -7.686
588 HA ILE 71 HA ILE 71 -3.955 10.397 -4.859
589 HB ILE 71 HB ILE 71 -4.947 8.166 -6.648
590 HG12 ILE 71 HG12 ILE 71 -6.457 10.361 -5.208
591 HG13 ILE 71 HG13 ILE 71 -6.206 10.259 -6.946
592 HG21 ILE 71 HG21 ILE 71 -6.090 7.339 -4.656
593 HG22 ILE 71 HG22 ILE 71 -5.376 8.634 -3.698
594 HG23 ILE 71 HG23 ILE 71 -4.345 7.390 -4.406
595 HD11 ILE 71 HD11 ILE 71 -7.512 8.196 -7.008
596 HD12 ILE 71 HD12 ILE 71 -8.438 9.546 -6.350
597 HD13 ILE 71 HD13 ILE 71 -7.776 8.319 -5.269
598 H ALA 72 H ALA 72 -2.368 8.636 -7.457
599 HA ALA 72 HA ALA 72 -1.128 6.626 -5.983
600 HB1 ALA 72 HB1 ALA 72 0.424 6.419 -7.840
601 HB2 ALA 72 HB2 ALA 72 -0.070 7.998 -8.450
602 HB3 ALA 72 HB3 ALA 72 -1.221 6.662 -8.430
603 H ASN 73 H ASN 73 -0.049 9.938 -6.619
604 HA ASN 73 HA ASN 73 2.557 9.681 -5.592
605 HB2 ASN 73 HB2 ASN 73 0.768 12.111 -5.770
606 HB3 ASN 73 HB3 ASN 73 2.468 12.174 -5.308
607 HD21 ASN 73 HD21 ASN 73 0.213 11.727 -7.888
608 HD22 ASN 73 HD22 ASN 73 1.360 11.772 -9.170
609 H ASP 74 H ASP 74 -0.488 10.551 -4.033
610 HA ASP 74 HA ASP 74 0.736 10.979 -1.468
611 HB2 ASP 74 HB2 ASP 74 -1.443 12.028 -2.192
612 HB3 ASP 74 HB3 ASP 74 -2.190 10.444 -2.016
613 H THR 75 H THR 75 -0.766 8.304 -3.146
614 HA THR 75 HA THR 75 -1.008 6.501 -1.005
615 HB THR 75 HB THR 75 -0.460 5.860 -3.916
616 HG1 THR 75 HG1 THR 75 -2.353 7.141 -3.598
617 HG21 THR 75 HG21 THR 75 -1.720 4.185 -1.738
618 HG22 THR 75 HG22 THR 75 -0.120 3.930 -2.434
619 HG23 THR 75 HG23 THR 75 -1.560 3.725 -3.432
620 H LEU 76 H LEU 76 1.721 7.369 -3.047
621 HA LEU 76 HA LEU 76 3.541 5.394 -2.315
622 HB2 LEU 76 HB2 LEU 76 4.031 8.316 -2.898
623 HB3 LEU 76 HB3 LEU 76 5.294 7.107 -2.781
624 HG LEU 76 HG LEU 76 3.074 7.111 -4.828
625 HD11 LEU 76 HD11 LEU 76 4.847 7.666 -6.423
626 HD12 LEU 76 HD12 LEU 76 6.002 7.785 -5.094
627 HD13 LEU 76 HD13 LEU 76 4.660 8.922 -5.198
628 HD21 LEU 76 HD21 LEU 76 4.346 5.302 -5.871
629 HD22 LEU 76 HD22 LEU 76 3.822 4.864 -4.246
630 HD23 LEU 76 HD23 LEU 76 5.495 5.337 -4.532
631 H ARG 77 H ARG 77 2.606 8.364 -0.683
632 HA ARG 77 HA ARG 77 4.502 8.213 1.425
633 HB2 ARG 77 HB2 ARG 77 1.768 9.485 1.587
634 HB3 ARG 77 HB3 ARG 77 3.211 9.916 2.494
635 HG2 ARG 77 HG2 ARG 77 4.256 10.779 0.493
636 HG3 ARG 77 HG3 ARG 77 2.876 10.261 -0.479
637 HD2 ARG 77 HD2 ARG 77 1.435 11.734 0.929
638 HD3 ARG 77 HD3 ARG 77 2.899 12.347 1.692
639 HE ARG 77 HE ARG 77 2.773 12.547 -1.205
640 HH11 ARG 77 HH11 ARG 77 2.396 14.123 1.893
641 HH12 ARG 77 HH12 ARG 77 2.391 15.726 1.224
642 HH21 ARG 77 HH21 ARG 77 2.756 14.679 -2.099
643 HH22 ARG 77 HH22 ARG 77 2.601 16.039 -1.023
644 H TRP 78 H TRP 78 1.182 7.125 1.021
645 HA TRP 78 HA TRP 78 0.705 6.112 3.577
646 HB2 TRP 78 HB2 TRP 78 -0.934 6.438 1.656
647 HB3 TRP 78 HB3 TRP 78 -0.340 4.914 1.010
648 HD1 TRP 78 HD1 TRP 78 -1.284 2.702 2.070
649 HE1 TRP 78 HE1 TRP 78 -3.113 2.215 3.817
650 HE3 TRP 78 HE3 TRP 78 -1.952 7.433 3.894
651 HZ2 TRP 78 HZ2 TRP 78 -4.627 3.640 5.716
652 HZ3 TRP 78 HZ3 TRP 78 -3.612 7.783 5.678
653 HH2 TRP 78 HH2 TRP 78 -4.921 5.926 6.568
654 H LEU 79 H LEU 79 2.056 4.519 0.702
655 HA LEU 79 HA LEU 79 2.455 1.982 1.883
656 HB2 LEU 79 HB2 LEU 79 3.945 3.285 -0.404
657 HB3 LEU 79 HB3 LEU 79 3.987 1.578 -0.004
658 HG LEU 79 HG LEU 79 1.542 3.100 -0.914
659 HD11 LEU 79 HD11 LEU 79 1.770 1.796 -2.969
660 HD12 LEU 79 HD12 LEU 79 3.268 1.093 -2.358
661 HD13 LEU 79 HD13 LEU 79 3.179 2.821 -2.697
662 HD21 LEU 79 HD21 LEU 79 0.502 0.885 -1.056
663 HD22 LEU 79 HD22 LEU 79 0.984 1.272 0.595
664 HD23 LEU 79 HD23 LEU 79 1.957 0.162 -0.369
665 H LYS 80 H LYS 80 4.645 4.728 1.402
666 HA LYS 80 HA LYS 80 6.988 3.890 2.445
667 HB2 LYS 80 HB2 LYS 80 5.938 6.231 1.605
668 HB3 LYS 80 HB3 LYS 80 5.986 6.544 3.331
669 HG2 LYS 80 HG2 LYS 80 8.326 5.824 1.582
670 HG3 LYS 80 HG3 LYS 80 7.959 7.412 2.261
671 HD2 LYS 80 HD2 LYS 80 9.234 6.826 3.971
672 HD3 LYS 80 HD3 LYS 80 7.931 5.746 4.452
673 HE2 LYS 80 HE2 LYS 80 9.555 4.198 4.345
674 HE3 LYS 80 HE3 LYS 80 9.143 4.204 2.639
675 HZ1 LYS 80 HZ1 LYS 80 11.577 4.404 3.172
676 HZ2 LYS 80 HZ2 LYS 80 11.248 5.962 3.746
677 HZ3 LYS 80 HZ3 LYS 80 10.952 5.576 2.119
678 H ARG 81 H ARG 81 4.203 5.186 4.245
679 HA ARG 81 HA ARG 81 5.389 4.951 6.817
680 HB2 ARG 81 HB2 ARG 81 2.461 5.078 6.079
681 HB3 ARG 81 HB3 ARG 81 3.140 5.387 7.670
682 HG2 ARG 81 HG2 ARG 81 4.185 7.386 6.927
683 HG3 ARG 81 HG3 ARG 81 3.826 7.018 5.237
684 HD2 ARG 81 HD2 ARG 81 1.399 7.126 5.809
685 HD3 ARG 81 HD3 ARG 81 1.855 7.678 7.419
686 HE ARG 81 HE ARG 81 2.966 9.596 6.213
687 HH11 ARG 81 HH11 ARG 81 0.251 7.875 4.818
688 HH12 ARG 81 HH12 ARG 81 -0.340 9.244 3.923
689 HH21 ARG 81 HH21 ARG 81 2.190 11.415 5.046
690 HH22 ARG 81 HH22 ARG 81 0.771 11.257 4.052
691 H MET 82 H MET 82 3.082 2.929 5.025
692 HA MET 82 HA MET 82 2.510 1.145 7.111
693 HB2 MET 82 HB2 MET 82 1.131 1.369 5.083
694 HB3 MET 82 HB3 MET 82 2.414 0.632 4.136
695 HG2 MET 82 HG2 MET 82 2.175 -1.440 5.391
696 HG3 MET 82 HG3 MET 82 0.916 -0.705 6.380
697 HE1 MET 82 HE1 MET 82 1.931 -1.949 2.818
698 HE2 MET 82 HE2 MET 82 1.475 -0.280 2.476
699 HE3 MET 82 HE3 MET 82 0.484 -1.608 1.872
700 H PHE 83 H PHE 83 4.860 0.851 4.445
701 HA PHE 83 HA PHE 83 5.769 -1.712 5.291
702 HB2 PHE 83 HB2 PHE 83 6.984 0.322 3.419
703 HB3 PHE 83 HB3 PHE 83 7.694 -1.260 3.721
704 HD1 PHE 83 HD2 PHE 83 5.925 -3.254 3.463
705 HD2 PHE 83 HD1 PHE 83 5.680 0.537 1.550
706 HE1 PHE 83 HE2 PHE 83 4.498 -4.234 1.717
707 HE2 PHE 83 HE1 PHE 83 4.251 -0.435 -0.201
708 HZ PHE 83 HZ PHE 83 3.657 -2.824 -0.120
709 H ASN 84 H ASN 84 6.628 1.549 6.121
710 HA ASN 84 HA ASN 84 9.147 1.041 7.303
711 HB2 ASN 84 HB2 ASN 84 8.489 3.311 6.818
712 HB3 ASN 84 HB3 ASN 84 7.080 3.174 7.866
713 HD21 ASN 84 HD21 ASN 84 10.544 3.457 7.741
714 HD22 ASN 84 HD22 ASN 84 10.748 3.926 9.392
715 H TYR 85 H TYR 85 5.885 1.154 8.624
716 HA TYR 85 HA TYR 85 6.470 0.505 11.279
717 HB2 TYR 85 HB2 TYR 85 4.242 1.249 10.203
718 HB3 TYR 85 HB3 TYR 85 3.992 -0.457 9.853
719 HD1 TYR 85 HD2 TYR 85 4.490 1.984 12.586
720 HD2 TYR 85 HD1 TYR 85 3.190 -1.928 11.538
721 HE1 TYR 85 HE2 TYR 85 3.559 1.698 14.840
722 HE2 TYR 85 HE1 TYR 85 2.256 -2.225 13.793
723 HH TYR 85 HH TYR 85 1.889 0.367 15.992
724 H ALA 86 H ALA 86 6.114 -1.538 8.435
725 HA ALA 86 HA ALA 86 6.257 -4.010 9.868
726 HB1 ALA 86 HB1 ALA 86 6.618 -5.028 7.665
727 HB2 ALA 86 HB2 ALA 86 6.795 -3.423 6.956
728 HB3 ALA 86 HB3 ALA 86 5.252 -3.912 7.657
729 H ILE 87 H ILE 87 8.583 -1.728 8.662
730 HA ILE 87 HA ILE 87 10.838 -3.484 8.795
731 HB ILE 87 HB ILE 87 10.709 -0.462 8.764
732 HG12 ILE 87 HG12 ILE 87 11.344 -2.472 6.590
733 HG13 ILE 87 HG13 ILE 87 9.856 -1.541 6.726
734 HG21 ILE 87 HG21 ILE 87 13.096 -0.534 8.193
735 HG22 ILE 87 HG22 ILE 87 13.097 -2.281 8.439
736 HG23 ILE 87 HG23 ILE 87 12.784 -1.198 9.796
737 HD11 ILE 87 HD11 ILE 87 12.602 -0.396 6.275
738 HD12 ILE 87 HD12 ILE 87 11.097 0.518 6.376
739 HD13 ILE 87 HD13 ILE 87 11.355 -0.614 5.048
740 H LYS 88 H LYS 88 9.420 -1.070 10.994
741 HA LYS 88 HA LYS 88 11.448 -1.352 12.963
742 HB2 LYS 88 HB2 LYS 88 9.999 -0.101 14.445
743 HB3 LYS 88 HB3 LYS 88 10.008 0.636 12.851
744 HG2 LYS 88 HG2 LYS 88 7.845 -0.455 12.375
745 HG3 LYS 88 HG3 LYS 88 7.838 -1.089 14.022
746 HD2 LYS 88 HD2 LYS 88 6.488 0.913 13.919
747 HD3 LYS 88 HD3 LYS 88 7.934 1.229 14.878
748 HE2 LYS 88 HE2 LYS 88 8.983 2.258 12.901
749 HE3 LYS 88 HE3 LYS 88 7.498 1.995 11.992
750 HZ1 LYS 88 HZ1 LYS 88 6.333 3.425 13.566
751 HZ2 LYS 88 HZ2 LYS 88 7.615 4.255 12.829
752 HZ3 LYS 88 HZ3 LYS 88 7.769 3.688 14.424
753 H ARG 89 H ARG 89 8.729 -3.226 12.114
754 HA ARG 89 HA ARG 89 8.731 -4.757 14.586
755 HB2 ARG 89 HB2 ARG 89 6.979 -4.448 12.306
756 HB3 ARG 89 HB3 ARG 89 7.288 -6.149 12.625
757 HG2 ARG 89 HG2 ARG 89 6.547 -5.839 14.942
758 HG3 ARG 89 HG3 ARG 89 6.208 -4.140 14.592
759 HD2 ARG 89 HD2 ARG 89 4.520 -4.725 13.012
760 HD3 ARG 89 HD3 ARG 89 4.971 -6.427 13.074
761 HE ARG 89 HE ARG 89 4.206 -6.255 15.503
762 HH11 ARG 89 HH11 ARG 89 2.879 -4.290 12.942
763 HH12 ARG 89 HH12 ARG 89 1.289 -4.201 13.644
764 HH21 ARG 89 HH21 ARG 89 2.083 -6.212 16.405
765 HH22 ARG 89 HH22 ARG 89 0.826 -5.336 15.569
766 H HIS 90 H HIS 90 10.704 -4.564 12.019
767 HA HIS 90 HA HIS 90 12.145 -5.835 10.881
768 HB2 HIS 90 HB2 HIS 90 12.934 -6.130 13.258
769 HB3 HIS 90 HB3 HIS 90 12.077 -7.669 13.277
770 HD1 HIS 90 HD1 HIS 90 15.108 -5.997 11.839
771 HD2 HIS 90 HD2 HIS 90 13.233 -9.692 11.754
772 HE1 HIS 90 HE1 HIS 90 16.786 -7.579 10.829
773 HE2 HIS 90 HE2 HIS 90 15.550 -9.763 10.598
774 H ILE 91 H ILE 91 9.664 -6.237 9.987
775 HA ILE 91 HA ILE 91 9.487 -9.127 9.482
776 HB ILE 91 HB ILE 91 7.671 -6.921 8.467
777 HG12 ILE 91 HG12 ILE 91 7.227 -8.830 10.779
778 HG13 ILE 91 HG13 ILE 91 7.635 -7.125 10.947
779 HG21 ILE 91 HG21 ILE 91 6.131 -8.750 7.946
780 HG22 ILE 91 HG22 ILE 91 7.317 -9.918 8.525
781 HG23 ILE 91 HG23 ILE 91 7.663 -8.944 7.095
782 HD11 ILE 91 HD11 ILE 91 5.541 -6.523 9.838
783 HD12 ILE 91 HD12 ILE 91 5.265 -7.499 11.282
784 HD13 ILE 91 HD13 ILE 91 5.139 -8.233 9.682
785 H ILE 92 H ILE 92 9.905 -6.016 7.890
786 HA ILE 92 HA ILE 92 11.436 -7.371 5.788
787 HB ILE 92 HB ILE 92 10.722 -5.578 4.204
788 HG12 ILE 92 HG12 ILE 92 8.616 -5.021 6.308
789 HG13 ILE 92 HG13 ILE 92 9.950 -3.948 5.892
790 HG21 ILE 92 HG21 ILE 92 8.547 -7.371 5.274
791 HG22 ILE 92 HG22 ILE 92 9.766 -7.796 4.071
792 HG23 ILE 92 HG23 ILE 92 8.540 -6.585 3.693
793 HD11 ILE 92 HD11 ILE 92 7.710 -4.779 4.062
794 HD12 ILE 92 HD12 ILE 92 9.046 -3.710 3.637
795 HD13 ILE 92 HD13 ILE 92 7.881 -3.219 4.867
796 H GLU 93 H GLU 93 13.248 -6.225 5.036
797 HA GLU 93 HA GLU 93 13.963 -3.819 6.560
798 HB2 GLU 93 HB2 GLU 93 14.881 -5.961 7.584
799 HB3 GLU 93 HB3 GLU 93 15.854 -6.139 6.133
800 HG2 GLU 93 HG2 GLU 93 16.960 -4.013 6.615
801 HG3 GLU 93 HG3 GLU 93 15.985 -3.840 8.074
802 H TYR 94 H TYR 94 13.227 -4.716 3.691
803 HA TYR 94 HA TYR 94 15.645 -3.746 2.325
804 HB2 TYR 94 HB2 TYR 94 13.347 -5.312 1.134
805 HB3 TYR 94 HB3 TYR 94 14.875 -4.918 0.351
806 HD1 TYR 94 HD2 TYR 94 17.020 -5.856 1.450
807 HD2 TYR 94 HD1 TYR 94 13.117 -7.324 2.289
808 HE1 TYR 94 HE2 TYR 94 17.994 -7.946 2.305
809 HE2 TYR 94 HE1 TYR 94 14.081 -9.417 3.144
810 HH TYR 94 HH TYR 94 17.306 -9.765 3.930
811 H ASN 95 H ASN 95 12.655 -2.706 3.299
812 HA ASN 95 HA ASN 95 11.087 -1.237 2.636
813 HB2 ASN 95 HB2 ASN 95 13.256 0.079 3.189
814 HB3 ASN 95 HB3 ASN 95 13.331 0.361 1.448
815 HD21 ASN 95 HD21 ASN 95 11.549 1.401 0.451
816 HD22 ASN 95 HD22 ASN 95 10.546 2.451 1.361
817 HA PRO 96 HA PRO 96 11.060 -2.935 -1.696
818 HB2 PRO 96 HB2 PRO 96 8.186 -3.223 -1.043
819 HB3 PRO 96 HB3 PRO 96 9.315 -4.415 -1.705
820 HG2 PRO 96 HG2 PRO 96 8.484 -4.584 0.818
821 HG3 PRO 96 HG3 PRO 96 10.163 -4.960 0.386
822 HD2 PRO 96 HD2 PRO 96 9.037 -2.472 1.627
823 HD3 PRO 96 HD3 PRO 96 10.519 -3.363 2.037
824 H ALA 97 H ALA 97 9.191 -0.465 -0.127
825 HA ALA 97 HA ALA 97 7.909 0.483 -2.516
826 HB1 ALA 97 HB1 ALA 97 7.093 2.298 -1.131
827 HB2 ALA 97 HB2 ALA 97 8.205 1.840 0.160
828 HB3 ALA 97 HB3 ALA 97 6.891 0.756 -0.297
829 H ALA 98 H ALA 98 11.053 0.563 -1.605
830 HA ALA 98 HA ALA 98 11.766 3.283 -1.926
831 HB1 ALA 98 HB1 ALA 98 14.053 2.485 -2.100
832 HB2 ALA 98 HB2 ALA 98 13.473 0.832 -2.307
833 HB3 ALA 98 HB3 ALA 98 13.204 1.679 -0.782
834 H ALA 99 H ALA 99 10.859 0.916 -4.192
835 HA ALA 99 HA ALA 99 12.346 1.667 -6.445
836 HB1 ALA 99 HB1 ALA 99 10.988 -0.375 -6.329
837 HB2 ALA 99 HB2 ALA 99 10.602 0.590 -7.755
838 HB3 ALA 99 HB3 ALA 99 9.522 0.604 -6.360
839 H PHE 100 H PHE 100 9.512 3.052 -4.955
840 HA PHE 100 HA PHE 100 9.729 5.348 -6.766
841 HB2 PHE 100 HB2 PHE 100 7.193 3.896 -5.994
842 HB3 PHE 100 HB3 PHE 100 7.197 5.535 -6.643
843 HD1 PHE 100 HD2 PHE 100 7.971 5.947 -8.946
844 HD2 PHE 100 HD1 PHE 100 7.532 2.010 -7.395
845 HE1 PHE 100 HE2 PHE 100 8.023 5.043 -11.233
846 HE2 PHE 100 HE1 PHE 100 7.586 1.099 -9.678
847 HZ PHE 100 HZ PHE 100 7.830 2.617 -11.600
848 H ASP 101 H ASP 101 10.752 4.833 -4.142
849 HA ASP 101 HA ASP 101 9.211 5.943 -2.078
850 HB2 ASP 101 HB2 ASP 101 11.296 4.621 -1.754
851 HB3 ASP 101 HB3 ASP 101 12.225 5.981 -2.373
852 HA PRO 102 HA PRO 102 8.902 10.186 -3.238
853 HB2 PRO 102 HB2 PRO 102 8.881 10.689 -0.310
854 HB3 PRO 102 HB3 PRO 102 7.694 11.136 -1.540
855 HG2 PRO 102 HG2 PRO 102 7.204 9.154 0.168
856 HG3 PRO 102 HG3 PRO 102 6.698 9.041 -1.529
857 HD2 PRO 102 HD2 PRO 102 9.022 7.757 -0.153
858 HD3 PRO 102 HD3 PRO 102 7.938 7.092 -1.393
859 H GLY 103 H GLY 103 11.403 9.035 -1.099
860 HA2 GLY 103 HA2 GLY 103 13.654 9.823 -1.421
861 HA3 GLY 103 HA3 GLY 103 13.002 11.410 -1.805
862 H ASP 104 H ASP 104 12.854 12.884 -0.223
863 HA ASP 104 HA ASP 104 13.738 12.087 2.423
864 HB2 ASP 104 HB2 ASP 104 14.697 14.122 1.466
865 HB3 ASP 104 HB3 ASP 104 13.088 14.830 1.333
866 H ALA 105 H ALA 105 12.382 11.447 3.887
867 HA ALA 105 HA ALA 105 9.789 12.798 4.134
868 HB1 ALA 105 HB1 ALA 105 10.200 9.813 4.376
869 HB2 ALA 105 HB2 ALA 105 9.410 10.632 3.028
870 HB3 ALA 105 HB3 ALA 105 8.686 10.681 4.635
871 H GLY 106 H GLY 106 8.805 12.054 6.387
872 HA2 GLY 106 HA2 GLY 106 10.570 12.959 8.390
873 HA3 GLY 106 HA3 GLY 106 9.015 12.186 8.668
874 H GLY 107 H GLY 107 12.357 11.885 8.962
875 HA2 GLY 107 HA2 GLY 107 12.537 9.014 8.933
876 HA3 GLY 107 HA3 GLY 107 13.743 10.130 9.567
877 H LYS 108 H LYS 108 11.999 11.506 11.305
878 HA LYS 108 HA LYS 108 11.052 11.504 13.339
879 HB2 LYS 108 HB2 LYS 108 10.291 8.748 12.452
880 HB3 LYS 108 HB3 LYS 108 9.891 9.319 14.067
881 HG2 LYS 108 HG2 LYS 108 9.072 10.641 11.490
882 HG3 LYS 108 HG3 LYS 108 8.043 9.627 12.508
883 HD2 LYS 108 HD2 LYS 108 8.268 11.196 14.345
884 HD3 LYS 108 HD3 LYS 108 9.369 12.189 13.387
885 HE2 LYS 108 HE2 LYS 108 7.158 13.159 13.385
886 HE3 LYS 108 HE3 LYS 108 7.570 12.586 11.771
887 HZ1 LYS 108 HZ1 LYS 108 6.135 10.771 11.971
888 HZ2 LYS 108 HZ2 LYS 108 5.261 12.062 12.648
889 HZ3 LYS 108 HZ3 LYS 108 6.009 10.925 13.655
890 H LEU 109 H LEU 109 11.558 11.260 15.400
891 HA LEU 109 HA LEU 109 13.786 9.523 16.126
892 HB2 LEU 109 HB2 LEU 109 13.761 10.697 18.260
893 HB3 LEU 109 HB3 LEU 109 13.801 11.844 16.940
894 HG LEU 109 HG LEU 109 11.209 11.135 18.297
895 HD11 LEU 109 HD11 LEU 109 11.530 13.103 19.723
896 HD12 LEU 109 HD12 LEU 109 13.175 13.270 19.108
897 HD13 LEU 109 HD13 LEU 109 12.725 11.848 20.049
898 HD21 LEU 109 HD21 LEU 109 11.069 12.330 16.169
899 HD22 LEU 109 HD22 LEU 109 12.146 13.578 16.792
900 HD23 LEU 109 HD23 LEU 109 10.548 13.356 17.506
901 H GLU 110 H GLU 110 11.512 8.251 15.310
902 HA GLU 110 HA GLU 110 9.502 7.794 17.187
903 HB2 GLU 110 HB2 GLU 110 9.834 7.232 14.579
904 HB3 GLU 110 HB3 GLU 110 10.153 5.641 15.253
905 HG2 GLU 110 HG2 GLU 110 7.677 7.237 15.849
906 HG3 GLU 110 HG3 GLU 110 7.797 6.059 14.545
907 H HIS 111 H HIS 111 9.818 7.001 19.125
908 HA HIS 111 HA HIS 111 11.106 4.409 19.415
909 HB2 HIS 111 HB2 HIS 111 12.928 5.906 19.940
910 HB3 HIS 111 HB3 HIS 111 11.897 6.871 20.990
911 HD1 HIS 111 HD1 HIS 111 11.457 5.988 23.369
912 HD2 HIS 111 HD2 HIS 111 13.882 3.509 21.067
913 HE1 HIS 111 HE1 HIS 111 12.457 4.335 24.977
914 HE2 HIS 111 HE2 HIS 111 14.021 2.930 23.590
915 H HIS 112 H HIS 112 9.567 3.217 20.288
916 HA HIS 112 HA HIS 112 8.219 4.140 22.693
917 HB2 HIS 112 HB2 HIS 112 6.769 3.368 20.158
918 HB3 HIS 112 HB3 HIS 112 6.007 3.246 21.740
919 HD1 HIS 112 HD1 HIS 112 6.984 5.680 19.110
920 HD2 HIS 112 HD2 HIS 112 5.495 5.751 23.004
921 HE1 HIS 112 HE1 HIS 112 6.167 8.029 19.490
922 HE2 HIS 112 HE2 HIS 112 5.156 8.015 21.794
923 H HIS 113 H HIS 113 8.790 2.594 24.065
924 HA HIS 113 HA HIS 113 9.493 -0.031 23.138
925 HB2 HIS 113 HB2 HIS 113 10.538 1.302 25.087
926 HB3 HIS 113 HB3 HIS 113 9.166 0.728 26.029
927 HD1 HIS 113 HD1 HIS 113 12.103 -0.653 24.040
928 HD2 HIS 113 HD2 HIS 113 9.466 -1.779 27.058
929 HE1 HIS 113 HE1 HIS 113 12.933 -2.870 24.879
930 HE2 HIS 113 HE2 HIS 113 11.459 -3.421 26.842
931 H HIS 114 H HIS 114 6.627 1.451 24.248
932 HA HIS 114 HA HIS 114 5.334 -1.157 24.614
933 HB2 HIS 114 HB2 HIS 114 4.203 1.639 24.929
934 HB3 HIS 114 HB3 HIS 114 3.334 0.144 25.259
935 HD1 HIS 114 HD1 HIS 114 4.450 2.660 27.176
936 HD2 HIS 114 HD2 HIS 114 5.495 -1.368 27.158
937 HE1 HIS 114 HE1 HIS 114 5.383 2.187 29.467
938 HE2 HIS 114 HE2 HIS 114 5.906 -0.279 29.470
939 H HIS 115 H HIS 115 4.597 -2.116 22.857
940 HA HIS 115 HA HIS 115 4.712 -0.776 20.342
941 HB2 HIS 115 HB2 HIS 115 3.863 -3.572 21.088
942 HB3 HIS 115 HB3 HIS 115 3.986 -2.998 19.430
943 HD1 HIS 115 HD1 HIS 115 6.150 -3.665 22.465
944 HD2 HIS 115 HD2 HIS 115 6.505 -3.074 18.362
945 HE1 HIS 115 HE1 HIS 115 8.546 -4.188 21.909
946 HE2 HIS 115 HE2 HIS 115 8.667 -4.056 19.396
947 H HIS 116 H HIS 116 3.086 0.854 20.792
948 HA HIS 116 HA HIS 116 0.843 0.374 19.188
949 HB2 HIS 116 HB2 HIS 116 -1.002 0.684 20.764
950 HB3 HIS 116 HB3 HIS 116 -0.092 -0.766 21.160
951 HD1 HIS 116 HD1 HIS 116 0.775 -0.962 23.502
952 HD2 HIS 116 HD2 HIS 116 -0.544 2.882 22.606
953 HE1 HIS 116 HE1 HIS 116 0.798 0.292 25.684
954 HE2 HIS 116 HE2 HIS 116 -0.231 2.528 25.152
Start of MODEL 9
1 H1 MET 1 H1 MET 1 2.274 -9.002 15.269
2 H2 MET 1 H2 MET 1 3.913 -8.742 14.914
3 H3 MET 1 H3 MET 1 3.282 -8.235 16.400
4 HA MET 1 HA MET 1 4.567 -10.226 16.685
5 HB2 MET 1 HB2 MET 1 1.584 -10.651 16.946
6 HB3 MET 1 HB3 MET 1 2.802 -11.659 17.713
7 HG2 MET 1 HG2 MET 1 3.578 -9.783 19.020
8 HG3 MET 1 HG3 MET 1 2.447 -8.710 18.197
9 HE1 MET 1 HE1 MET 1 -1.005 -10.061 19.445
10 HE2 MET 1 HE2 MET 1 -0.149 -10.529 17.977
11 HE3 MET 1 HE3 MET 1 -0.184 -8.838 18.475
12 H ALA 2 H ALA 2 5.535 -11.707 15.470
13 HA ALA 2 HA ALA 2 3.903 -13.203 13.528
14 HB1 ALA 2 HB1 ALA 2 6.655 -12.080 13.036
15 HB2 ALA 2 HB2 ALA 2 5.149 -11.504 12.320
16 HB3 ALA 2 HB3 ALA 2 5.753 -13.114 11.929
17 H GLU 3 H GLU 3 3.801 -15.110 14.517
18 HA GLU 3 HA GLU 3 6.192 -16.722 14.415
19 HB2 GLU 3 HB2 GLU 3 6.197 -15.857 16.764
20 HB3 GLU 3 HB3 GLU 3 4.622 -16.603 17.003
21 HG2 GLU 3 HG2 GLU 3 5.667 -18.801 16.425
22 HG3 GLU 3 HG3 GLU 3 7.230 -17.991 16.430
23 H LYS 4 H LYS 4 2.801 -16.608 15.480
24 HA LYS 4 HA LYS 4 2.341 -19.284 14.414
25 HB2 LYS 4 HB2 LYS 4 0.451 -17.363 15.795
26 HB3 LYS 4 HB3 LYS 4 0.038 -18.993 15.293
27 HG2 LYS 4 HG2 LYS 4 0.446 -19.182 17.573
28 HG3 LYS 4 HG3 LYS 4 1.937 -19.757 16.829
29 HD2 LYS 4 HD2 LYS 4 2.378 -18.279 18.734
30 HD3 LYS 4 HD3 LYS 4 2.988 -17.598 17.227
31 HE2 LYS 4 HE2 LYS 4 1.927 -15.855 18.500
32 HE3 LYS 4 HE3 LYS 4 0.942 -16.207 17.082
33 HZ1 LYS 4 HZ1 LYS 4 -0.521 -16.002 18.893
34 HZ2 LYS 4 HZ2 LYS 4 0.424 -16.990 19.891
35 HZ3 LYS 4 HZ3 LYS 4 -0.418 -17.667 18.584
36 H ASN 5 H ASN 5 1.453 -15.935 13.866
37 HA ASN 5 HA ASN 5 0.341 -16.688 11.244
38 HB2 ASN 5 HB2 ASN 5 -1.419 -15.860 12.726
39 HB3 ASN 5 HB3 ASN 5 -0.477 -14.417 13.072
40 HD21 ASN 5 HD21 ASN 5 -2.139 -13.094 12.359
41 HD22 ASN 5 HD22 ASN 5 -2.513 -12.895 10.681
42 H ALA 6 H ALA 6 1.883 -16.233 9.806
43 HA ALA 6 HA ALA 6 3.807 -14.151 10.178
44 HB1 ALA 6 HB1 ALA 6 4.602 -14.759 7.957
45 HB2 ALA 6 HB2 ALA 6 3.171 -15.758 7.705
46 HB3 ALA 6 HB3 ALA 6 4.346 -16.196 8.946
47 H TYR 7 H TYR 7 3.984 -12.202 9.120
48 HA TYR 7 HA TYR 7 1.541 -10.868 8.603
49 HB2 TYR 7 HB2 TYR 7 4.425 -10.104 8.496
50 HB3 TYR 7 HB3 TYR 7 3.233 -9.045 7.753
51 HD1 TYR 7 HD2 TYR 7 4.160 -10.666 10.967
52 HD2 TYR 7 HD1 TYR 7 1.967 -7.568 9.045
53 HE1 TYR 7 HE2 TYR 7 3.715 -9.630 13.151
54 HE2 TYR 7 HE1 TYR 7 1.519 -6.522 11.223
55 HH TYR 7 HH TYR 7 1.521 -6.923 13.493
56 H THR 8 H THR 8 0.412 -11.416 6.862
57 HA THR 8 HA THR 8 1.571 -11.565 4.227
58 HB THR 8 HB THR 8 -1.344 -11.052 4.673
59 HG1 THR 8 HG1 THR 8 -0.483 -13.696 5.017
60 HG21 THR 8 HG21 THR 8 -1.575 -12.771 2.938
61 HG22 THR 8 HG22 THR 8 0.171 -13.015 2.950
62 HG23 THR 8 HG23 THR 8 -0.497 -11.475 2.416
63 H VAL 9 H VAL 9 1.141 -9.902 2.546
64 HA VAL 9 HA VAL 9 1.622 -7.301 3.516
65 HB VAL 9 HB VAL 9 2.299 -8.052 1.257
66 HG11 VAL 9 HG11 VAL 9 0.677 -7.985 -0.586
67 HG12 VAL 9 HG12 VAL 9 -0.624 -7.771 0.586
68 HG13 VAL 9 HG13 VAL 9 0.323 -9.259 0.581
69 HG21 VAL 9 HG21 VAL 9 2.287 -5.684 1.769
70 HG22 VAL 9 HG22 VAL 9 0.587 -5.567 1.311
71 HG23 VAL 9 HG23 VAL 9 1.805 -5.942 0.091
72 H ALA 10 H ALA 10 -1.339 -8.943 2.590
73 HA ALA 10 HA ALA 10 -3.075 -6.732 2.720
74 HB1 ALA 10 HB1 ALA 10 -4.859 -8.374 2.983
75 HB2 ALA 10 HB2 ALA 10 -3.666 -9.626 3.330
76 HB3 ALA 10 HB3 ALA 10 -3.719 -8.879 1.735
77 H GLN 11 H GLN 11 -1.985 -9.039 5.168
78 HA GLN 11 HA GLN 11 -3.637 -8.088 7.254
79 HB2 GLN 11 HB2 GLN 11 -1.142 -9.744 7.263
80 HB3 GLN 11 HB3 GLN 11 -2.022 -9.327 8.731
81 HG2 GLN 11 HG2 GLN 11 -4.066 -10.312 7.575
82 HG3 GLN 11 HG3 GLN 11 -2.923 -11.001 6.421
83 HE21 GLN 11 HE21 GLN 11 -1.496 -12.575 7.094
84 HE22 GLN 11 HE22 GLN 11 -1.704 -13.409 8.588
85 H LEU 12 H LEU 12 -0.318 -7.378 6.285
86 HA LEU 12 HA LEU 12 0.458 -5.774 8.430
87 HB2 LEU 12 HB2 LEU 12 1.998 -6.554 6.690
88 HB3 LEU 12 HB3 LEU 12 1.201 -5.532 5.511
89 HG LEU 12 HG LEU 12 1.931 -3.537 6.809
90 HD11 LEU 12 HD11 LEU 12 3.521 -5.561 8.379
91 HD12 LEU 12 HD12 LEU 12 2.176 -4.598 8.991
92 HD13 LEU 12 HD13 LEU 12 3.673 -3.808 8.498
93 HD21 LEU 12 HD21 LEU 12 4.145 -5.381 5.927
94 HD22 LEU 12 HD22 LEU 12 4.253 -3.629 6.090
95 HD23 LEU 12 HD23 LEU 12 3.192 -4.339 4.871
96 H ALA 13 H ALA 13 -1.202 -4.915 5.427
97 HA ALA 13 HA ALA 13 -1.356 -2.147 5.855
98 HB1 ALA 13 HB1 ALA 13 -3.094 -2.159 4.152
99 HB2 ALA 13 HB2 ALA 13 -3.261 -3.907 4.315
100 HB3 ALA 13 HB3 ALA 13 -1.765 -3.220 3.682
101 H ASP 14 H ASP 14 -3.576 -4.773 6.698
102 HA ASP 14 HA ASP 14 -5.605 -3.014 7.641
103 HB2 ASP 14 HB2 ASP 14 -5.226 -5.978 7.666
104 HB3 ASP 14 HB3 ASP 14 -6.471 -5.257 8.684
105 H GLU 15 H GLU 15 -2.875 -4.587 9.186
106 HA GLU 15 HA GLU 15 -3.810 -3.928 11.830
107 HB2 GLU 15 HB2 GLU 15 -2.184 -5.773 11.446
108 HB3 GLU 15 HB3 GLU 15 -0.986 -4.582 10.954
109 HG2 GLU 15 HG2 GLU 15 -1.032 -3.574 13.152
110 HG3 GLU 15 HG3 GLU 15 -2.307 -4.680 13.656
111 H TYR 16 H TYR 16 -1.602 -2.495 9.469
112 HA TYR 16 HA TYR 16 -0.636 -0.427 11.099
113 HB2 TYR 16 HB2 TYR 16 0.483 -0.961 9.023
114 HB3 TYR 16 HB3 TYR 16 -0.950 -0.534 8.092
115 HD1 TYR 16 HD2 TYR 16 1.609 0.894 10.376
116 HD2 TYR 16 HD1 TYR 16 -1.252 1.663 7.328
117 HE1 TYR 16 HE2 TYR 16 2.402 3.215 10.229
118 HE2 TYR 16 HE1 TYR 16 -0.470 3.988 7.173
119 HH TYR 16 HH TYR 16 0.681 5.634 8.613
120 H PHE 17 H PHE 17 -3.350 -0.394 8.759
121 HA PHE 17 HA PHE 17 -3.911 2.345 9.198
122 HB2 PHE 17 HB2 PHE 17 -5.562 2.139 7.643
123 HB3 PHE 17 HB3 PHE 17 -4.694 0.656 7.281
124 HD1 PHE 17 HD2 PHE 17 -5.627 -1.507 7.890
125 HD2 PHE 17 HD1 PHE 17 -7.738 2.101 8.682
126 HE1 PHE 17 HE2 PHE 17 -7.689 -2.796 8.246
127 HE2 PHE 17 HE1 PHE 17 -9.807 0.816 9.040
128 HZ PHE 17 HZ PHE 17 -9.782 -1.635 8.821
129 H GLU 18 H GLU 18 -5.021 -0.590 10.745
130 HA GLU 18 HA GLU 18 -7.251 0.432 12.104
131 HB2 GLU 18 HB2 GLU 18 -6.673 -1.969 11.871
132 HB3 GLU 18 HB3 GLU 18 -5.343 -1.740 12.995
133 HG2 GLU 18 HG2 GLU 18 -7.661 -0.755 14.247
134 HG3 GLU 18 HG3 GLU 18 -8.076 -2.311 13.534
135 H ARG 19 H ARG 19 -3.858 0.769 12.697
136 HA ARG 19 HA ARG 19 -4.233 1.684 15.421
137 HB2 ARG 19 HB2 ARG 19 -1.724 1.748 13.738
138 HB3 ARG 19 HB3 ARG 19 -1.830 1.902 15.487
139 HG2 ARG 19 HG2 ARG 19 -2.400 -0.541 13.833
140 HG3 ARG 19 HG3 ARG 19 -1.088 -0.300 14.988
141 HD2 ARG 19 HD2 ARG 19 -2.659 -0.187 16.807
142 HD3 ARG 19 HD3 ARG 19 -4.016 -0.285 15.691
143 HE ARG 19 HE ARG 19 -2.870 -2.555 15.108
144 HH11 ARG 19 HH11 ARG 19 -3.226 -1.118 18.276
145 HH12 ARG 19 HH12 ARG 19 -3.323 -2.646 19.104
146 HH21 ARG 19 HH21 ARG 19 -3.011 -4.572 16.188
147 HH22 ARG 19 HH22 ARG 19 -3.183 -4.600 17.914
148 H MET 20 H MET 20 -3.490 3.033 12.267
149 HA MET 20 HA MET 20 -3.102 5.699 13.317
150 HB2 MET 20 HB2 MET 20 -3.246 4.688 10.471
151 HB3 MET 20 HB3 MET 20 -2.845 6.338 10.927
152 HG2 MET 20 HG2 MET 20 -1.274 3.881 11.678
153 HG3 MET 20 HG3 MET 20 -0.860 5.021 10.399
154 HE1 MET 20 HE1 MET 20 1.109 4.141 12.790
155 HE2 MET 20 HE2 MET 20 1.836 5.694 13.202
156 HE3 MET 20 HE3 MET 20 1.585 5.262 11.510
157 H ILE 21 H ILE 21 -5.660 3.879 11.843
158 HA ILE 21 HA ILE 21 -7.388 6.196 11.500
159 HB ILE 21 HB ILE 21 -7.870 3.233 11.069
160 HG12 ILE 21 HG12 ILE 21 -6.264 4.181 9.507
161 HG13 ILE 21 HG13 ILE 21 -7.772 3.815 8.677
162 HG21 ILE 21 HG21 ILE 21 -9.906 3.833 9.887
163 HG22 ILE 21 HG22 ILE 21 -9.650 5.534 10.280
164 HG23 ILE 21 HG23 ILE 21 -9.981 4.371 11.565
165 HD11 ILE 21 HD11 ILE 21 -6.878 6.538 9.602
166 HD12 ILE 21 HD12 ILE 21 -8.390 6.173 8.771
167 HD13 ILE 21 HD13 ILE 21 -6.851 5.935 7.942
168 H ALA 22 H ALA 22 -6.332 4.522 14.062
169 HA ALA 22 HA ALA 22 -8.846 4.418 15.516
170 HB1 ALA 22 HB1 ALA 22 -7.551 3.496 17.345
171 HB2 ALA 22 HB2 ALA 22 -6.049 3.850 16.491
172 HB3 ALA 22 HB3 ALA 22 -7.167 2.645 15.848
173 H GLY 23 H GLY 23 -6.715 6.770 14.655
174 HA2 GLY 23 HA2 GLY 23 -6.949 8.258 17.185
175 HA3 GLY 23 HA3 GLY 23 -5.814 8.619 15.893
176 H ARG 24 H ARG 24 -6.447 9.891 14.178
177 HA ARG 24 HA ARG 24 -9.191 10.922 14.266
178 HB2 ARG 24 HB2 ARG 24 -7.739 12.676 15.001
179 HB3 ARG 24 HB3 ARG 24 -6.596 12.356 13.704
180 HG2 ARG 24 HG2 ARG 24 -9.018 12.891 12.430
181 HG3 ARG 24 HG3 ARG 24 -8.893 14.075 13.735
182 HD2 ARG 24 HD2 ARG 24 -6.635 13.498 11.842
183 HD3 ARG 24 HD3 ARG 24 -7.863 14.705 11.512
184 HE ARG 24 HE ARG 24 -6.841 15.223 14.056
185 HH11 ARG 24 HH11 ARG 24 -5.788 15.284 10.713
186 HH12 ARG 24 HH12 ARG 24 -4.551 16.473 10.988
187 HH21 ARG 24 HH21 ARG 24 -5.227 16.820 14.417
188 HH22 ARG 24 HH22 ARG 24 -4.231 17.344 13.097
189 H TRP 25 H TRP 25 -10.056 9.719 12.713
190 HA TRP 25 HA TRP 25 -8.687 9.551 10.129
191 HB2 TRP 25 HB2 TRP 25 -10.032 7.576 9.676
192 HB3 TRP 25 HB3 TRP 25 -9.190 7.396 11.209
193 HD1 TRP 25 HD1 TRP 25 -12.554 7.160 9.685
194 HE1 TRP 25 HE1 TRP 25 -14.345 6.779 11.495
195 HE3 TRP 25 HE3 TRP 25 -9.748 8.162 13.841
196 HZ2 TRP 25 HZ2 TRP 25 -14.544 6.887 14.298
197 HZ3 TRP 25 HZ3 TRP 25 -10.818 7.993 16.050
198 HH2 TRP 25 HH2 TRP 25 -13.164 7.373 16.267
199 H LYS 26 H LYS 26 -11.880 10.143 11.577
200 HA LYS 26 HA LYS 26 -13.532 11.593 11.008
201 HB2 LYS 26 HB2 LYS 26 -11.503 12.651 9.041
202 HB3 LYS 26 HB3 LYS 26 -13.047 13.413 9.384
203 HG2 LYS 26 HG2 LYS 26 -11.118 12.878 11.601
204 HG3 LYS 26 HG3 LYS 26 -10.890 14.268 10.544
205 HD2 LYS 26 HD2 LYS 26 -12.105 14.961 12.500
206 HD3 LYS 26 HD3 LYS 26 -13.190 15.015 11.111
207 HE2 LYS 26 HE2 LYS 26 -14.223 12.951 11.777
208 HE3 LYS 26 HE3 LYS 26 -13.047 12.731 13.071
209 HZ1 LYS 26 HZ1 LYS 26 -15.183 13.572 13.876
210 HZ2 LYS 26 HZ2 LYS 26 -15.012 14.962 12.922
211 HZ3 LYS 26 HZ3 LYS 26 -13.919 14.664 14.186
212 H HIS 27 H HIS 27 -12.377 9.322 8.813
213 HA HIS 27 HA HIS 27 -14.887 9.221 7.425
214 HB2 HIS 27 HB2 HIS 27 -13.738 9.305 5.121
215 HB3 HIS 27 HB3 HIS 27 -14.060 10.829 5.935
216 HD1 HIS 27 HD1 HIS 27 -11.169 8.449 5.298
217 HD2 HIS 27 HD2 HIS 27 -11.879 12.421 6.269
218 HE1 HIS 27 HE1 HIS 27 -8.930 9.582 5.170
219 HE2 HIS 27 HE2 HIS 27 -9.355 11.925 6.005
220 HA PRO 28 HA PRO 28 -12.907 5.179 8.174
221 HB2 PRO 28 HB2 PRO 28 -15.634 4.198 8.477
222 HB3 PRO 28 HB3 PRO 28 -14.334 4.257 9.668
223 HG2 PRO 28 HG2 PRO 28 -16.548 5.826 9.810
224 HG3 PRO 28 HG3 PRO 28 -14.971 6.312 10.452
225 HD2 PRO 28 HD2 PRO 28 -16.306 7.112 7.900
226 HD3 PRO 28 HD3 PRO 28 -15.347 8.093 9.030
227 H ASN 29 H ASN 29 -15.976 5.506 6.413
228 HA ASN 29 HA ASN 29 -15.775 3.172 4.905
229 HB2 ASN 29 HB2 ASN 29 -17.458 4.206 3.408
230 HB3 ASN 29 HB3 ASN 29 -17.880 4.362 5.108
231 HD21 ASN 29 HD21 ASN 29 -18.717 5.915 2.753
232 HD22 ASN 29 HD22 ASN 29 -18.328 7.567 3.126
233 H ILE 30 H ILE 30 -14.798 6.475 4.080
234 HA ILE 30 HA ILE 30 -14.076 6.002 1.425
235 HB ILE 30 HB ILE 30 -12.962 8.063 3.331
236 HG12 ILE 30 HG12 ILE 30 -15.225 8.201 1.324
237 HG13 ILE 30 HG13 ILE 30 -15.401 8.173 3.075
238 HG21 ILE 30 HG21 ILE 30 -12.886 7.982 0.315
239 HG22 ILE 30 HG22 ILE 30 -11.508 7.773 1.396
240 HG23 ILE 30 HG23 ILE 30 -12.344 9.324 1.324
241 HD11 ILE 30 HD11 ILE 30 -14.067 10.344 1.476
242 HD12 ILE 30 HD12 ILE 30 -14.262 10.320 3.228
243 HD13 ILE 30 HD13 ILE 30 -15.680 10.415 2.186
244 H VAL 31 H VAL 31 -12.119 5.758 4.389
245 HA VAL 31 HA VAL 31 -9.717 5.307 2.876
246 HB VAL 31 HB VAL 31 -9.639 6.421 5.084
247 HG11 VAL 31 HG11 VAL 31 -11.310 5.140 6.282
248 HG12 VAL 31 HG12 VAL 31 -9.767 5.085 7.135
249 HG13 VAL 31 HG13 VAL 31 -10.300 3.697 6.187
250 HG21 VAL 31 HG21 VAL 31 -8.050 3.866 4.882
251 HG22 VAL 31 HG22 VAL 31 -7.663 5.227 5.935
252 HG23 VAL 31 HG23 VAL 31 -7.624 5.429 4.184
253 H ARG 32 H ARG 32 -12.064 3.296 4.577
254 HA ARG 32 HA ARG 32 -10.598 0.886 4.530
255 HB2 ARG 32 HB2 ARG 32 -12.967 1.637 5.613
256 HB3 ARG 32 HB3 ARG 32 -13.544 0.722 4.229
257 HG2 ARG 32 HG2 ARG 32 -11.737 -0.291 6.417
258 HG3 ARG 32 HG3 ARG 32 -13.441 -0.679 6.197
259 HD2 ARG 32 HD2 ARG 32 -12.812 -1.659 3.962
260 HD3 ARG 32 HD3 ARG 32 -11.124 -1.462 4.434
261 HE ARG 32 HE ARG 32 -13.085 -3.255 5.709
262 HH11 ARG 32 HH11 ARG 32 -9.761 -2.249 5.226
263 HH12 ARG 32 HH12 ARG 32 -9.085 -3.628 6.046
264 HH21 ARG 32 HH21 ARG 32 -12.204 -5.080 6.757
265 HH22 ARG 32 HH22 ARG 32 -10.480 -5.235 6.916
266 H SER 33 H SER 33 -13.027 2.220 2.309
267 HA SER 33 HA SER 33 -13.087 0.102 0.493
268 HB2 SER 33 HB2 SER 33 -13.576 3.040 -0.043
269 HB3 SER 33 HB3 SER 33 -14.110 1.698 -1.059
270 HG SER 33 HG SER 33 -15.831 2.156 0.216
271 H ARG 34 H ARG 34 -10.797 2.725 0.836
272 HA ARG 34 HA ARG 34 -9.577 2.320 -1.721
273 HB2 ARG 34 HB2 ARG 34 -9.316 4.453 -0.552
274 HB3 ARG 34 HB3 ARG 34 -8.463 3.644 0.757
275 HG2 ARG 34 HG2 ARG 34 -6.750 2.927 -0.912
276 HG3 ARG 34 HG3 ARG 34 -7.559 3.953 -2.094
277 HD2 ARG 34 HD2 ARG 34 -7.161 5.899 -0.683
278 HD3 ARG 34 HD3 ARG 34 -6.370 4.872 0.516
279 HE ARG 34 HE ARG 34 -5.031 4.403 -1.848
280 HH11 ARG 34 HH11 ARG 34 -5.632 7.147 0.249
281 HH12 ARG 34 HH12 ARG 34 -4.202 8.007 -0.246
282 HH21 ARG 34 HH21 ARG 34 -3.188 5.531 -2.528
283 HH22 ARG 34 HH22 ARG 34 -2.826 7.081 -1.825
284 H ILE 35 H ILE 35 -8.901 1.253 1.578
285 HA ILE 35 HA ILE 35 -6.411 0.075 1.134
286 HB ILE 35 HB ILE 35 -8.534 -0.766 3.117
287 HG12 ILE 35 HG12 ILE 35 -6.196 1.107 3.517
288 HG13 ILE 35 HG13 ILE 35 -7.832 1.655 3.153
289 HG21 ILE 35 HG21 ILE 35 -6.775 -2.447 2.849
290 HG22 ILE 35 HG22 ILE 35 -6.691 -1.670 4.429
291 HG23 ILE 35 HG23 ILE 35 -5.550 -1.218 3.162
292 HD11 ILE 35 HD11 ILE 35 -7.364 1.788 5.526
293 HD12 ILE 35 HD12 ILE 35 -6.998 0.063 5.564
294 HD13 ILE 35 HD13 ILE 35 -8.635 0.610 5.200
295 H GLU 36 H GLU 36 -9.660 -1.226 0.751
296 HA GLU 36 HA GLU 36 -8.703 -3.884 0.161
297 HB2 GLU 36 HB2 GLU 36 -11.144 -4.322 -0.292
298 HB3 GLU 36 HB3 GLU 36 -10.780 -3.734 1.324
299 HG2 GLU 36 HG2 GLU 36 -11.384 -1.439 0.524
300 HG3 GLU 36 HG3 GLU 36 -11.953 -2.185 -0.966
301 H LYS 37 H LYS 37 -9.044 -1.051 -1.660
302 HA LYS 37 HA LYS 37 -9.459 -2.522 -4.145
303 HB2 LYS 37 HB2 LYS 37 -11.020 -0.714 -3.623
304 HB3 LYS 37 HB3 LYS 37 -9.682 0.415 -3.488
305 HG2 LYS 37 HG2 LYS 37 -10.654 0.777 -5.588
306 HG3 LYS 37 HG3 LYS 37 -9.153 -0.104 -5.882
307 HD2 LYS 37 HD2 LYS 37 -11.738 -1.565 -5.563
308 HD3 LYS 37 HD3 LYS 37 -11.304 -0.815 -7.078
309 HE2 LYS 37 HE2 LYS 37 -9.237 -2.127 -7.149
310 HE3 LYS 37 HE3 LYS 37 -9.691 -2.890 -5.623
311 HZ1 LYS 37 HZ1 LYS 37 -10.251 -4.310 -7.477
312 HZ2 LYS 37 HZ2 LYS 37 -11.177 -3.080 -8.188
313 HZ3 LYS 37 HZ3 LYS 37 -11.674 -3.774 -6.723
314 H ASP 38 H ASP 38 -7.618 0.261 -2.959
315 HA ASP 38 HA ASP 38 -5.809 0.134 -5.209
316 HB2 ASP 38 HB2 ASP 38 -6.289 2.330 -4.825
317 HB3 ASP 38 HB3 ASP 38 -6.510 2.096 -3.104
318 H ILE 39 H ILE 39 -5.617 -0.290 -1.697
319 HA ILE 39 HA ILE 39 -2.779 -0.703 -1.756
320 HB ILE 39 HB ILE 39 -4.735 -1.288 0.471
321 HG12 ILE 39 HG12 ILE 39 -2.961 1.104 -0.070
322 HG13 ILE 39 HG13 ILE 39 -4.717 1.075 -0.187
323 HG21 ILE 39 HG21 ILE 39 -2.755 -1.242 1.923
324 HG22 ILE 39 HG22 ILE 39 -1.725 -1.059 0.504
325 HG23 ILE 39 HG23 ILE 39 -2.658 -2.537 0.731
326 HD11 ILE 39 HD11 ILE 39 -4.832 0.615 2.231
327 HD12 ILE 39 HD12 ILE 39 -4.046 2.148 1.854
328 HD13 ILE 39 HD13 ILE 39 -3.074 0.748 2.312
329 H LYS 40 H LYS 40 -5.619 -2.825 -1.539
330 HA LYS 40 HA LYS 40 -3.821 -5.055 -2.237
331 HB2 LYS 40 HB2 LYS 40 -6.286 -5.075 -0.506
332 HB3 LYS 40 HB3 LYS 40 -5.719 -6.536 -1.299
333 HG2 LYS 40 HG2 LYS 40 -4.796 -6.674 0.819
334 HG3 LYS 40 HG3 LYS 40 -3.471 -6.041 -0.158
335 HD2 LYS 40 HD2 LYS 40 -3.464 -4.738 1.787
336 HD3 LYS 40 HD3 LYS 40 -4.259 -3.732 0.579
337 HE2 LYS 40 HE2 LYS 40 -5.474 -3.590 2.651
338 HE3 LYS 40 HE3 LYS 40 -6.446 -4.468 1.472
339 HZ1 LYS 40 HZ1 LYS 40 -6.072 -6.483 2.542
340 HZ2 LYS 40 HZ2 LYS 40 -6.283 -5.398 3.836
341 HZ3 LYS 40 HZ3 LYS 40 -4.732 -5.900 3.397
342 HA PRO 41 HA PRO 41 -6.675 -4.323 -5.803
343 HB2 PRO 41 HB2 PRO 41 -4.326 -5.060 -7.389
344 HB3 PRO 41 HB3 PRO 41 -5.306 -3.594 -7.459
345 HG2 PRO 41 HG2 PRO 41 -2.783 -3.599 -6.500
346 HG3 PRO 41 HG3 PRO 41 -4.035 -2.508 -5.878
347 HD2 PRO 41 HD2 PRO 41 -2.987 -5.056 -4.707
348 HD3 PRO 41 HD3 PRO 41 -3.413 -3.534 -3.896
349 H ALA 42 H ALA 42 -4.065 -6.757 -5.936
350 HA ALA 42 HA ALA 42 -5.907 -8.947 -5.842
351 HB1 ALA 42 HB1 ALA 42 -4.470 -8.457 -8.448
352 HB2 ALA 42 HB2 ALA 42 -6.197 -8.224 -8.178
353 HB3 ALA 42 HB3 ALA 42 -5.495 -9.838 -8.060
354 H ILE 43 H ILE 43 -3.352 -7.864 -4.674
355 HA ILE 43 HA ILE 43 -1.738 -10.300 -4.959
356 HB ILE 43 HB ILE 43 0.309 -8.778 -4.675
357 HG12 ILE 43 HG12 ILE 43 -1.593 -6.734 -5.829
358 HG13 ILE 43 HG13 ILE 43 -1.089 -6.748 -4.145
359 HG21 ILE 43 HG21 ILE 43 0.483 -8.403 -7.096
360 HG22 ILE 43 HG22 ILE 43 -1.241 -8.735 -7.262
361 HG23 ILE 43 HG23 ILE 43 -0.146 -10.006 -6.717
362 HD11 ILE 43 HD11 ILE 43 1.225 -6.406 -4.842
363 HD12 ILE 43 HD12 ILE 43 0.171 -5.132 -5.457
364 HD13 ILE 43 HD13 ILE 43 0.718 -6.421 -6.530
365 H GLY 44 H GLY 44 -3.660 -9.168 -2.926
366 HA2 GLY 44 HA2 GLY 44 -2.086 -8.343 -0.678
367 HA3 GLY 44 HA3 GLY 44 -3.788 -8.779 -0.656
368 H SER 45 H SER 45 -2.737 -11.373 -2.054
369 HA SER 45 HA SER 45 -2.623 -12.886 0.398
370 HB2 SER 45 HB2 SER 45 -2.383 -13.952 -2.414
371 HB3 SER 45 HB3 SER 45 -2.978 -14.790 -0.978
372 HG SER 45 HG SER 45 -4.768 -14.156 -2.126
373 H LEU 46 H LEU 46 -0.332 -11.242 -1.182
374 HA LEU 46 HA LEU 46 1.762 -13.260 -1.124
375 HB2 LEU 46 HB2 LEU 46 1.622 -10.402 -2.024
376 HB3 LEU 46 HB3 LEU 46 3.176 -11.163 -1.748
377 HG LEU 46 HG LEU 46 2.606 -12.883 -3.436
378 HD11 LEU 46 HD11 LEU 46 0.166 -12.778 -3.277
379 HD12 LEU 46 HD12 LEU 46 0.724 -12.540 -4.933
380 HD13 LEU 46 HD13 LEU 46 0.194 -11.158 -3.974
381 HD21 LEU 46 HD21 LEU 46 2.449 -10.026 -4.368
382 HD22 LEU 46 HD22 LEU 46 2.855 -11.414 -5.376
383 HD23 LEU 46 HD23 LEU 46 3.921 -10.945 -4.050
384 H LYS 47 H LYS 47 3.585 -13.144 0.214
385 HA LYS 47 HA LYS 47 3.153 -11.993 2.806
386 HB2 LYS 47 HB2 LYS 47 4.654 -14.086 1.861
387 HB3 LYS 47 HB3 LYS 47 5.884 -12.862 2.145
388 HG2 LYS 47 HG2 LYS 47 5.736 -14.150 4.117
389 HG3 LYS 47 HG3 LYS 47 4.945 -12.609 4.462
390 HD2 LYS 47 HD2 LYS 47 3.636 -14.473 5.345
391 HD3 LYS 47 HD3 LYS 47 2.759 -13.644 4.056
392 HE2 LYS 47 HE2 LYS 47 3.394 -15.362 2.474
393 HE3 LYS 47 HE3 LYS 47 4.379 -16.160 3.697
394 HZ1 LYS 47 HZ1 LYS 47 2.353 -16.562 4.984
395 HZ2 LYS 47 HZ2 LYS 47 2.276 -17.280 3.456
396 HZ3 LYS 47 HZ3 LYS 47 1.421 -15.848 3.757
397 H VAL 48 H VAL 48 4.920 -10.635 3.826
398 HA VAL 48 HA VAL 48 5.161 -8.211 2.398
399 HB VAL 48 HB VAL 48 6.782 -8.997 4.824
400 HG11 VAL 48 HG11 VAL 48 7.503 -6.939 3.726
401 HG12 VAL 48 HG12 VAL 48 6.780 -6.603 5.299
402 HG13 VAL 48 HG13 VAL 48 5.859 -6.305 3.825
403 HG21 VAL 48 HG21 VAL 48 4.439 -9.442 5.272
404 HG22 VAL 48 HG22 VAL 48 4.003 -7.832 4.700
405 HG23 VAL 48 HG23 VAL 48 4.968 -8.016 6.163
406 H GLU 49 H GLU 49 7.191 -10.998 2.606
407 HA GLU 49 HA GLU 49 9.576 -9.766 1.587
408 HB2 GLU 49 HB2 GLU 49 8.815 -12.688 1.517
409 HB3 GLU 49 HB3 GLU 49 10.433 -12.008 1.436
410 HG2 GLU 49 HG2 GLU 49 10.434 -11.441 3.703
411 HG3 GLU 49 HG3 GLU 49 8.682 -11.619 3.836
412 H ASP 50 H ASP 50 6.717 -11.216 0.262
413 HA ASP 50 HA ASP 50 7.924 -11.721 -2.322
414 HB2 ASP 50 HB2 ASP 50 5.148 -12.209 -1.248
415 HB3 ASP 50 HB3 ASP 50 5.618 -12.556 -2.908
416 H VAL 51 H VAL 51 6.048 -9.258 -0.799
417 HA VAL 51 HA VAL 51 5.149 -8.118 -3.280
418 HB VAL 51 HB VAL 51 3.790 -7.708 -1.330
419 HG11 VAL 51 HG11 VAL 51 5.498 -7.795 0.397
420 HG12 VAL 51 HG12 VAL 51 4.525 -6.331 0.542
421 HG13 VAL 51 HG13 VAL 51 6.145 -6.249 -0.151
422 HG21 VAL 51 HG21 VAL 51 5.118 -5.172 -2.272
423 HG22 VAL 51 HG22 VAL 51 3.555 -5.273 -1.460
424 HG23 VAL 51 HG23 VAL 51 3.772 -6.002 -3.053
425 H LYS 52 H LYS 52 7.136 -8.201 -4.309
426 HA LYS 52 HA LYS 52 9.462 -6.802 -3.602
427 HB2 LYS 52 HB2 LYS 52 8.550 -7.343 -6.424
428 HB3 LYS 52 HB3 LYS 52 10.193 -7.304 -5.806
429 HG2 LYS 52 HG2 LYS 52 9.866 -9.360 -4.623
430 HG3 LYS 52 HG3 LYS 52 8.154 -9.368 -5.014
431 HD2 LYS 52 HD2 LYS 52 8.674 -9.666 -7.367
432 HD3 LYS 52 HD3 LYS 52 10.402 -9.571 -7.016
433 HE2 LYS 52 HE2 LYS 52 10.275 -11.583 -5.678
434 HE3 LYS 52 HE3 LYS 52 8.529 -11.657 -5.900
435 HZ1 LYS 52 HZ1 LYS 52 10.535 -11.872 -8.083
436 HZ2 LYS 52 HZ2 LYS 52 8.855 -12.025 -8.245
437 HZ3 LYS 52 HZ3 LYS 52 9.726 -13.179 -7.368
438 HA PRO 53 HA PRO 53 8.724 -2.515 -4.731
439 HB2 PRO 53 HB2 PRO 53 11.162 -2.756 -6.427
440 HB3 PRO 53 HB3 PRO 53 10.777 -1.570 -5.173
441 HG2 PRO 53 HG2 PRO 53 12.527 -3.518 -4.703
442 HG3 PRO 53 HG3 PRO 53 11.382 -3.002 -3.451
443 HD2 PRO 53 HD2 PRO 53 11.326 -5.432 -5.188
444 HD3 PRO 53 HD3 PRO 53 10.861 -5.253 -3.484
445 H ARG 54 H ARG 54 9.545 -4.890 -7.162
446 HA ARG 54 HA ARG 54 8.658 -3.674 -9.486
447 HB2 ARG 54 HB2 ARG 54 9.782 -5.838 -9.456
448 HB3 ARG 54 HB3 ARG 54 8.417 -6.562 -8.622
449 HG2 ARG 54 HG2 ARG 54 7.014 -6.029 -10.616
450 HG3 ARG 54 HG3 ARG 54 8.492 -5.527 -11.443
451 HD2 ARG 54 HD2 ARG 54 9.444 -7.741 -11.112
452 HD3 ARG 54 HD3 ARG 54 7.996 -8.249 -10.250
453 HE ARG 54 HE ARG 54 8.175 -7.676 -13.135
454 HH11 ARG 54 HH11 ARG 54 6.447 -8.985 -10.394
455 HH12 ARG 54 HH12 ARG 54 5.293 -9.852 -11.353
456 HH21 ARG 54 HH21 ARG 54 6.697 -8.865 -14.418
457 HH22 ARG 54 HH22 ARG 54 5.455 -9.805 -13.645
458 H HIS 55 H HIS 55 6.833 -5.247 -6.915
459 HA HIS 55 HA HIS 55 4.335 -5.184 -8.315
460 HB2 HIS 55 HB2 HIS 55 4.856 -5.571 -5.362
461 HB3 HIS 55 HB3 HIS 55 3.320 -5.849 -6.177
462 HD1 HIS 55 HD1 HIS 55 5.057 -7.188 -8.685
463 HD2 HIS 55 HD2 HIS 55 4.839 -8.330 -4.687
464 HE1 HIS 55 HE1 HIS 55 5.893 -9.571 -8.590
465 HE2 HIS 55 HE2 HIS 55 5.569 -10.296 -6.207
466 H ILE 56 H ILE 56 5.967 -3.131 -5.994
467 HA ILE 56 HA ILE 56 3.924 -1.274 -5.527
468 HB ILE 56 HB ILE 56 6.877 -0.662 -5.797
469 HG12 ILE 56 HG12 ILE 56 6.566 -2.498 -4.225
470 HG13 ILE 56 HG13 ILE 56 6.982 -1.030 -3.350
471 HG21 ILE 56 HG21 ILE 56 5.476 1.326 -5.742
472 HG22 ILE 56 HG22 ILE 56 6.401 1.177 -4.248
473 HG23 ILE 56 HG23 ILE 56 4.690 0.749 -4.273
474 HD11 ILE 56 HD11 ILE 56 5.246 -2.279 -2.202
475 HD12 ILE 56 HD12 ILE 56 4.217 -2.188 -3.633
476 HD13 ILE 56 HD13 ILE 56 4.637 -0.717 -2.754
477 H ASP 57 H ASP 57 6.263 -1.613 -8.140
478 HA ASP 57 HA ASP 57 5.390 0.637 -9.649
479 HB2 ASP 57 HB2 ASP 57 7.588 -0.353 -10.015
480 HB3 ASP 57 HB3 ASP 57 6.855 -1.880 -10.486
481 H ASP 58 H ASP 58 4.566 -2.794 -9.618
482 HA ASP 58 HA ASP 58 2.892 -2.920 -11.843
483 HB2 ASP 58 HB2 ASP 58 2.746 -4.450 -9.233
484 HB3 ASP 58 HB3 ASP 58 1.728 -4.812 -10.619
485 H VAL 59 H VAL 59 2.039 -2.144 -8.467
486 HA VAL 59 HA VAL 59 -0.718 -1.834 -9.057
487 HB VAL 59 HB VAL 59 0.020 -2.310 -6.776
488 HG11 VAL 59 HG11 VAL 59 2.064 -1.010 -6.691
489 HG12 VAL 59 HG12 VAL 59 0.990 -0.556 -5.366
490 HG13 VAL 59 HG13 VAL 59 1.135 0.488 -6.780
491 HG21 VAL 59 HG21 VAL 59 -2.159 -1.296 -7.100
492 HG22 VAL 59 HG22 VAL 59 -1.442 0.314 -7.034
493 HG23 VAL 59 HG23 VAL 59 -1.429 -0.714 -5.602
494 H LEU 60 H LEU 60 1.988 0.446 -8.912
495 HA LEU 60 HA LEU 60 0.512 2.821 -9.105
496 HB2 LEU 60 HB2 LEU 60 3.289 2.139 -10.049
497 HB3 LEU 60 HB3 LEU 60 2.620 3.755 -10.139
498 HG LEU 60 HG LEU 60 3.074 2.181 -7.607
499 HD11 LEU 60 HD11 LEU 60 5.144 2.927 -8.642
500 HD12 LEU 60 HD12 LEU 60 4.812 3.854 -7.178
501 HD13 LEU 60 HD13 LEU 60 4.511 4.567 -8.762
502 HD21 LEU 60 HD21 LEU 60 2.085 5.001 -8.025
503 HD22 LEU 60 HD22 LEU 60 2.470 4.266 -6.470
504 HD23 LEU 60 HD23 LEU 60 1.131 3.642 -7.432
505 H LYS 61 H LYS 61 2.047 0.909 -11.685
506 HA LYS 61 HA LYS 61 1.302 2.585 -13.793
507 HB2 LYS 61 HB2 LYS 61 1.820 0.685 -15.256
508 HB3 LYS 61 HB3 LYS 61 3.035 0.873 -14.004
509 HG2 LYS 61 HG2 LYS 61 1.903 -0.941 -12.734
510 HG3 LYS 61 HG3 LYS 61 0.840 -1.179 -14.123
511 HD2 LYS 61 HD2 LYS 61 2.854 -1.586 -15.521
512 HD3 LYS 61 HD3 LYS 61 3.842 -1.481 -14.064
513 HE2 LYS 61 HE2 LYS 61 2.516 -3.350 -13.104
514 HE3 LYS 61 HE3 LYS 61 1.681 -3.496 -14.650
515 HZ1 LYS 61 HZ1 LYS 61 4.583 -3.891 -14.153
516 HZ2 LYS 61 HZ2 LYS 61 3.867 -3.899 -15.688
517 HZ3 LYS 61 HZ3 LYS 61 3.448 -5.083 -14.552
518 H ALA 62 H ALA 62 -0.458 0.022 -12.184
519 HA ALA 62 HA ALA 62 -2.562 -0.019 -14.167
520 HB1 ALA 62 HB1 ALA 62 -2.488 -1.335 -11.452
521 HB2 ALA 62 HB2 ALA 62 -1.899 -2.058 -12.948
522 HB3 ALA 62 HB3 ALA 62 -3.612 -1.684 -12.764
523 H VAL 63 H VAL 63 -2.112 1.365 -10.916
524 HA VAL 63 HA VAL 63 -4.896 2.090 -10.761
525 HB VAL 63 HB VAL 63 -3.482 1.551 -8.749
526 HG11 VAL 63 HG11 VAL 63 -2.413 4.328 -9.211
527 HG12 VAL 63 HG12 VAL 63 -1.495 2.820 -9.242
528 HG13 VAL 63 HG13 VAL 63 -2.208 3.389 -7.731
529 HG21 VAL 63 HG21 VAL 63 -4.575 3.230 -7.319
530 HG22 VAL 63 HG22 VAL 63 -5.668 2.539 -8.516
531 HG23 VAL 63 HG23 VAL 63 -5.001 4.152 -8.761
532 H MET 64 H MET 64 -1.963 3.632 -11.850
533 HA MET 64 HA MET 64 -2.899 6.298 -11.872
534 HB2 MET 64 HB2 MET 64 -0.842 4.893 -13.575
535 HB3 MET 64 HB3 MET 64 -1.194 6.607 -13.729
536 HG2 MET 64 HG2 MET 64 -0.560 6.926 -11.378
537 HG3 MET 64 HG3 MET 64 -0.150 5.215 -11.278
538 HE1 MET 64 HE1 MET 64 1.896 7.505 -10.474
539 HE2 MET 64 HE2 MET 64 3.374 6.912 -11.231
540 HE3 MET 64 HE3 MET 64 2.287 5.786 -10.418
541 H LYS 65 H LYS 65 -3.123 3.683 -14.238
542 HA LYS 65 HA LYS 65 -4.283 5.339 -16.253
543 HB2 LYS 65 HB2 LYS 65 -4.734 3.173 -17.419
544 HB3 LYS 65 HB3 LYS 65 -3.061 3.431 -16.981
545 HG2 LYS 65 HG2 LYS 65 -3.064 1.757 -15.433
546 HG3 LYS 65 HG3 LYS 65 -4.799 1.884 -15.140
547 HD2 LYS 65 HD2 LYS 65 -3.554 0.829 -17.677
548 HD3 LYS 65 HD3 LYS 65 -4.156 -0.177 -16.356
549 HE2 LYS 65 HE2 LYS 65 -6.394 0.743 -16.657
550 HE3 LYS 65 HE3 LYS 65 -5.804 1.792 -17.946
551 HZ1 LYS 65 HZ1 LYS 65 -6.896 -0.168 -18.827
552 HZ2 LYS 65 HZ2 LYS 65 -5.812 -1.178 -17.999
553 HZ3 LYS 65 HZ3 LYS 65 -5.253 -0.168 -19.240
554 H ARG 66 H ARG 66 -5.600 2.861 -14.078
555 HA ARG 66 HA ARG 66 -8.246 3.174 -15.130
556 HB2 ARG 66 HB2 ARG 66 -8.928 1.515 -13.532
557 HB3 ARG 66 HB3 ARG 66 -7.392 1.024 -14.232
558 HG2 ARG 66 HG2 ARG 66 -6.254 1.914 -12.215
559 HG3 ARG 66 HG3 ARG 66 -7.844 2.225 -11.511
560 HD2 ARG 66 HD2 ARG 66 -7.019 0.130 -10.682
561 HD3 ARG 66 HD3 ARG 66 -8.368 -0.188 -11.770
562 HE ARG 66 HE ARG 66 -5.753 -0.308 -13.001
563 HH11 ARG 66 HH11 ARG 66 -8.298 -2.078 -11.396
564 HH12 ARG 66 HH12 ARG 66 -7.790 -3.624 -11.995
565 HH21 ARG 66 HH21 ARG 66 -5.063 -2.359 -13.797
566 HH22 ARG 66 HH22 ARG 66 -5.941 -3.787 -13.346
567 H GLY 67 H GLY 67 -6.456 4.694 -12.615
568 HA2 GLY 67 HA2 GLY 67 -8.950 5.935 -11.636
569 HA3 GLY 67 HA3 GLY 67 -7.559 5.623 -10.607
570 H ALA 68 H ALA 68 -5.937 7.064 -10.506
571 HA ALA 68 HA ALA 68 -5.585 9.162 -12.433
572 HB1 ALA 68 HB1 ALA 68 -6.105 11.023 -10.940
573 HB2 ALA 68 HB2 ALA 68 -6.650 9.890 -9.702
574 HB3 ALA 68 HB3 ALA 68 -7.534 10.027 -11.222
575 HA PRO 69 HA PRO 69 -1.506 8.888 -10.725
576 HB2 PRO 69 HB2 PRO 69 -0.606 11.421 -11.288
577 HB3 PRO 69 HB3 PRO 69 -0.687 10.113 -12.473
578 HG2 PRO 69 HG2 PRO 69 -2.596 12.367 -12.005
579 HG3 PRO 69 HG3 PRO 69 -2.025 11.681 -13.538
580 HD2 PRO 69 HD2 PRO 69 -4.447 11.088 -12.526
581 HD3 PRO 69 HD3 PRO 69 -3.485 9.891 -13.423
582 H SER 70 H SER 70 -3.617 11.532 -9.844
583 HA SER 70 HA SER 70 -2.113 12.700 -7.792
584 HB2 SER 70 HB2 SER 70 -5.118 12.575 -7.727
585 HB3 SER 70 HB3 SER 70 -4.054 13.920 -7.309
586 HG SER 70 HG SER 70 -3.499 14.009 -9.587
587 H ILE 71 H ILE 71 -4.635 10.168 -7.620
588 HA ILE 71 HA ILE 71 -4.223 9.819 -4.805
589 HB ILE 71 HB ILE 71 -5.685 7.798 -5.058
590 HG12 ILE 71 HG12 ILE 71 -7.039 7.990 -7.337
591 HG13 ILE 71 HG13 ILE 71 -5.501 8.602 -7.932
592 HG21 ILE 71 HG21 ILE 71 -7.731 9.114 -5.477
593 HG22 ILE 71 HG22 ILE 71 -6.727 10.437 -6.072
594 HG23 ILE 71 HG23 ILE 71 -6.600 9.922 -4.391
595 HD11 ILE 71 HD11 ILE 71 -5.715 6.227 -8.349
596 HD12 ILE 71 HD12 ILE 71 -5.951 5.925 -6.627
597 HD13 ILE 71 HD13 ILE 71 -4.406 6.543 -7.211
598 H ALA 72 H ALA 72 -2.895 8.510 -7.703
599 HA ALA 72 HA ALA 72 -1.930 6.054 -6.721
600 HB1 ALA 72 HB1 ALA 72 -2.137 6.560 -9.108
601 HB2 ALA 72 HB2 ALA 72 -0.509 6.025 -8.692
602 HB3 ALA 72 HB3 ALA 72 -0.831 7.738 -8.966
603 H ASN 73 H ASN 73 -0.353 9.266 -6.975
604 HA ASN 73 HA ASN 73 2.113 8.328 -5.914
605 HB2 ASN 73 HB2 ASN 73 2.802 10.623 -5.747
606 HB3 ASN 73 HB3 ASN 73 1.895 10.446 -7.242
607 HD21 ASN 73 HD21 ASN 73 1.810 11.692 -3.975
608 HD22 ASN 73 HD22 ASN 73 0.511 12.802 -4.217
609 H ASP 74 H ASP 74 -0.873 9.346 -4.519
610 HA ASP 74 HA ASP 74 0.113 9.882 -1.906
611 HB2 ASP 74 HB2 ASP 74 -2.082 10.696 -2.794
612 HB3 ASP 74 HB3 ASP 74 -2.686 9.046 -2.681
613 H THR 75 H THR 75 -0.920 6.996 -3.602
614 HA THR 75 HA THR 75 -1.131 5.257 -1.417
615 HB THR 75 HB THR 75 -0.147 4.579 -4.200
616 HG1 THR 75 HG1 THR 75 -2.615 3.904 -4.098
617 HG21 THR 75 HG21 THR 75 -1.032 2.349 -3.720
618 HG22 THR 75 HG22 THR 75 -1.482 2.872 -2.097
619 HG23 THR 75 HG23 THR 75 0.219 2.792 -2.558
620 H LEU 76 H LEU 76 1.670 6.291 -3.316
621 HA LEU 76 HA LEU 76 3.566 4.516 -2.270
622 HB2 LEU 76 HB2 LEU 76 3.898 7.311 -3.346
623 HB3 LEU 76 HB3 LEU 76 5.235 6.238 -2.981
624 HG LEU 76 HG LEU 76 3.091 5.718 -5.036
625 HD11 LEU 76 HD11 LEU 76 4.607 7.511 -5.696
626 HD12 LEU 76 HD12 LEU 76 4.895 6.059 -6.655
627 HD13 LEU 76 HD13 LEU 76 5.993 6.480 -5.342
628 HD21 LEU 76 HD21 LEU 76 5.578 4.170 -4.323
629 HD22 LEU 76 HD22 LEU 76 4.500 3.817 -5.674
630 HD23 LEU 76 HD23 LEU 76 3.917 3.666 -4.016
631 H ARG 77 H ARG 77 2.685 7.790 -1.201
632 HA ARG 77 HA ARG 77 4.606 7.910 0.870
633 HB2 ARG 77 HB2 ARG 77 3.350 9.840 1.711
634 HB3 ARG 77 HB3 ARG 77 3.603 9.939 -0.025
635 HG2 ARG 77 HG2 ARG 77 1.277 8.991 -0.281
636 HG3 ARG 77 HG3 ARG 77 1.075 9.288 1.446
637 HD2 ARG 77 HD2 ARG 77 1.811 11.372 -0.604
638 HD3 ARG 77 HD3 ARG 77 0.192 11.112 0.038
639 HE ARG 77 HE ARG 77 2.485 11.989 1.674
640 HH11 ARG 77 HH11 ARG 77 -0.934 11.973 0.887
641 HH12 ARG 77 HH12 ARG 77 -1.338 13.190 2.067
642 HH21 ARG 77 HH21 ARG 77 1.951 13.566 3.254
643 HH22 ARG 77 HH22 ARG 77 0.297 14.079 3.419
644 H TRP 78 H TRP 78 1.353 6.636 0.728
645 HA TRP 78 HA TRP 78 1.126 6.211 3.550
646 HB2 TRP 78 HB2 TRP 78 -0.808 6.421 1.939
647 HB3 TRP 78 HB3 TRP 78 -0.403 4.814 1.349
648 HD1 TRP 78 HD1 TRP 78 -1.700 2.918 2.470
649 HE1 TRP 78 HE1 TRP 78 -3.003 2.622 4.670
650 HE3 TRP 78 HE3 TRP 78 -0.686 7.440 4.636
651 HZ2 TRP 78 HZ2 TRP 78 -3.522 4.097 7.013
652 HZ3 TRP 78 HZ3 TRP 78 -1.623 7.915 6.862
653 HH2 TRP 78 HH2 TRP 78 -3.012 6.276 8.023
654 H LEU 79 H LEU 79 2.145 4.269 0.776
655 HA LEU 79 HA LEU 79 2.376 1.808 2.154
656 HB2 LEU 79 HB2 LEU 79 3.730 2.769 -0.361
657 HB3 LEU 79 HB3 LEU 79 3.818 1.124 0.236
658 HG LEU 79 HG LEU 79 1.324 2.554 -0.660
659 HD11 LEU 79 HD11 LEU 79 2.885 0.291 -1.900
660 HD12 LEU 79 HD12 LEU 79 2.786 1.944 -2.506
661 HD13 LEU 79 HD13 LEU 79 1.347 0.922 -2.489
662 HD21 LEU 79 HD21 LEU 79 0.871 0.996 1.171
663 HD22 LEU 79 HD22 LEU 79 1.697 -0.287 0.286
664 HD23 LEU 79 HD23 LEU 79 0.206 0.405 -0.353
665 H LYS 80 H LYS 80 4.737 4.375 1.468
666 HA LYS 80 HA LYS 80 7.014 3.044 2.397
667 HB2 LYS 80 HB2 LYS 80 8.046 5.221 2.720
668 HB3 LYS 80 HB3 LYS 80 7.120 5.220 1.226
669 HG2 LYS 80 HG2 LYS 80 5.439 6.565 2.139
670 HG3 LYS 80 HG3 LYS 80 5.973 6.264 3.791
671 HD2 LYS 80 HD2 LYS 80 6.618 8.486 3.182
672 HD3 LYS 80 HD3 LYS 80 8.071 7.493 3.273
673 HE2 LYS 80 HE2 LYS 80 8.109 7.283 0.854
674 HE3 LYS 80 HE3 LYS 80 6.608 8.204 0.733
675 HZ1 LYS 80 HZ1 LYS 80 7.736 10.113 1.691
676 HZ2 LYS 80 HZ2 LYS 80 8.547 9.594 0.291
677 HZ3 LYS 80 HZ3 LYS 80 9.176 9.227 1.823
678 H ARG 81 H ARG 81 4.501 4.752 4.145
679 HA ARG 81 HA ARG 81 5.719 4.594 6.718
680 HB2 ARG 81 HB2 ARG 81 2.840 4.944 5.870
681 HB3 ARG 81 HB3 ARG 81 3.389 5.041 7.534
682 HG2 ARG 81 HG2 ARG 81 4.678 7.001 7.066
683 HG3 ARG 81 HG3 ARG 81 4.366 6.845 5.333
684 HD2 ARG 81 HD2 ARG 81 2.044 7.302 5.634
685 HD3 ARG 81 HD3 ARG 81 2.190 7.195 7.386
686 HE ARG 81 HE ARG 81 3.828 9.224 6.887
687 HH11 ARG 81 HH11 ARG 81 0.642 8.567 5.584
688 HH12 ARG 81 HH12 ARG 81 0.198 10.245 5.479
689 HH21 ARG 81 HH21 ARG 81 3.242 11.427 6.750
690 HH22 ARG 81 HH22 ARG 81 1.678 11.866 6.132
691 H MET 82 H MET 82 3.444 2.624 4.912
692 HA MET 82 HA MET 82 2.717 0.835 6.955
693 HB2 MET 82 HB2 MET 82 1.476 1.154 4.844
694 HB3 MET 82 HB3 MET 82 2.791 0.384 3.969
695 HG2 MET 82 HG2 MET 82 2.390 -1.686 5.219
696 HG3 MET 82 HG3 MET 82 1.046 -0.905 6.052
697 HE1 MET 82 HE1 MET 82 -1.093 0.086 4.728
698 HE2 MET 82 HE2 MET 82 -1.335 -0.123 2.993
699 HE3 MET 82 HE3 MET 82 -0.034 0.911 3.583
700 H PHE 83 H PHE 83 5.180 0.575 4.400
701 HA PHE 83 HA PHE 83 6.112 -1.969 5.278
702 HB2 PHE 83 HB2 PHE 83 7.265 0.120 3.442
703 HB3 PHE 83 HB3 PHE 83 8.153 -1.346 3.850
704 HD1 PHE 83 HD1 PHE 83 7.242 -3.554 3.213
705 HD2 PHE 83 HD2 PHE 83 5.456 0.078 1.903
706 HE1 PHE 83 HE1 PHE 83 6.024 -4.786 1.467
707 HE2 PHE 83 HE2 PHE 83 4.237 -1.147 0.151
708 HZ PHE 83 HZ PHE 83 4.519 -3.583 -0.066
709 H ASN 84 H ASN 84 7.007 1.346 6.054
710 HA ASN 84 HA ASN 84 9.344 0.808 7.511
711 HB2 ASN 84 HB2 ASN 84 8.883 3.077 7.031
712 HB3 ASN 84 HB3 ASN 84 7.264 2.980 7.717
713 HD21 ASN 84 HD21 ASN 84 10.686 3.060 8.457
714 HD22 ASN 84 HD22 ASN 84 10.501 3.612 10.088
715 H TYR 85 H TYR 85 5.967 0.812 8.416
716 HA TYR 85 HA TYR 85 6.110 0.274 11.127
717 HB2 TYR 85 HB2 TYR 85 4.043 0.813 9.944
718 HB3 TYR 85 HB3 TYR 85 4.117 -0.711 9.075
719 HD1 TYR 85 HD1 TYR 85 4.176 0.432 12.646
720 HD2 TYR 85 HD2 TYR 85 2.656 -2.319 9.780
721 HE1 TYR 85 HE1 TYR 85 2.778 -0.602 14.385
722 HE2 TYR 85 HE2 TYR 85 1.261 -3.363 11.512
723 HH TYR 85 HH TYR 85 1.021 -3.569 13.814
724 H ALA 86 H ALA 86 6.525 -1.889 8.389
725 HA ALA 86 HA ALA 86 6.448 -4.324 9.827
726 HB1 ALA 86 HB1 ALA 86 7.469 -5.320 7.854
727 HB2 ALA 86 HB2 ALA 86 7.837 -3.715 7.221
728 HB3 ALA 86 HB3 ALA 86 6.159 -4.228 7.402
729 H ILE 87 H ILE 87 9.083 -2.115 8.978
730 HA ILE 87 HA ILE 87 11.194 -3.744 9.955
731 HB ILE 87 HB ILE 87 10.993 -0.781 9.433
732 HG12 ILE 87 HG12 ILE 87 12.749 -1.308 7.741
733 HG13 ILE 87 HG13 ILE 87 12.608 -3.005 8.171
734 HG21 ILE 87 HG21 ILE 87 13.438 -2.219 10.456
735 HG22 ILE 87 HG22 ILE 87 12.464 -1.067 11.369
736 HG23 ILE 87 HG23 ILE 87 13.355 -0.533 9.944
737 HD11 ILE 87 HD11 ILE 87 10.437 -1.302 6.983
738 HD12 ILE 87 HD12 ILE 87 10.304 -3.012 7.395
739 HD13 ILE 87 HD13 ILE 87 11.415 -2.493 6.127
740 H LYS 88 H LYS 88 9.156 -1.284 11.425
741 HA LYS 88 HA LYS 88 10.384 -1.130 13.951
742 HB2 LYS 88 HB2 LYS 88 7.434 -0.920 13.360
743 HB3 LYS 88 HB3 LYS 88 8.294 -0.217 14.723
744 HG2 LYS 88 HG2 LYS 88 9.384 1.355 13.351
745 HG3 LYS 88 HG3 LYS 88 8.881 0.519 11.879
746 HD2 LYS 88 HD2 LYS 88 7.559 2.541 12.320
747 HD3 LYS 88 HD3 LYS 88 6.575 1.084 12.300
748 HE2 LYS 88 HE2 LYS 88 6.322 1.076 14.611
749 HE3 LYS 88 HE3 LYS 88 7.683 2.164 14.856
750 HZ1 LYS 88 HZ1 LYS 88 5.698 3.387 15.210
751 HZ2 LYS 88 HZ2 LYS 88 5.005 2.838 13.763
752 HZ3 LYS 88 HZ3 LYS 88 6.327 3.903 13.722
753 H ARG 89 H ARG 89 7.703 -3.083 12.783
754 HA ARG 89 HA ARG 89 7.421 -4.664 15.125
755 HB2 ARG 89 HB2 ARG 89 6.589 -5.178 12.269
756 HB3 ARG 89 HB3 ARG 89 6.156 -6.224 13.614
757 HG2 ARG 89 HG2 ARG 89 5.409 -3.320 13.351
758 HG3 ARG 89 HG3 ARG 89 4.354 -4.693 13.017
759 HD2 ARG 89 HD2 ARG 89 4.631 -5.432 15.357
760 HD3 ARG 89 HD3 ARG 89 5.595 -3.990 15.669
761 HE ARG 89 HE ARG 89 2.991 -3.433 14.583
762 HH11 ARG 89 HH11 ARG 89 4.808 -4.030 17.508
763 HH12 ARG 89 HH12 ARG 89 3.665 -3.222 18.541
764 HH21 ARG 89 HH21 ARG 89 1.489 -2.369 15.905
765 HH22 ARG 89 HH22 ARG 89 1.778 -2.245 17.617
766 H HIS 90 H HIS 90 9.866 -4.606 12.875
767 HA HIS 90 HA HIS 90 11.740 -5.831 12.567
768 HB2 HIS 90 HB2 HIS 90 11.502 -6.080 15.117
769 HB3 HIS 90 HB3 HIS 90 10.874 -7.690 14.777
770 HD1 HIS 90 HD1 HIS 90 12.656 -9.384 15.100
771 HD2 HIS 90 HD2 HIS 90 14.159 -5.837 13.531
772 HE1 HIS 90 HE1 HIS 90 15.127 -9.753 14.827
773 HE2 HIS 90 HE2 HIS 90 16.007 -7.628 13.800
774 H ILE 91 H ILE 91 9.164 -6.481 11.305
775 HA ILE 91 HA ILE 91 9.067 -9.299 10.838
776 HB ILE 91 HB ILE 91 8.079 -7.109 9.003
777 HG12 ILE 91 HG12 ILE 91 6.499 -8.463 11.193
778 HG13 ILE 91 HG13 ILE 91 7.296 -6.908 11.409
779 HG21 ILE 91 HG21 ILE 91 7.181 -9.966 9.381
780 HG22 ILE 91 HG22 ILE 91 8.114 -9.344 8.020
781 HG23 ILE 91 HG23 ILE 91 6.459 -8.794 8.277
782 HD11 ILE 91 HD11 ILE 91 5.143 -7.529 9.407
783 HD12 ILE 91 HD12 ILE 91 5.948 -5.971 9.605
784 HD13 ILE 91 HD13 ILE 91 4.950 -6.621 10.906
785 H ILE 92 H ILE 92 10.073 -6.576 8.820
786 HA ILE 92 HA ILE 92 12.332 -8.143 7.802
787 HB ILE 92 HB ILE 92 12.008 -7.278 5.540
788 HG12 ILE 92 HG12 ILE 92 9.391 -6.128 6.540
789 HG13 ILE 92 HG13 ILE 92 10.838 -5.182 6.205
790 HG21 ILE 92 HG21 ILE 92 10.022 -8.550 4.876
791 HG22 ILE 92 HG22 ILE 92 9.516 -8.635 6.563
792 HG23 ILE 92 HG23 ILE 92 11.001 -9.436 6.049
793 HD11 ILE 92 HD11 ILE 92 10.733 -5.867 3.861
794 HD12 ILE 92 HD12 ILE 92 9.266 -5.033 4.375
795 HD13 ILE 92 HD13 ILE 92 9.269 -6.789 4.205
796 H GLU 93 H GLU 93 13.843 -6.507 6.574
797 HA GLU 93 HA GLU 93 13.615 -3.836 7.765
798 HB2 GLU 93 HB2 GLU 93 16.066 -5.590 7.688
799 HB3 GLU 93 HB3 GLU 93 16.145 -3.853 7.967
800 HG2 GLU 93 HG2 GLU 93 14.754 -4.089 9.948
801 HG3 GLU 93 HG3 GLU 93 14.616 -5.821 9.660
802 H TYR 94 H TYR 94 12.875 -4.873 5.211
803 HA TYR 94 HA TYR 94 14.590 -3.230 3.471
804 HB2 TYR 94 HB2 TYR 94 14.649 -5.678 2.942
805 HB3 TYR 94 HB3 TYR 94 12.912 -5.631 2.677
806 HD1 TYR 94 HD1 TYR 94 16.188 -4.706 1.332
807 HD2 TYR 94 HD2 TYR 94 11.991 -4.597 0.674
808 HE1 TYR 94 HE1 TYR 94 16.577 -4.143 -1.032
809 HE2 TYR 94 HE2 TYR 94 12.366 -4.036 -1.687
810 HH TYR 94 HH TYR 94 15.227 -4.436 -3.249
811 H ASN 95 H ASN 95 13.522 -1.680 2.238
812 HA ASN 95 HA ASN 95 10.610 -1.507 2.702
813 HB2 ASN 95 HB2 ASN 95 12.652 0.714 2.585
814 HB3 ASN 95 HB3 ASN 95 10.917 0.995 2.503
815 HD21 ASN 95 HD21 ASN 95 9.671 0.705 4.340
816 HD22 ASN 95 HD22 ASN 95 10.360 0.556 5.915
817 HA PRO 96 HA PRO 96 11.156 -2.105 -1.836
818 HB2 PRO 96 HB2 PRO 96 8.267 -2.719 -1.523
819 HB3 PRO 96 HB3 PRO 96 9.525 -3.637 -2.364
820 HG2 PRO 96 HG2 PRO 96 8.558 -4.459 -0.021
821 HG3 PRO 96 HG3 PRO 96 10.280 -4.628 -0.410
822 HD2 PRO 96 HD2 PRO 96 8.919 -2.628 1.349
823 HD3 PRO 96 HD3 PRO 96 10.475 -3.451 1.576
824 H ALA 97 H ALA 97 8.506 -0.454 -0.150
825 HA ALA 97 HA ALA 97 7.796 1.052 -2.514
826 HB1 ALA 97 HB1 ALA 97 6.072 0.244 -0.963
827 HB2 ALA 97 HB2 ALA 97 6.022 1.995 -1.175
828 HB3 ALA 97 HB3 ALA 97 6.722 1.301 0.289
829 H ALA 98 H ALA 98 10.116 1.413 -0.117
830 HA ALA 98 HA ALA 98 9.957 4.274 0.168
831 HB1 ALA 98 HB1 ALA 98 12.054 4.099 1.384
832 HB2 ALA 98 HB2 ALA 98 12.224 2.418 0.882
833 HB3 ALA 98 HB3 ALA 98 10.906 2.887 1.954
834 H ALA 99 H ALA 99 11.188 2.130 -2.153
835 HA ALA 99 HA ALA 99 13.217 3.887 -3.200
836 HB1 ALA 99 HB1 ALA 99 11.958 1.432 -4.422
837 HB2 ALA 99 HB2 ALA 99 13.423 1.460 -3.441
838 HB3 ALA 99 HB3 ALA 99 13.396 2.263 -5.013
839 H PHE 100 H PHE 100 9.896 3.863 -3.249
840 HA PHE 100 HA PHE 100 9.832 5.462 -5.719
841 HB2 PHE 100 HB2 PHE 100 7.613 3.786 -4.515
842 HB3 PHE 100 HB3 PHE 100 7.440 4.833 -5.917
843 HD1 PHE 100 HD1 PHE 100 8.980 1.738 -4.654
844 HD2 PHE 100 HD2 PHE 100 8.173 4.150 -8.064
845 HE1 PHE 100 HE1 PHE 100 9.635 -0.123 -6.124
846 HE2 PHE 100 HE2 PHE 100 8.830 2.297 -9.537
847 HZ PHE 100 HZ PHE 100 9.562 0.152 -8.568
848 H ASP 101 H ASP 101 10.253 7.402 -4.662
849 HA ASP 101 HA ASP 101 8.440 8.180 -2.496
850 HB2 ASP 101 HB2 ASP 101 10.797 8.571 -2.046
851 HB3 ASP 101 HB3 ASP 101 10.953 9.508 -3.531
852 HA PRO 102 HA PRO 102 6.162 10.469 -5.572
853 HB2 PRO 102 HB2 PRO 102 4.075 11.086 -4.023
854 HB3 PRO 102 HB3 PRO 102 4.337 9.430 -4.588
855 HG2 PRO 102 HG2 PRO 102 5.000 10.651 -1.930
856 HG3 PRO 102 HG3 PRO 102 4.231 9.091 -2.282
857 HD2 PRO 102 HD2 PRO 102 6.886 9.349 -1.706
858 HD3 PRO 102 HD3 PRO 102 6.231 8.067 -2.740
859 H GLY 103 H GLY 103 6.054 12.560 -6.092
860 HA2 GLY 103 HA2 GLY 103 6.848 14.538 -4.069
861 HA3 GLY 103 HA3 GLY 103 7.007 14.747 -5.809
862 H ASP 104 H ASP 104 5.704 16.519 -3.938
863 HA ASP 104 HA ASP 104 2.886 16.242 -4.141
864 HB2 ASP 104 HB2 ASP 104 4.689 18.531 -3.420
865 HB3 ASP 104 HB3 ASP 104 2.963 18.792 -3.638
866 H ALA 105 H ALA 105 2.285 15.882 -6.244
867 HA ALA 105 HA ALA 105 2.845 17.996 -8.196
868 HB1 ALA 105 HB1 ALA 105 3.236 15.703 -8.938
869 HB2 ALA 105 HB2 ALA 105 1.924 16.441 -9.855
870 HB3 ALA 105 HB3 ALA 105 1.560 15.287 -8.573
871 H GLY 106 H GLY 106 0.168 16.229 -6.701
872 HA2 GLY 106 HA2 GLY 106 -1.974 16.889 -6.207
873 HA3 GLY 106 HA3 GLY 106 -1.506 18.531 -6.620
874 H GLY 107 H GLY 107 -1.335 18.996 -8.961
875 HA2 GLY 107 HA2 GLY 107 -2.073 18.207 -11.212
876 HA3 GLY 107 HA3 GLY 107 -3.527 17.636 -10.399
877 H LYS 108 H LYS 108 -3.566 19.936 -8.610
878 HA LYS 108 HA LYS 108 -3.780 22.336 -10.118
879 HB2 LYS 108 HB2 LYS 108 -6.225 22.594 -10.013
880 HB3 LYS 108 HB3 LYS 108 -5.779 21.205 -11.001
881 HG2 LYS 108 HG2 LYS 108 -6.283 19.712 -9.150
882 HG3 LYS 108 HG3 LYS 108 -6.694 21.094 -8.135
883 HD2 LYS 108 HD2 LYS 108 -8.516 21.672 -9.660
884 HD3 LYS 108 HD3 LYS 108 -8.103 20.286 -10.675
885 HE2 LYS 108 HE2 LYS 108 -8.507 18.807 -8.740
886 HE3 LYS 108 HE3 LYS 108 -9.018 20.208 -7.807
887 HZ1 LYS 108 HZ1 LYS 108 -10.870 18.919 -8.779
888 HZ2 LYS 108 HZ2 LYS 108 -10.315 19.334 -10.331
889 HZ3 LYS 108 HZ3 LYS 108 -10.853 20.542 -9.265
890 H LEU 109 H LEU 109 -5.692 23.630 -8.607
891 HA LEU 109 HA LEU 109 -5.354 23.123 -5.817
892 HB2 LEU 109 HB2 LEU 109 -4.320 25.333 -5.306
893 HB3 LEU 109 HB3 LEU 109 -3.243 24.217 -6.118
894 HG LEU 109 HG LEU 109 -4.034 25.529 -8.275
895 HD11 LEU 109 HD11 LEU 109 -5.678 26.925 -7.123
896 HD12 LEU 109 HD12 LEU 109 -4.391 27.899 -7.834
897 HD13 LEU 109 HD13 LEU 109 -4.402 27.585 -6.099
898 HD21 LEU 109 HD21 LEU 109 -2.098 27.003 -8.005
899 HD22 LEU 109 HD22 LEU 109 -1.738 25.355 -7.490
900 HD23 LEU 109 HD23 LEU 109 -2.039 26.609 -6.287
901 H GLU 110 H GLU 110 -6.911 24.212 -4.605
902 HA GLU 110 HA GLU 110 -8.857 25.690 -6.233
903 HB2 GLU 110 HB2 GLU 110 -9.255 23.958 -3.797
904 HB3 GLU 110 HB3 GLU 110 -10.511 25.003 -4.451
905 HG2 GLU 110 HG2 GLU 110 -10.398 23.804 -6.576
906 HG3 GLU 110 HG3 GLU 110 -9.152 22.750 -5.907
907 H HIS 111 H HIS 111 -9.046 27.744 -5.877
908 HA HIS 111 HA HIS 111 -8.660 28.749 -3.153
909 HB2 HIS 111 HB2 HIS 111 -7.531 30.764 -4.010
910 HB3 HIS 111 HB3 HIS 111 -6.619 29.303 -4.348
911 HD1 HIS 111 HD1 HIS 111 -7.549 28.390 -7.018
912 HD2 HIS 111 HD2 HIS 111 -7.224 32.425 -6.078
913 HE1 HIS 111 HE1 HIS 111 -7.284 29.575 -9.216
914 HE2 HIS 111 HE2 HIS 111 -6.853 31.980 -8.598
915 H HIS 112 H HIS 112 -10.711 28.998 -2.678
916 HA HIS 112 HA HIS 112 -12.758 29.761 -4.436
917 HB2 HIS 112 HB2 HIS 112 -14.129 30.096 -2.378
918 HB3 HIS 112 HB3 HIS 112 -13.320 28.537 -2.451
919 HD1 HIS 112 HD1 HIS 112 -13.247 31.816 -0.590
920 HD2 HIS 112 HD2 HIS 112 -11.487 28.051 -0.430
921 HE1 HIS 112 HE1 HIS 112 -12.097 31.698 1.638
922 HE2 HIS 112 HE2 HIS 112 -10.898 29.479 1.643
923 H HIS 113 H HIS 113 -13.736 31.629 -4.904
924 HA HIS 113 HA HIS 113 -12.896 34.101 -3.646
925 HB2 HIS 113 HB2 HIS 113 -11.132 33.819 -5.269
926 HB3 HIS 113 HB3 HIS 113 -12.291 33.452 -6.539
927 HD1 HIS 113 HD1 HIS 113 -11.115 36.357 -4.407
928 HD2 HIS 113 HD2 HIS 113 -13.169 35.614 -7.947
929 HE1 HIS 113 HE1 HIS 113 -11.381 38.597 -5.528
930 HE2 HIS 113 HE2 HIS 113 -12.432 38.080 -7.763
931 H HIS 114 H HIS 114 -15.046 34.342 -3.067
932 HA HIS 114 HA HIS 114 -16.510 36.040 -4.655
933 HB2 HIS 114 HB2 HIS 114 -18.361 34.860 -5.528
934 HB3 HIS 114 HB3 HIS 114 -16.954 33.936 -6.018
935 HD1 HIS 114 HD1 HIS 114 -20.208 33.565 -4.567
936 HD2 HIS 114 HD2 HIS 114 -16.577 31.561 -4.241
937 HE1 HIS 114 HE1 HIS 114 -20.767 31.305 -3.612
938 HE2 HIS 114 HE2 HIS 114 -18.588 30.036 -3.646
939 H HIS 115 H HIS 115 -16.440 33.706 -2.085
940 HA HIS 115 HA HIS 115 -17.878 35.482 -0.321
941 HB2 HIS 115 HB2 HIS 115 -19.714 34.273 -1.486
942 HB3 HIS 115 HB3 HIS 115 -19.032 32.747 -0.947
943 HD1 HIS 115 HD1 HIS 115 -21.367 35.376 0.026
944 HD2 HIS 115 HD2 HIS 115 -19.190 32.395 1.948
945 HE1 HIS 115 HE1 HIS 115 -22.413 35.127 2.298
946 HE2 HIS 115 HE2 HIS 115 -21.073 33.328 3.455
947 H HIS 116 H HIS 116 -17.076 35.251 1.719
948 HA HIS 116 HA HIS 116 -14.816 33.663 2.156
949 HB2 HIS 116 HB2 HIS 116 -14.835 34.415 4.420
950 HB3 HIS 116 HB3 HIS 116 -15.406 35.742 3.423
951 HD1 HIS 116 HD1 HIS 116 -16.429 33.429 6.144
952 HD2 HIS 116 HD2 HIS 116 -18.134 36.428 3.819
953 HE1 HIS 116 HE1 HIS 116 -18.582 34.037 7.293
954 HE2 HIS 116 HE2 HIS 116 -19.476 36.005 5.997
Start of MODEL 10
1 H1 MET 1 H1 MET 1 -2.974 -11.606 12.231
2 H2 MET 1 H2 MET 1 -4.584 -12.053 12.515
3 H3 MET 1 H3 MET 1 -3.698 -12.809 11.283
4 HA MET 1 HA MET 1 -3.056 -12.981 14.164
5 HB2 MET 1 HB2 MET 1 -4.409 -14.964 12.323
6 HB3 MET 1 HB3 MET 1 -3.790 -15.364 13.919
7 HG2 MET 1 HG2 MET 1 -5.339 -13.840 14.950
8 HG3 MET 1 HG3 MET 1 -5.910 -13.307 13.369
9 HE1 MET 1 HE1 MET 1 -8.409 -13.794 14.252
10 HE2 MET 1 HE2 MET 1 -7.769 -14.386 15.787
11 HE3 MET 1 HE3 MET 1 -8.922 -15.362 14.876
12 H ALA 2 H ALA 2 -2.691 -14.764 11.106
13 HA ALA 2 HA ALA 2 -0.917 -15.692 10.060
14 HB1 ALA 2 HB1 ALA 2 0.779 -13.985 11.871
15 HB2 ALA 2 HB2 ALA 2 0.175 -13.526 10.278
16 HB3 ALA 2 HB3 ALA 2 1.330 -14.849 10.435
17 H GLU 3 H GLU 3 1.350 -16.848 10.695
18 HA GLU 3 HA GLU 3 0.595 -19.032 12.332
19 HB2 GLU 3 HB2 GLU 3 3.470 -18.458 11.717
20 HB3 GLU 3 HB3 GLU 3 2.637 -20.003 11.784
21 HG2 GLU 3 HG2 GLU 3 2.900 -19.831 9.544
22 HG3 GLU 3 HG3 GLU 3 1.360 -18.987 9.702
23 H LYS 4 H LYS 4 3.038 -16.502 12.780
24 HA LYS 4 HA LYS 4 2.850 -16.979 15.672
25 HB2 LYS 4 HB2 LYS 4 5.254 -16.079 15.710
26 HB3 LYS 4 HB3 LYS 4 5.002 -17.715 15.125
27 HG2 LYS 4 HG2 LYS 4 5.007 -16.731 12.789
28 HG3 LYS 4 HG3 LYS 4 5.600 -15.244 13.530
29 HD2 LYS 4 HD2 LYS 4 7.552 -16.395 14.370
30 HD3 LYS 4 HD3 LYS 4 6.935 -17.941 13.786
31 HE2 LYS 4 HE2 LYS 4 6.996 -17.000 11.473
32 HE3 LYS 4 HE3 LYS 4 7.785 -15.568 12.130
33 HZ1 LYS 4 HZ1 LYS 4 8.848 -18.342 12.275
34 HZ2 LYS 4 HZ2 LYS 4 9.615 -16.956 12.872
35 HZ3 LYS 4 HZ3 LYS 4 9.377 -17.139 11.204
36 H ASN 5 H ASN 5 3.924 -14.430 13.378
37 HA ASN 5 HA ASN 5 2.101 -12.532 14.450
38 HB2 ASN 5 HB2 ASN 5 3.822 -12.725 16.301
39 HB3 ASN 5 HB3 ASN 5 4.991 -12.029 15.185
40 HD21 ASN 5 HD21 ASN 5 1.861 -11.452 16.689
41 HD22 ASN 5 HD22 ASN 5 2.010 -9.728 16.773
42 H ALA 6 H ALA 6 3.627 -13.649 11.958
43 HA ALA 6 HA ALA 6 4.229 -11.030 10.763
44 HB1 ALA 6 HB1 ALA 6 6.082 -12.621 10.636
45 HB2 ALA 6 HB2 ALA 6 5.459 -12.246 9.031
46 HB3 ALA 6 HB3 ALA 6 5.043 -13.776 9.802
47 H TYR 7 H TYR 7 1.903 -10.717 10.689
48 HA TYR 7 HA TYR 7 0.290 -12.358 8.979
49 HB2 TYR 7 HB2 TYR 7 -1.229 -10.170 9.246
50 HB3 TYR 7 HB3 TYR 7 -1.101 -11.393 10.502
51 HD1 TYR 7 HD1 TYR 7 -0.160 -7.982 9.519
52 HD2 TYR 7 HD2 TYR 7 0.100 -10.950 12.550
53 HE1 TYR 7 HE1 TYR 7 0.594 -6.275 11.122
54 HE2 TYR 7 HE2 TYR 7 0.853 -9.256 14.162
55 HH TYR 7 HH TYR 7 0.571 -5.965 13.645
56 H THR 8 H THR 8 -0.711 -11.673 7.008
57 HA THR 8 HA THR 8 1.239 -11.047 5.134
58 HB THR 8 HB THR 8 -0.528 -11.015 3.474
59 HG1 THR 8 HG1 THR 8 -2.762 -11.401 4.684
60 HG21 THR 8 HG21 THR 8 0.145 -13.189 4.367
61 HG22 THR 8 HG22 THR 8 -1.568 -13.185 3.949
62 HG23 THR 8 HG23 THR 8 -1.073 -13.054 5.636
63 H VAL 9 H VAL 9 1.314 -9.331 3.561
64 HA VAL 9 HA VAL 9 1.425 -6.759 4.583
65 HB VAL 9 HB VAL 9 2.606 -7.491 2.557
66 HG11 VAL 9 HG11 VAL 9 -0.094 -7.367 1.223
67 HG12 VAL 9 HG12 VAL 9 0.860 -8.821 1.526
68 HG13 VAL 9 HG13 VAL 9 1.450 -7.597 0.402
69 HG21 VAL 9 HG21 VAL 9 2.330 -5.450 1.245
70 HG22 VAL 9 HG22 VAL 9 2.329 -5.106 2.977
71 HG23 VAL 9 HG23 VAL 9 0.812 -5.117 2.077
72 H ALA 10 H ALA 10 -1.276 -8.534 3.341
73 HA ALA 10 HA ALA 10 -3.009 -6.301 2.912
74 HB1 ALA 10 HB1 ALA 10 -4.786 -7.967 2.755
75 HB2 ALA 10 HB2 ALA 10 -3.691 -9.206 3.372
76 HB3 ALA 10 HB3 ALA 10 -3.383 -8.457 1.806
77 H GLN 11 H GLN 11 -2.667 -8.719 5.517
78 HA GLN 11 HA GLN 11 -4.670 -7.534 7.162
79 HB2 GLN 11 HB2 GLN 11 -2.487 -9.490 7.880
80 HB3 GLN 11 HB3 GLN 11 -3.860 -9.076 8.899
81 HG2 GLN 11 HG2 GLN 11 -5.364 -9.937 7.135
82 HG3 GLN 11 HG3 GLN 11 -3.944 -10.457 6.228
83 HE21 GLN 11 HE21 GLN 11 -5.947 -11.015 8.999
84 HE22 GLN 11 HE22 GLN 11 -5.287 -12.561 9.407
85 H LEU 12 H LEU 12 -1.248 -7.071 6.775
86 HA LEU 12 HA LEU 12 -0.644 -5.702 9.132
87 HB2 LEU 12 HB2 LEU 12 1.033 -6.392 7.472
88 HB3 LEU 12 HB3 LEU 12 0.403 -5.217 6.335
89 HG LEU 12 HG LEU 12 1.072 -3.406 7.918
90 HD11 LEU 12 HD11 LEU 12 2.419 -5.668 9.385
91 HD12 LEU 12 HD12 LEU 12 1.071 -4.698 9.978
92 HD13 LEU 12 HD13 LEU 12 2.644 -3.949 9.709
93 HD21 LEU 12 HD21 LEU 12 2.483 -3.984 6.033
94 HD22 LEU 12 HD22 LEU 12 3.257 -5.259 6.975
95 HD23 LEU 12 HD23 LEU 12 3.474 -3.568 7.431
96 H ALA 13 H ALA 13 -2.059 -4.552 6.103
97 HA ALA 13 HA ALA 13 -2.280 -1.832 6.954
98 HB1 ALA 13 HB1 ALA 13 -3.732 -3.288 4.745
99 HB2 ALA 13 HB2 ALA 13 -2.196 -2.436 4.582
100 HB3 ALA 13 HB3 ALA 13 -3.666 -1.539 4.963
101 H ASP 14 H ASP 14 -4.216 -4.694 7.218
102 HA ASP 14 HA ASP 14 -6.670 -3.477 7.921
103 HB2 ASP 14 HB2 ASP 14 -6.706 -5.740 7.163
104 HB3 ASP 14 HB3 ASP 14 -5.560 -6.243 8.399
105 H GLU 15 H GLU 15 -3.993 -4.791 9.871
106 HA GLU 15 HA GLU 15 -5.263 -4.099 12.335
107 HB2 GLU 15 HB2 GLU 15 -3.426 -5.012 13.405
108 HB3 GLU 15 HB3 GLU 15 -3.405 -5.876 11.881
109 HG2 GLU 15 HG2 GLU 15 -1.281 -5.296 11.691
110 HG3 GLU 15 HG3 GLU 15 -1.818 -3.632 11.448
111 H TYR 16 H TYR 16 -2.997 -2.544 10.165
112 HA TYR 16 HA TYR 16 -2.250 -0.347 11.725
113 HB2 TYR 16 HB2 TYR 16 -1.222 -0.925 9.555
114 HB3 TYR 16 HB3 TYR 16 -2.710 -0.471 8.735
115 HD1 TYR 16 HD1 TYR 16 0.110 0.857 10.745
116 HD2 TYR 16 HD2 TYR 16 -3.140 1.770 8.157
117 HE1 TYR 16 HE1 TYR 16 0.933 3.165 10.534
118 HE2 TYR 16 HE2 TYR 16 -2.328 4.080 7.941
119 HH TYR 16 HH TYR 16 -0.935 5.664 9.184
120 H PHE 17 H PHE 17 -5.092 -0.928 9.736
121 HA PHE 17 HA PHE 17 -6.341 1.558 9.885
122 HB2 PHE 17 HB2 PHE 17 -7.149 -0.271 8.466
123 HB3 PHE 17 HB3 PHE 17 -7.562 -1.214 9.890
124 HD1 PHE 17 HD1 PHE 17 -9.474 -0.557 11.298
125 HD2 PHE 17 HD2 PHE 17 -8.591 1.443 7.654
126 HE1 PHE 17 HE1 PHE 17 -11.736 0.404 11.284
127 HE2 PHE 17 HE2 PHE 17 -10.853 2.416 7.634
128 HZ PHE 17 HZ PHE 17 -12.428 1.896 9.453
129 H GLU 18 H GLU 18 -6.499 -1.212 12.082
130 HA GLU 18 HA GLU 18 -8.352 -0.114 13.896
131 HB2 GLU 18 HB2 GLU 18 -6.228 -2.214 14.350
132 HB3 GLU 18 HB3 GLU 18 -7.588 -1.900 15.417
133 HG2 GLU 18 HG2 GLU 18 -7.836 -2.783 12.552
134 HG3 GLU 18 HG3 GLU 18 -7.881 -3.864 13.944
135 H ARG 19 H ARG 19 -4.968 0.435 13.469
136 HA ARG 19 HA ARG 19 -4.532 1.350 16.184
137 HB2 ARG 19 HB2 ARG 19 -2.676 1.749 13.842
138 HB3 ARG 19 HB3 ARG 19 -2.271 1.762 15.550
139 HG2 ARG 19 HG2 ARG 19 -3.125 -0.633 13.945
140 HG3 ARG 19 HG3 ARG 19 -1.484 -0.256 14.467
141 HD2 ARG 19 HD2 ARG 19 -2.235 -0.426 16.814
142 HD3 ARG 19 HD3 ARG 19 -3.840 -0.888 16.242
143 HE ARG 19 HE ARG 19 -1.909 -2.574 15.070
144 HH11 ARG 19 HH11 ARG 19 -3.405 -1.973 18.197
145 HH12 ARG 19 HH12 ARG 19 -3.171 -3.604 18.751
146 HH21 ARG 19 HH21 ARG 19 -1.600 -4.694 15.801
147 HH22 ARG 19 HH22 ARG 19 -2.140 -5.152 17.393
148 H MET 20 H MET 20 -4.278 2.881 12.963
149 HA MET 20 HA MET 20 -4.070 5.473 14.276
150 HB2 MET 20 HB2 MET 20 -3.863 4.792 11.338
151 HB3 MET 20 HB3 MET 20 -3.435 6.323 12.085
152 HG2 MET 20 HG2 MET 20 -2.068 3.678 12.521
153 HG3 MET 20 HG3 MET 20 -1.460 5.039 11.586
154 HE1 MET 20 HE1 MET 20 0.129 3.510 13.972
155 HE2 MET 20 HE2 MET 20 0.896 4.905 14.734
156 HE3 MET 20 HE3 MET 20 0.810 4.800 12.978
157 H ILE 21 H ILE 21 -6.402 3.654 12.486
158 HA ILE 21 HA ILE 21 -7.940 6.072 11.856
159 HB ILE 21 HB ILE 21 -8.454 3.268 10.839
160 HG12 ILE 21 HG12 ILE 21 -6.789 5.480 9.607
161 HG13 ILE 21 HG13 ILE 21 -6.166 3.971 10.265
162 HG21 ILE 21 HG21 ILE 21 -9.627 4.431 9.028
163 HG22 ILE 21 HG22 ILE 21 -9.259 5.982 9.783
164 HG23 ILE 21 HG23 ILE 21 -10.321 4.834 10.599
165 HD11 ILE 21 HD11 ILE 21 -7.351 2.734 8.523
166 HD12 ILE 21 HD12 ILE 21 -6.234 3.916 7.844
167 HD13 ILE 21 HD13 ILE 21 -7.966 4.251 7.867
168 H ALA 22 H ALA 22 -7.692 4.893 14.506
169 HA ALA 22 HA ALA 22 -10.540 4.370 15.024
170 HB1 ALA 22 HB1 ALA 22 -9.083 2.515 15.701
171 HB2 ALA 22 HB2 ALA 22 -9.866 3.271 17.090
172 HB3 ALA 22 HB3 ALA 22 -8.172 3.617 16.736
173 H GLY 23 H GLY 23 -11.380 5.328 17.038
174 HA2 GLY 23 HA2 GLY 23 -11.427 6.973 18.710
175 HA3 GLY 23 HA3 GLY 23 -9.876 7.570 18.135
176 H ARG 24 H ARG 24 -10.032 8.473 15.797
177 HA ARG 24 HA ARG 24 -12.538 9.701 15.145
178 HB2 ARG 24 HB2 ARG 24 -11.400 12.004 15.007
179 HB3 ARG 24 HB3 ARG 24 -11.955 11.440 16.572
180 HG2 ARG 24 HG2 ARG 24 -9.918 12.260 17.119
181 HG3 ARG 24 HG3 ARG 24 -9.489 10.587 16.793
182 HD2 ARG 24 HD2 ARG 24 -8.761 11.199 14.549
183 HD3 ARG 24 HD3 ARG 24 -9.227 12.874 14.842
184 HE ARG 24 HE ARG 24 -7.476 12.335 16.854
185 HH11 ARG 24 HH11 ARG 24 -7.350 12.067 13.365
186 HH12 ARG 24 HH12 ARG 24 -5.635 12.333 13.271
187 HH21 ARG 24 HH21 ARG 24 -5.221 12.676 16.748
188 HH22 ARG 24 HH22 ARG 24 -4.422 12.695 15.203
189 H TRP 25 H TRP 25 -12.760 9.458 13.131
190 HA TRP 25 HA TRP 25 -10.537 9.746 11.280
191 HB2 TRP 25 HB2 TRP 25 -10.870 7.549 10.269
192 HB3 TRP 25 HB3 TRP 25 -10.459 7.382 11.970
193 HD1 TRP 25 HD1 TRP 25 -12.949 6.309 9.462
194 HE1 TRP 25 HE1 TRP 25 -14.902 5.066 10.590
195 HE3 TRP 25 HE3 TRP 25 -11.964 7.469 14.334
196 HZ2 TRP 25 HZ2 TRP 25 -15.901 4.651 13.183
197 HZ3 TRP 25 HZ3 TRP 25 -13.467 6.617 16.076
198 HH2 TRP 25 HH2 TRP 25 -15.395 5.239 15.509
199 H LYS 26 H LYS 26 -13.982 8.970 11.664
200 HA LYS 26 HA LYS 26 -15.829 9.502 10.488
201 HB2 LYS 26 HB2 LYS 26 -14.018 11.757 9.754
202 HB3 LYS 26 HB3 LYS 26 -15.565 11.591 8.932
203 HG2 LYS 26 HG2 LYS 26 -15.272 11.679 11.922
204 HG3 LYS 26 HG3 LYS 26 -15.588 13.098 10.920
205 HD2 LYS 26 HD2 LYS 26 -17.665 12.168 10.151
206 HD3 LYS 26 HD3 LYS 26 -17.325 10.634 10.950
207 HE2 LYS 26 HE2 LYS 26 -18.952 12.068 12.162
208 HE3 LYS 26 HE3 LYS 26 -17.535 11.635 13.114
209 HZ1 LYS 26 HZ1 LYS 26 -16.635 13.774 12.849
210 HZ2 LYS 26 HZ2 LYS 26 -18.268 14.020 13.246
211 HZ3 LYS 26 HZ3 LYS 26 -17.745 14.197 11.640
212 H HIS 27 H HIS 27 -16.579 8.186 9.069
213 HA HIS 27 HA HIS 27 -16.901 6.938 7.220
214 HB2 HIS 27 HB2 HIS 27 -15.966 9.498 6.216
215 HB3 HIS 27 HB3 HIS 27 -15.579 8.173 5.122
216 HD1 HIS 27 HD1 HIS 27 -17.653 10.320 4.333
217 HD2 HIS 27 HD2 HIS 27 -18.593 6.680 6.129
218 HE1 HIS 27 HE1 HIS 27 -20.047 9.847 3.716
219 HE2 HIS 27 HE2 HIS 27 -20.567 7.598 4.720
220 HA PRO 28 HA PRO 28 -12.803 4.937 7.576
221 HB2 PRO 28 HB2 PRO 28 -13.759 2.487 8.179
222 HB3 PRO 28 HB3 PRO 28 -13.577 3.753 9.398
223 HG2 PRO 28 HG2 PRO 28 -16.036 2.868 7.943
224 HG3 PRO 28 HG3 PRO 28 -15.833 3.269 9.658
225 HD2 PRO 28 HD2 PRO 28 -16.895 4.993 7.839
226 HD3 PRO 28 HD3 PRO 28 -16.006 5.527 9.279
227 H ASN 29 H ASN 29 -15.700 4.208 5.798
228 HA ASN 29 HA ASN 29 -14.709 2.074 4.239
229 HB2 ASN 29 HB2 ASN 29 -16.653 2.419 2.810
230 HB3 ASN 29 HB3 ASN 29 -17.118 2.510 4.504
231 HD21 ASN 29 HD21 ASN 29 -18.354 3.574 2.051
232 HD22 ASN 29 HD22 ASN 29 -18.547 5.275 2.319
233 H ILE 30 H ILE 30 -14.444 5.533 3.940
234 HA ILE 30 HA ILE 30 -13.765 5.713 1.227
235 HB ILE 30 HB ILE 30 -12.825 7.418 3.541
236 HG12 ILE 30 HG12 ILE 30 -15.049 7.792 1.523
237 HG13 ILE 30 HG13 ILE 30 -15.250 7.419 3.232
238 HG21 ILE 30 HG21 ILE 30 -12.660 7.977 0.580
239 HG22 ILE 30 HG22 ILE 30 -11.300 7.641 1.649
240 HG23 ILE 30 HG23 ILE 30 -12.249 9.112 1.869
241 HD11 ILE 30 HD11 ILE 30 -14.068 9.946 2.100
242 HD12 ILE 30 HD12 ILE 30 -14.260 9.574 3.813
243 HD13 ILE 30 HD13 ILE 30 -15.682 9.764 2.786
244 H VAL 31 H VAL 31 -11.638 5.390 4.076
245 HA VAL 31 HA VAL 31 -9.323 5.073 2.419
246 HB VAL 31 HB VAL 31 -9.134 6.101 4.643
247 HG11 VAL 31 HG11 VAL 31 -9.765 3.355 5.699
248 HG12 VAL 31 HG12 VAL 31 -10.749 4.807 5.881
249 HG13 VAL 31 HG13 VAL 31 -9.171 4.706 6.661
250 HG21 VAL 31 HG21 VAL 31 -7.546 3.557 4.355
251 HG22 VAL 31 HG22 VAL 31 -7.113 4.932 5.373
252 HG23 VAL 31 HG23 VAL 31 -7.166 5.114 3.619
253 H ARG 32 H ARG 32 -11.561 2.909 4.075
254 HA ARG 32 HA ARG 32 -10.115 0.518 3.785
255 HB2 ARG 32 HB2 ARG 32 -12.974 1.215 4.167
256 HB3 ARG 32 HB3 ARG 32 -12.624 -0.401 3.570
257 HG2 ARG 32 HG2 ARG 32 -11.488 0.804 6.087
258 HG3 ARG 32 HG3 ARG 32 -12.852 -0.315 6.015
259 HD2 ARG 32 HD2 ARG 32 -11.336 -1.970 4.912
260 HD3 ARG 32 HD3 ARG 32 -9.998 -0.860 5.204
261 HE ARG 32 HE ARG 32 -11.305 -1.317 7.633
262 HH11 ARG 32 HH11 ARG 32 -9.397 -3.133 5.286
263 HH12 ARG 32 HH12 ARG 32 -8.771 -4.223 6.487
264 HH21 ARG 32 HH21 ARG 32 -10.452 -2.762 9.184
265 HH22 ARG 32 HH22 ARG 32 -9.334 -4.004 8.680
266 H SER 33 H SER 33 -12.306 2.181 1.539
267 HA SER 33 HA SER 33 -12.390 0.248 -0.466
268 HB2 SER 33 HB2 SER 33 -12.363 3.265 -0.782
269 HB3 SER 33 HB3 SER 33 -12.872 2.116 -2.021
270 HG SER 33 HG SER 33 -14.068 2.527 0.527
271 H ARG 34 H ARG 34 -9.953 2.635 0.327
272 HA ARG 34 HA ARG 34 -8.331 2.052 -1.964
273 HB2 ARG 34 HB2 ARG 34 -7.773 3.618 0.556
274 HB3 ARG 34 HB3 ARG 34 -6.619 3.444 -0.760
275 HG2 ARG 34 HG2 ARG 34 -8.198 4.512 -2.286
276 HG3 ARG 34 HG3 ARG 34 -9.347 4.697 -0.961
277 HD2 ARG 34 HD2 ARG 34 -7.791 6.131 0.222
278 HD3 ARG 34 HD3 ARG 34 -6.580 5.888 -1.036
279 HE ARG 34 HE ARG 34 -8.756 6.874 -2.364
280 HH11 ARG 34 HH11 ARG 34 -6.790 7.998 0.310
281 HH12 ARG 34 HH12 ARG 34 -7.062 9.679 -0.034
282 HH21 ARG 34 HH21 ARG 34 -9.101 9.050 -2.833
283 HH22 ARG 34 HH22 ARG 34 -8.385 10.287 -1.838
284 H ILE 35 H ILE 35 -8.188 1.255 1.503
285 HA ILE 35 HA ILE 35 -5.772 -0.116 1.512
286 HB ILE 35 HB ILE 35 -8.231 -0.671 3.181
287 HG12 ILE 35 HG12 ILE 35 -5.737 0.941 3.781
288 HG13 ILE 35 HG13 ILE 35 -7.310 1.622 3.378
289 HG21 ILE 35 HG21 ILE 35 -6.749 -2.596 3.198
290 HG22 ILE 35 HG22 ILE 35 -6.692 -1.768 4.753
291 HG23 ILE 35 HG23 ILE 35 -5.378 -1.560 3.595
292 HD11 ILE 35 HD11 ILE 35 -6.680 -0.057 5.794
293 HD12 ILE 35 HD12 ILE 35 -8.252 0.636 5.397
294 HD13 ILE 35 HD13 ILE 35 -6.891 1.695 5.770
295 H GLU 36 H GLU 36 -9.030 -1.421 0.899
296 HA GLU 36 HA GLU 36 -8.082 -4.104 0.649
297 HB2 GLU 36 HB2 GLU 36 -10.728 -3.006 -0.304
298 HB3 GLU 36 HB3 GLU 36 -10.342 -4.683 0.041
299 HG2 GLU 36 HG2 GLU 36 -10.623 -2.425 2.000
300 HG3 GLU 36 HG3 GLU 36 -11.644 -3.851 1.839
301 H LYS 37 H LYS 37 -8.669 -1.501 -1.650
302 HA LYS 37 HA LYS 37 -8.374 -3.417 -3.850
303 HB2 LYS 37 HB2 LYS 37 -10.526 -2.156 -3.655
304 HB3 LYS 37 HB3 LYS 37 -9.625 -0.677 -3.950
305 HG2 LYS 37 HG2 LYS 37 -9.536 -2.953 -5.892
306 HG3 LYS 37 HG3 LYS 37 -10.850 -1.777 -5.909
307 HD2 LYS 37 HD2 LYS 37 -8.106 -0.696 -5.823
308 HD3 LYS 37 HD3 LYS 37 -8.593 -1.488 -7.312
309 HE2 LYS 37 HE2 LYS 37 -9.031 0.900 -7.399
310 HE3 LYS 37 HE3 LYS 37 -10.530 -0.019 -7.482
311 HZ1 LYS 37 HZ1 LYS 37 -10.841 0.435 -5.092
312 HZ2 LYS 37 HZ2 LYS 37 -10.797 1.850 -6.016
313 HZ3 LYS 37 HZ3 LYS 37 -9.444 1.398 -5.097
314 H ASP 38 H ASP 38 -7.524 -0.053 -3.008
315 HA ASP 38 HA ASP 38 -5.751 0.169 -5.252
316 HB2 ASP 38 HB2 ASP 38 -6.224 1.992 -2.886
317 HB3 ASP 38 HB3 ASP 38 -5.178 2.389 -4.247
318 H ILE 39 H ILE 39 -5.367 -0.279 -1.775
319 HA ILE 39 HA ILE 39 -2.497 -0.129 -1.888
320 HB ILE 39 HB ILE 39 -4.244 -1.173 0.352
321 HG12 ILE 39 HG12 ILE 39 -4.793 1.158 -0.236
322 HG13 ILE 39 HG13 ILE 39 -4.027 1.051 1.345
323 HG21 ILE 39 HG21 ILE 39 -1.375 -0.250 0.329
324 HG22 ILE 39 HG22 ILE 39 -1.949 -1.901 0.571
325 HG23 ILE 39 HG23 ILE 39 -2.299 -0.660 1.774
326 HD11 ILE 39 HD11 ILE 39 -1.912 1.777 0.360
327 HD12 ILE 39 HD12 ILE 39 -3.198 2.954 0.102
328 HD13 ILE 39 HD13 ILE 39 -2.695 1.896 -1.216
329 H LYS 40 H LYS 40 -4.926 -2.675 -1.809
330 HA LYS 40 HA LYS 40 -2.802 -4.597 -2.477
331 HB2 LYS 40 HB2 LYS 40 -5.224 -4.883 -0.766
332 HB3 LYS 40 HB3 LYS 40 -4.768 -6.261 -1.759
333 HG2 LYS 40 HG2 LYS 40 -3.793 -6.559 0.377
334 HG3 LYS 40 HG3 LYS 40 -2.494 -6.144 -0.738
335 HD2 LYS 40 HD2 LYS 40 -3.343 -3.697 0.239
336 HD3 LYS 40 HD3 LYS 40 -3.419 -4.765 1.643
337 HE2 LYS 40 HE2 LYS 40 -1.092 -5.527 1.024
338 HE3 LYS 40 HE3 LYS 40 -1.050 -4.186 -0.117
339 HZ1 LYS 40 HZ1 LYS 40 -1.316 -4.033 2.831
340 HZ2 LYS 40 HZ2 LYS 40 -1.546 -2.705 1.807
341 HZ3 LYS 40 HZ3 LYS 40 -0.037 -3.464 1.884
342 HA PRO 41 HA PRO 41 -5.584 -4.230 -6.155
343 HB2 PRO 41 HB2 PRO 41 -3.153 -4.093 -7.735
344 HB3 PRO 41 HB3 PRO 41 -4.438 -2.892 -7.579
345 HG2 PRO 41 HG2 PRO 41 -1.930 -2.524 -6.590
346 HG3 PRO 41 HG3 PRO 41 -3.374 -1.789 -5.869
347 HD2 PRO 41 HD2 PRO 41 -1.865 -4.236 -5.019
348 HD3 PRO 41 HD3 PRO 41 -2.542 -2.929 -4.021
349 H ALA 42 H ALA 42 -2.935 -6.213 -5.241
350 HA ALA 42 HA ALA 42 -4.047 -8.555 -6.376
351 HB1 ALA 42 HB1 ALA 42 -3.077 -7.611 -8.434
352 HB2 ALA 42 HB2 ALA 42 -2.300 -9.123 -7.970
353 HB3 ALA 42 HB3 ALA 42 -1.492 -7.587 -7.660
354 H ILE 43 H ILE 43 -1.270 -6.914 -5.052
355 HA ILE 43 HA ILE 43 -0.088 -9.272 -3.934
356 HB ILE 43 HB ILE 43 1.251 -7.489 -2.614
357 HG12 ILE 43 HG12 ILE 43 0.105 -5.728 -4.787
358 HG13 ILE 43 HG13 ILE 43 -0.485 -5.708 -3.129
359 HG21 ILE 43 HG21 ILE 43 2.129 -8.775 -4.494
360 HG22 ILE 43 HG22 ILE 43 2.699 -7.106 -4.550
361 HG23 ILE 43 HG23 ILE 43 1.400 -7.631 -5.623
362 HD11 ILE 43 HD11 ILE 43 1.080 -3.897 -3.540
363 HD12 ILE 43 HD12 ILE 43 2.318 -5.059 -4.018
364 HD13 ILE 43 HD13 ILE 43 1.731 -5.032 -2.355
365 H GLY 44 H GLY 44 -2.193 -9.909 -2.928
366 HA2 GLY 44 HA2 GLY 44 -2.197 -8.958 -0.140
367 HA3 GLY 44 HA3 GLY 44 -3.715 -9.143 -1.010
368 H SER 45 H SER 45 -2.603 -10.547 1.397
369 HA SER 45 HA SER 45 -2.287 -12.621 2.272
370 HB2 SER 45 HB2 SER 45 -4.036 -13.419 -0.074
371 HB3 SER 45 HB3 SER 45 -3.735 -14.400 1.362
372 HG SER 45 HG SER 45 -5.713 -12.894 1.168
373 H LEU 46 H LEU 46 -0.327 -11.648 0.478
374 HA LEU 46 HA LEU 46 0.716 -14.099 -0.777
375 HB2 LEU 46 HB2 LEU 46 0.121 -12.278 -2.357
376 HB3 LEU 46 HB3 LEU 46 1.194 -11.194 -1.500
377 HG LEU 46 HG LEU 46 3.103 -12.670 -2.158
378 HD11 LEU 46 HD11 LEU 46 1.840 -14.722 -2.556
379 HD12 LEU 46 HD12 LEU 46 2.780 -14.250 -3.973
380 HD13 LEU 46 HD13 LEU 46 1.041 -13.963 -3.933
381 HD21 LEU 46 HD21 LEU 46 3.176 -11.875 -4.471
382 HD22 LEU 46 HD22 LEU 46 2.613 -10.624 -3.364
383 HD23 LEU 46 HD23 LEU 46 1.459 -11.482 -4.387
384 H LYS 47 H LYS 47 1.035 -13.526 1.983
385 HA LYS 47 HA LYS 47 2.425 -12.987 3.670
386 HB2 LYS 47 HB2 LYS 47 4.211 -14.033 1.552
387 HB3 LYS 47 HB3 LYS 47 4.981 -13.202 2.901
388 HG2 LYS 47 HG2 LYS 47 3.045 -15.490 3.174
389 HG3 LYS 47 HG3 LYS 47 4.804 -15.632 3.241
390 HD2 LYS 47 HD2 LYS 47 4.901 -14.233 5.190
391 HD3 LYS 47 HD3 LYS 47 3.177 -13.877 5.074
392 HE2 LYS 47 HE2 LYS 47 2.584 -16.080 5.663
393 HE3 LYS 47 HE3 LYS 47 4.226 -16.664 5.421
394 HZ1 LYS 47 HZ1 LYS 47 3.330 -14.805 7.561
395 HZ2 LYS 47 HZ2 LYS 47 4.931 -15.303 7.318
396 HZ3 LYS 47 HZ3 LYS 47 3.750 -16.435 7.771
397 H VAL 48 H VAL 48 4.406 -11.596 4.314
398 HA VAL 48 HA VAL 48 3.889 -8.932 3.285
399 HB VAL 48 HB VAL 48 6.000 -9.483 5.317
400 HG11 VAL 48 HG11 VAL 48 5.631 -7.207 4.587
401 HG12 VAL 48 HG12 VAL 48 5.151 -7.390 6.274
402 HG13 VAL 48 HG13 VAL 48 3.922 -7.324 5.010
403 HG21 VAL 48 HG21 VAL 48 4.191 -10.935 6.027
404 HG22 VAL 48 HG22 VAL 48 3.047 -9.599 5.906
405 HG23 VAL 48 HG23 VAL 48 4.335 -9.552 7.109
406 H GLU 49 H GLU 49 6.541 -11.218 3.574
407 HA GLU 49 HA GLU 49 8.560 -9.421 2.714
408 HB2 GLU 49 HB2 GLU 49 8.716 -12.434 2.754
409 HB3 GLU 49 HB3 GLU 49 10.047 -11.292 2.882
410 HG2 GLU 49 HG2 GLU 49 9.845 -11.799 5.065
411 HG3 GLU 49 HG3 GLU 49 8.646 -10.514 5.007
412 H ASP 50 H ASP 50 6.214 -10.952 0.930
413 HA ASP 50 HA ASP 50 7.893 -11.418 -1.404
414 HB2 ASP 50 HB2 ASP 50 5.857 -12.873 -0.632
415 HB3 ASP 50 HB3 ASP 50 4.902 -11.644 -1.453
416 H VAL 51 H VAL 51 6.280 -8.816 -0.018
417 HA VAL 51 HA VAL 51 5.451 -7.584 -2.463
418 HB VAL 51 HB VAL 51 4.403 -6.977 -0.301
419 HG11 VAL 51 HG11 VAL 51 6.364 -6.914 1.135
420 HG12 VAL 51 HG12 VAL 51 5.467 -5.398 1.206
421 HG13 VAL 51 HG13 VAL 51 6.959 -5.495 0.271
422 HG21 VAL 51 HG21 VAL 51 4.132 -5.542 -2.212
423 HG22 VAL 51 HG22 VAL 51 5.643 -4.711 -1.841
424 HG23 VAL 51 HG23 VAL 51 4.265 -4.566 -0.749
425 H LYS 52 H LYS 52 6.976 -7.419 -3.900
426 HA LYS 52 HA LYS 52 9.589 -6.331 -3.142
427 HB2 LYS 52 HB2 LYS 52 8.818 -8.086 -5.489
428 HB3 LYS 52 HB3 LYS 52 10.450 -7.545 -5.105
429 HG2 LYS 52 HG2 LYS 52 10.546 -8.853 -3.160
430 HG3 LYS 52 HG3 LYS 52 8.806 -9.123 -3.155
431 HD2 LYS 52 HD2 LYS 52 9.065 -10.436 -5.246
432 HD3 LYS 52 HD3 LYS 52 10.818 -10.257 -5.095
433 HE2 LYS 52 HE2 LYS 52 10.740 -11.363 -2.915
434 HE3 LYS 52 HE3 LYS 52 8.994 -11.524 -3.052
435 HZ1 LYS 52 HZ1 LYS 52 10.179 -13.568 -3.621
436 HZ2 LYS 52 HZ2 LYS 52 10.957 -12.769 -4.896
437 HZ3 LYS 52 HZ3 LYS 52 9.274 -12.976 -4.928
438 HA PRO 53 HA PRO 53 9.312 -2.614 -5.389
439 HB2 PRO 53 HB2 PRO 53 11.467 -3.654 -7.186
440 HB3 PRO 53 HB3 PRO 53 11.347 -2.094 -6.363
441 HG2 PRO 53 HG2 PRO 53 12.933 -3.977 -5.397
442 HG3 PRO 53 HG3 PRO 53 11.948 -2.993 -4.298
443 HD2 PRO 53 HD2 PRO 53 11.567 -5.816 -5.175
444 HD3 PRO 53 HD3 PRO 53 11.196 -5.057 -3.613
445 H ARG 54 H ARG 54 9.773 -5.370 -7.607
446 HA ARG 54 HA ARG 54 8.632 -4.001 -9.827
447 HB2 ARG 54 HB2 ARG 54 10.267 -6.085 -9.667
448 HB3 ARG 54 HB3 ARG 54 8.759 -6.982 -9.747
449 HG2 ARG 54 HG2 ARG 54 9.398 -4.852 -11.747
450 HG3 ARG 54 HG3 ARG 54 10.019 -6.492 -11.927
451 HD2 ARG 54 HD2 ARG 54 7.843 -7.399 -12.087
452 HD3 ARG 54 HD3 ARG 54 7.099 -5.898 -11.534
453 HE ARG 54 HE ARG 54 7.118 -5.155 -13.680
454 HH11 ARG 54 HH11 ARG 54 9.580 -7.648 -13.407
455 HH12 ARG 54 HH12 ARG 54 9.900 -7.686 -15.115
456 HH21 ARG 54 HH21 ARG 54 7.543 -5.213 -15.906
457 HH22 ARG 54 HH22 ARG 54 8.760 -6.282 -16.536
458 H HIS 55 H HIS 55 7.369 -6.156 -7.353
459 HA HIS 55 HA HIS 55 4.815 -6.548 -8.491
460 HB2 HIS 55 HB2 HIS 55 5.816 -6.640 -5.651
461 HB3 HIS 55 HB3 HIS 55 4.107 -6.843 -6.018
462 HD1 HIS 55 HD1 HIS 55 6.226 -9.058 -4.869
463 HD2 HIS 55 HD2 HIS 55 4.584 -8.807 -8.682
464 HE1 HIS 55 HE1 HIS 55 6.412 -11.360 -5.838
465 HE2 HIS 55 HE2 HIS 55 5.606 -11.138 -8.214
466 H ILE 56 H ILE 56 6.219 -3.961 -6.612
467 HA ILE 56 HA ILE 56 3.744 -2.577 -6.179
468 HB ILE 56 HB ILE 56 6.628 -1.812 -5.763
469 HG12 ILE 56 HG12 ILE 56 5.640 -3.392 -4.171
470 HG13 ILE 56 HG13 ILE 56 5.996 -1.852 -3.400
471 HG21 ILE 56 HG21 ILE 56 5.509 0.226 -6.394
472 HG22 ILE 56 HG22 ILE 56 5.826 0.242 -4.660
473 HG23 ILE 56 HG23 ILE 56 4.201 -0.101 -5.256
474 HD11 ILE 56 HD11 ILE 56 3.282 -2.735 -4.356
475 HD12 ILE 56 HD12 ILE 56 3.658 -1.232 -3.510
476 HD13 ILE 56 HD13 ILE 56 3.852 -2.779 -2.687
477 H ASP 57 H ASP 57 6.444 -2.222 -8.477
478 HA ASP 57 HA ASP 57 5.595 0.263 -9.510
479 HB2 ASP 57 HB2 ASP 57 7.289 0.072 -11.065
480 HB3 ASP 57 HB3 ASP 57 7.865 -1.019 -9.823
481 H ASP 58 H ASP 58 4.777 -3.027 -10.311
482 HA ASP 58 HA ASP 58 3.322 -2.413 -12.676
483 HB2 ASP 58 HB2 ASP 58 4.238 -4.670 -12.154
484 HB3 ASP 58 HB3 ASP 58 3.014 -4.836 -10.898
485 H VAL 59 H VAL 59 2.336 -2.919 -9.287
486 HA VAL 59 HA VAL 59 -0.441 -2.724 -9.900
487 HB VAL 59 HB VAL 59 -0.836 -2.570 -7.481
488 HG11 VAL 59 HG11 VAL 59 -0.606 -4.752 -8.503
489 HG12 VAL 59 HG12 VAL 59 0.074 -4.764 -6.876
490 HG13 VAL 59 HG13 VAL 59 1.140 -4.696 -8.279
491 HG21 VAL 59 HG21 VAL 59 1.083 -1.234 -6.826
492 HG22 VAL 59 HG22 VAL 59 2.166 -2.564 -7.235
493 HG23 VAL 59 HG23 VAL 59 1.024 -2.736 -5.901
494 H LEU 60 H LEU 60 1.989 -0.382 -8.851
495 HA LEU 60 HA LEU 60 0.169 1.758 -8.433
496 HB2 LEU 60 HB2 LEU 60 3.103 1.753 -9.142
497 HB3 LEU 60 HB3 LEU 60 2.198 3.214 -8.796
498 HG LEU 60 HG LEU 60 2.728 0.938 -6.883
499 HD11 LEU 60 HD11 LEU 60 4.025 2.602 -5.663
500 HD12 LEU 60 HD12 LEU 60 3.683 3.797 -6.916
501 HD13 LEU 60 HD13 LEU 60 4.653 2.372 -7.294
502 HD21 LEU 60 HD21 LEU 60 1.165 3.490 -6.482
503 HD22 LEU 60 HD22 LEU 60 1.619 2.357 -5.209
504 HD23 LEU 60 HD23 LEU 60 0.513 1.849 -6.485
505 H LYS 61 H LYS 61 1.846 0.530 -11.264
506 HA LYS 61 HA LYS 61 1.160 2.579 -13.060
507 HB2 LYS 61 HB2 LYS 61 2.834 1.103 -13.778
508 HB3 LYS 61 HB3 LYS 61 1.908 -0.319 -13.332
509 HG2 LYS 61 HG2 LYS 61 0.712 1.326 -15.450
510 HG3 LYS 61 HG3 LYS 61 2.251 0.560 -15.859
511 HD2 LYS 61 HD2 LYS 61 -0.203 -0.841 -14.786
512 HD3 LYS 61 HD3 LYS 61 0.366 -0.876 -16.454
513 HE2 LYS 61 HE2 LYS 61 2.452 -1.937 -15.713
514 HE3 LYS 61 HE3 LYS 61 1.860 -1.920 -14.053
515 HZ1 LYS 61 HZ1 LYS 61 1.497 -4.075 -14.964
516 HZ2 LYS 61 HZ2 LYS 61 0.736 -3.439 -16.342
517 HZ3 LYS 61 HZ3 LYS 61 -0.023 -3.325 -14.830
518 H ALA 62 H ALA 62 -0.598 -0.181 -11.836
519 HA ALA 62 HA ALA 62 -2.782 0.051 -13.663
520 HB1 ALA 62 HB1 ALA 62 -2.274 -2.050 -12.511
521 HB2 ALA 62 HB2 ALA 62 -3.925 -1.518 -12.196
522 HB3 ALA 62 HB3 ALA 62 -2.679 -1.301 -10.967
523 H VAL 63 H VAL 63 -2.333 0.983 -10.243
524 HA VAL 63 HA VAL 63 -4.933 2.055 -9.985
525 HB VAL 63 HB VAL 63 -4.158 3.056 -7.876
526 HG11 VAL 63 HG11 VAL 63 -3.230 0.216 -8.270
527 HG12 VAL 63 HG12 VAL 63 -4.887 0.725 -7.945
528 HG13 VAL 63 HG13 VAL 63 -3.635 0.975 -6.729
529 HG21 VAL 63 HG21 VAL 63 -1.913 3.706 -8.523
530 HG22 VAL 63 HG22 VAL 63 -1.450 2.011 -8.679
531 HG23 VAL 63 HG23 VAL 63 -1.871 2.669 -7.097
532 H MET 64 H MET 64 -1.956 3.479 -11.143
533 HA MET 64 HA MET 64 -2.768 6.190 -10.791
534 HB2 MET 64 HB2 MET 64 -0.882 6.798 -12.167
535 HB3 MET 64 HB3 MET 64 -0.393 5.518 -11.073
536 HG2 MET 64 HG2 MET 64 -0.513 3.895 -12.845
537 HG3 MET 64 HG3 MET 64 -1.140 5.112 -13.956
538 HE1 MET 64 HE1 MET 64 1.675 5.686 -11.263
539 HE2 MET 64 HE2 MET 64 3.122 5.269 -12.179
540 HE3 MET 64 HE3 MET 64 1.942 4.021 -11.773
541 H LYS 65 H LYS 65 -3.384 3.777 -13.209
542 HA LYS 65 HA LYS 65 -4.478 5.706 -15.076
543 HB2 LYS 65 HB2 LYS 65 -3.230 3.778 -15.929
544 HB3 LYS 65 HB3 LYS 65 -4.347 2.683 -15.137
545 HG2 LYS 65 HG2 LYS 65 -5.364 4.644 -17.145
546 HG3 LYS 65 HG3 LYS 65 -4.584 3.149 -17.670
547 HD2 LYS 65 HD2 LYS 65 -6.790 3.137 -15.644
548 HD3 LYS 65 HD3 LYS 65 -7.129 3.146 -17.365
549 HE2 LYS 65 HE2 LYS 65 -5.310 1.129 -16.098
550 HE3 LYS 65 HE3 LYS 65 -7.050 0.888 -16.208
551 HZ1 LYS 65 HZ1 LYS 65 -6.865 1.137 -18.628
552 HZ2 LYS 65 HZ2 LYS 65 -5.958 -0.173 -18.057
553 HZ3 LYS 65 HZ3 LYS 65 -5.180 1.272 -18.489
554 H ARG 66 H ARG 66 -5.500 3.206 -12.848
555 HA ARG 66 HA ARG 66 -8.232 3.152 -13.375
556 HB2 ARG 66 HB2 ARG 66 -6.667 2.699 -10.841
557 HB3 ARG 66 HB3 ARG 66 -8.410 2.495 -10.905
558 HG2 ARG 66 HG2 ARG 66 -6.465 1.010 -12.653
559 HG3 ARG 66 HG3 ARG 66 -7.134 0.390 -11.142
560 HD2 ARG 66 HD2 ARG 66 -9.419 0.803 -12.152
561 HD3 ARG 66 HD3 ARG 66 -8.589 1.054 -13.687
562 HE ARG 66 HE ARG 66 -7.729 -1.253 -13.427
563 HH11 ARG 66 HH11 ARG 66 -10.595 -0.274 -11.661
564 HH12 ARG 66 HH12 ARG 66 -11.235 -1.890 -11.544
565 HH21 ARG 66 HH21 ARG 66 -8.555 -3.375 -13.284
566 HH22 ARG 66 HH22 ARG 66 -10.091 -3.657 -12.508
567 H GLY 67 H GLY 67 -6.374 5.341 -11.325
568 HA2 GLY 67 HA2 GLY 67 -8.833 6.952 -11.007
569 HA3 GLY 67 HA3 GLY 67 -7.595 6.837 -9.763
570 H ALA 68 H ALA 68 -5.529 7.750 -10.181
571 HA ALA 68 HA ALA 68 -5.024 9.427 -12.435
572 HB1 ALA 68 HB1 ALA 68 -6.673 10.848 -11.279
573 HB2 ALA 68 HB2 ALA 68 -5.065 11.576 -11.258
574 HB3 ALA 68 HB3 ALA 68 -5.694 10.783 -9.814
575 HA PRO 69 HA PRO 69 -0.939 8.730 -11.119
576 HB2 PRO 69 HB2 PRO 69 -0.187 11.487 -11.798
577 HB3 PRO 69 HB3 PRO 69 0.332 9.965 -12.516
578 HG2 PRO 69 HG2 PRO 69 -1.312 11.688 -13.789
579 HG3 PRO 69 HG3 PRO 69 -1.354 9.936 -14.045
580 HD2 PRO 69 HD2 PRO 69 -3.194 11.674 -12.480
581 HD3 PRO 69 HD3 PRO 69 -3.540 10.201 -13.410
582 H SER 70 H SER 70 -2.315 11.833 -10.152
583 HA SER 70 HA SER 70 -0.628 12.410 -8.007
584 HB2 SER 70 HB2 SER 70 -3.568 13.076 -8.047
585 HB3 SER 70 HB3 SER 70 -2.230 14.031 -7.402
586 HG SER 70 HG SER 70 -1.680 14.663 -9.390
587 H ILE 71 H ILE 71 -3.379 10.264 -8.272
588 HA ILE 71 HA ILE 71 -3.775 9.876 -5.479
589 HB ILE 71 HB ILE 71 -4.576 8.118 -7.808
590 HG12 ILE 71 HG12 ILE 71 -6.144 10.198 -6.262
591 HG13 ILE 71 HG13 ILE 71 -5.548 10.377 -7.909
592 HG21 ILE 71 HG21 ILE 71 -5.547 8.093 -4.952
593 HG22 ILE 71 HG22 ILE 71 -4.529 6.871 -5.714
594 HG23 ILE 71 HG23 ILE 71 -6.186 7.110 -6.269
595 HD11 ILE 71 HD11 ILE 71 -7.914 9.862 -7.892
596 HD12 ILE 71 HD12 ILE 71 -7.606 8.389 -6.970
597 HD13 ILE 71 HD13 ILE 71 -7.001 8.540 -8.619
598 H ALA 72 H ALA 72 -1.863 8.272 -7.966
599 HA ALA 72 HA ALA 72 -1.027 6.078 -6.385
600 HB1 ALA 72 HB1 ALA 72 0.394 7.351 -8.721
601 HB2 ALA 72 HB2 ALA 72 -0.847 6.104 -8.831
602 HB3 ALA 72 HB3 ALA 72 0.698 5.743 -8.063
603 H ASN 73 H ASN 73 0.176 9.346 -6.824
604 HA ASN 73 HA ASN 73 2.601 8.976 -5.357
605 HB2 ASN 73 HB2 ASN 73 1.107 11.570 -5.819
606 HB3 ASN 73 HB3 ASN 73 2.808 11.390 -5.408
607 HD21 ASN 73 HD21 ASN 73 3.193 9.124 -7.179
608 HD22 ASN 73 HD22 ASN 73 3.183 9.752 -8.781
609 H ASP 74 H ASP 74 -0.630 10.083 -4.611
610 HA ASP 74 HA ASP 74 -0.173 10.772 -1.901
611 HB2 ASP 74 HB2 ASP 74 -2.174 11.490 -3.166
612 HB3 ASP 74 HB3 ASP 74 -2.743 9.824 -3.193
613 H THR 75 H THR 75 -1.034 7.770 -3.498
614 HA THR 75 HA THR 75 -1.537 6.209 -1.216
615 HB THR 75 HB THR 75 -0.452 5.364 -3.915
616 HG1 THR 75 HG1 THR 75 -2.490 6.371 -4.054
617 HG21 THR 75 HG21 THR 75 -0.079 3.633 -2.227
618 HG22 THR 75 HG22 THR 75 -1.341 3.145 -3.361
619 HG23 THR 75 HG23 THR 75 -1.775 3.722 -1.752
620 H LEU 76 H LEU 76 1.439 7.144 -2.822
621 HA LEU 76 HA LEU 76 3.228 5.383 -1.570
622 HB2 LEU 76 HB2 LEU 76 3.651 8.216 -2.522
623 HB3 LEU 76 HB3 LEU 76 4.942 7.135 -2.037
624 HG LEU 76 HG LEU 76 3.056 6.588 -4.327
625 HD11 LEU 76 HD11 LEU 76 4.911 7.206 -5.781
626 HD12 LEU 76 HD12 LEU 76 5.876 7.657 -4.375
627 HD13 LEU 76 HD13 LEU 76 4.418 8.566 -4.773
628 HD21 LEU 76 HD21 LEU 76 4.685 4.873 -4.926
629 HD22 LEU 76 HD22 LEU 76 4.038 4.590 -3.310
630 HD23 LEU 76 HD23 LEU 76 5.648 5.278 -3.506
631 H ARG 77 H ARG 77 1.693 8.307 -0.457
632 HA ARG 77 HA ARG 77 3.351 8.877 1.754
633 HB2 ARG 77 HB2 ARG 77 1.478 10.295 0.654
634 HB3 ARG 77 HB3 ARG 77 0.387 9.397 1.696
635 HG2 ARG 77 HG2 ARG 77 0.897 11.472 2.746
636 HG3 ARG 77 HG3 ARG 77 1.704 10.187 3.652
637 HD2 ARG 77 HD2 ARG 77 3.810 10.748 2.775
638 HD3 ARG 77 HD3 ARG 77 3.106 11.715 1.479
639 HE ARG 77 HE ARG 77 2.443 12.757 4.050
640 HH11 ARG 77 HH11 ARG 77 5.060 12.605 1.707
641 HH12 ARG 77 HH12 ARG 77 5.740 14.137 2.189
642 HH21 ARG 77 HH21 ARG 77 3.328 14.742 4.680
643 HH22 ARG 77 HH22 ARG 77 4.750 15.361 3.885
644 H TRP 78 H TRP 78 0.501 6.846 1.341
645 HA TRP 78 HA TRP 78 0.443 5.967 4.068
646 HB2 TRP 78 HB2 TRP 78 -0.909 4.944 1.568
647 HB3 TRP 78 HB3 TRP 78 -1.126 4.198 3.150
648 HD1 TRP 78 HD1 TRP 78 -2.517 6.861 0.986
649 HE1 TRP 78 HE1 TRP 78 -4.226 8.288 2.287
650 HE3 TRP 78 HE3 TRP 78 -1.477 5.241 5.727
651 HZ2 TRP 78 HZ2 TRP 78 -5.021 8.666 4.969
652 HZ3 TRP 78 HZ3 TRP 78 -2.759 6.186 7.604
653 HH2 TRP 78 HH2 TRP 78 -4.494 7.864 7.231
654 H LEU 79 H LEU 79 1.656 4.635 1.016
655 HA LEU 79 HA LEU 79 2.466 2.120 1.918
656 HB2 LEU 79 HB2 LEU 79 3.782 3.868 -0.164
657 HB3 LEU 79 HB3 LEU 79 4.088 2.156 0.051
658 HG LEU 79 HG LEU 79 1.475 3.398 -0.813
659 HD11 LEU 79 HD11 LEU 79 1.933 2.293 -2.941
660 HD12 LEU 79 HD12 LEU 79 3.482 1.727 -2.316
661 HD13 LEU 79 HD13 LEU 79 3.198 3.454 -2.534
662 HD21 LEU 79 HD21 LEU 79 1.115 1.399 0.548
663 HD22 LEU 79 HD22 LEU 79 2.220 0.495 -0.486
664 HD23 LEU 79 HD23 LEU 79 0.703 1.111 -1.143
665 H LYS 80 H LYS 80 4.205 5.197 1.918
666 HA LYS 80 HA LYS 80 6.655 4.570 2.904
667 HB2 LYS 80 HB2 LYS 80 5.931 6.818 2.321
668 HB3 LYS 80 HB3 LYS 80 4.811 6.840 3.672
669 HG2 LYS 80 HG2 LYS 80 6.549 8.088 4.476
670 HG3 LYS 80 HG3 LYS 80 6.947 6.488 5.101
671 HD2 LYS 80 HD2 LYS 80 8.040 7.567 2.517
672 HD3 LYS 80 HD3 LYS 80 8.826 7.786 4.066
673 HE2 LYS 80 HE2 LYS 80 8.841 5.291 4.320
674 HE3 LYS 80 HE3 LYS 80 8.271 5.194 2.654
675 HZ1 LYS 80 HZ1 LYS 80 10.652 4.954 2.718
676 HZ2 LYS 80 HZ2 LYS 80 10.822 6.403 3.580
677 HZ3 LYS 80 HZ3 LYS 80 10.268 6.431 1.977
678 H ARG 81 H ARG 81 3.842 5.372 4.907
679 HA ARG 81 HA ARG 81 5.052 4.771 7.372
680 HB2 ARG 81 HB2 ARG 81 2.113 4.832 6.660
681 HB3 ARG 81 HB3 ARG 81 2.772 4.869 8.288
682 HG2 ARG 81 HG2 ARG 81 3.775 7.007 7.910
683 HG3 ARG 81 HG3 ARG 81 3.345 6.953 6.200
684 HD2 ARG 81 HD2 ARG 81 0.982 7.006 6.773
685 HD3 ARG 81 HD3 ARG 81 1.384 6.989 8.489
686 HE ARG 81 HE ARG 81 2.445 9.192 8.110
687 HH11 ARG 81 HH11 ARG 81 0.059 8.046 5.826
688 HH12 ARG 81 HH12 ARG 81 -0.420 9.640 5.322
689 HH21 ARG 81 HH21 ARG 81 1.832 11.287 7.463
690 HH22 ARG 81 HH22 ARG 81 0.591 11.482 6.254
691 H MET 82 H MET 82 2.962 2.830 5.268
692 HA MET 82 HA MET 82 2.561 0.703 7.067
693 HB2 MET 82 HB2 MET 82 1.135 1.025 5.115
694 HB3 MET 82 HB3 MET 82 2.488 0.692 4.044
695 HG2 MET 82 HG2 MET 82 2.617 -1.590 4.937
696 HG3 MET 82 HG3 MET 82 1.230 -1.252 5.970
697 HE1 MET 82 HE1 MET 82 0.995 -1.214 1.361
698 HE2 MET 82 HE2 MET 82 2.484 -1.545 2.247
699 HE3 MET 82 HE3 MET 82 1.752 0.058 2.322
700 H PHE 83 H PHE 83 4.956 1.100 4.452
701 HA PHE 83 HA PHE 83 6.088 -1.487 4.937
702 HB2 PHE 83 HB2 PHE 83 7.017 0.839 3.257
703 HB3 PHE 83 HB3 PHE 83 7.890 -0.686 3.359
704 HD1 PHE 83 HD2 PHE 83 5.912 -2.723 3.225
705 HD2 PHE 83 HD1 PHE 83 6.000 1.021 1.211
706 HE1 PHE 83 HE2 PHE 83 4.494 -3.655 1.441
707 HE2 PHE 83 HE1 PHE 83 4.587 0.100 -0.575
708 HZ PHE 83 HZ PHE 83 3.831 -2.241 -0.465
709 H ASN 84 H ASN 84 6.916 1.819 5.862
710 HA ASN 84 HA ASN 84 9.405 1.307 7.036
711 HB2 ASN 84 HB2 ASN 84 8.590 3.581 6.679
712 HB3 ASN 84 HB3 ASN 84 7.290 3.324 7.836
713 HD21 ASN 84 HD21 ASN 84 10.617 2.233 8.213
714 HD22 ASN 84 HD22 ASN 84 10.985 3.243 9.570
715 H TYR 85 H TYR 85 6.131 1.118 8.369
716 HA TYR 85 HA TYR 85 6.840 0.424 10.995
717 HB2 TYR 85 HB2 TYR 85 4.579 1.128 10.447
718 HB3 TYR 85 HB3 TYR 85 4.363 -0.267 9.394
719 HD1 TYR 85 HD1 TYR 85 4.632 0.838 12.897
720 HD2 TYR 85 HD2 TYR 85 3.845 -2.434 10.293
721 HE1 TYR 85 HE1 TYR 85 3.801 -0.476 14.803
722 HE2 TYR 85 HE2 TYR 85 3.004 -3.747 12.189
723 HH TYR 85 HH TYR 85 2.105 -2.506 15.036
724 H ALA 86 H ALA 86 6.433 -1.512 8.087
725 HA ALA 86 HA ALA 86 6.514 -4.024 9.412
726 HB1 ALA 86 HB1 ALA 86 6.769 -4.990 7.210
727 HB2 ALA 86 HB2 ALA 86 7.179 -3.415 6.533
728 HB3 ALA 86 HB3 ALA 86 5.558 -3.710 7.160
729 H ILE 87 H ILE 87 9.018 -1.994 7.902
730 HA ILE 87 HA ILE 87 11.145 -3.840 8.360
731 HB ILE 87 HB ILE 87 11.321 -0.824 8.150
732 HG12 ILE 87 HG12 ILE 87 11.548 -2.968 6.026
733 HG13 ILE 87 HG13 ILE 87 10.266 -1.768 6.160
734 HG21 ILE 87 HG21 ILE 87 13.418 -2.968 7.804
735 HG22 ILE 87 HG22 ILE 87 13.311 -1.815 9.134
736 HG23 ILE 87 HG23 ILE 87 13.656 -1.247 7.501
737 HD11 ILE 87 HD11 ILE 87 11.881 -1.205 4.423
738 HD12 ILE 87 HD12 ILE 87 13.166 -1.174 5.631
739 HD13 ILE 87 HD13 ILE 87 11.858 0.004 5.707
740 H LYS 88 H LYS 88 9.808 -1.124 10.156
741 HA LYS 88 HA LYS 88 11.455 -1.118 12.393
742 HB2 LYS 88 HB2 LYS 88 9.782 0.598 11.926
743 HB3 LYS 88 HB3 LYS 88 8.490 -0.569 12.119
744 HG2 LYS 88 HG2 LYS 88 10.319 0.031 14.401
745 HG3 LYS 88 HG3 LYS 88 8.988 1.119 14.005
746 HD2 LYS 88 HD2 LYS 88 7.639 -1.170 13.985
747 HD3 LYS 88 HD3 LYS 88 8.936 -1.650 15.081
748 HE2 LYS 88 HE2 LYS 88 7.043 0.668 15.394
749 HE3 LYS 88 HE3 LYS 88 7.097 -0.798 16.366
750 HZ1 LYS 88 HZ1 LYS 88 9.305 -0.144 17.139
751 HZ2 LYS 88 HZ2 LYS 88 8.144 1.031 17.516
752 HZ3 LYS 88 HZ3 LYS 88 9.210 1.284 16.227
753 H ARG 89 H ARG 89 8.614 -3.091 11.655
754 HA ARG 89 HA ARG 89 8.861 -4.593 14.123
755 HB2 ARG 89 HB2 ARG 89 6.669 -3.933 12.940
756 HB3 ARG 89 HB3 ARG 89 7.026 -5.232 11.812
757 HG2 ARG 89 HG2 ARG 89 6.885 -6.872 13.528
758 HG3 ARG 89 HG3 ARG 89 6.823 -5.635 14.778
759 HD2 ARG 89 HD2 ARG 89 4.659 -4.869 13.901
760 HD3 ARG 89 HD3 ARG 89 4.720 -6.139 12.679
761 HE ARG 89 HE ARG 89 4.491 -7.766 14.427
762 HH11 ARG 89 HH11 ARG 89 3.902 -4.449 15.399
763 HH12 ARG 89 HH12 ARG 89 3.105 -4.897 16.873
764 HH21 ARG 89 HH21 ARG 89 3.424 -8.342 16.354
765 HH22 ARG 89 HH22 ARG 89 2.792 -7.097 17.402
766 H HIS 90 H HIS 90 10.828 -4.560 11.774
767 HA HIS 90 HA HIS 90 12.315 -5.891 10.760
768 HB2 HIS 90 HB2 HIS 90 13.282 -7.651 12.045
769 HB3 HIS 90 HB3 HIS 90 12.795 -6.380 13.153
770 HD1 HIS 90 HD1 HIS 90 11.202 -7.017 15.014
771 HD2 HIS 90 HD2 HIS 90 11.663 -10.021 12.180
772 HE1 HIS 90 HE1 HIS 90 10.148 -9.069 16.020
773 HE2 HIS 90 HE2 HIS 90 10.539 -10.905 14.338
774 H ILE 91 H ILE 91 9.557 -6.250 9.874
775 HA ILE 91 HA ILE 91 9.312 -9.083 9.315
776 HB ILE 91 HB ILE 91 7.621 -6.833 8.216
777 HG12 ILE 91 HG12 ILE 91 7.151 -8.583 10.646
778 HG13 ILE 91 HG13 ILE 91 7.597 -6.880 10.694
779 HG21 ILE 91 HG21 ILE 91 7.148 -9.805 8.434
780 HG22 ILE 91 HG22 ILE 91 7.464 -8.904 6.953
781 HG23 ILE 91 HG23 ILE 91 5.974 -8.624 7.853
782 HD11 ILE 91 HD11 ILE 91 5.224 -7.181 11.086
783 HD12 ILE 91 HD12 ILE 91 5.060 -8.012 9.539
784 HD13 ILE 91 HD13 ILE 91 5.502 -6.304 9.581
785 H ILE 92 H ILE 92 9.781 -6.112 7.377
786 HA ILE 92 HA ILE 92 10.773 -7.843 5.205
787 HB ILE 92 HB ILE 92 10.049 -6.155 3.583
788 HG12 ILE 92 HG12 ILE 92 8.672 -4.805 5.917
789 HG13 ILE 92 HG13 ILE 92 10.128 -4.204 5.132
790 HG21 ILE 92 HG21 ILE 92 7.639 -6.580 3.725
791 HG22 ILE 92 HG22 ILE 92 7.846 -7.137 5.385
792 HG23 ILE 92 HG23 ILE 92 8.590 -8.026 4.056
793 HD11 ILE 92 HD11 ILE 92 8.157 -3.027 4.355
794 HD12 ILE 92 HD12 ILE 92 7.437 -4.550 3.834
795 HD13 ILE 92 HD13 ILE 92 8.894 -3.948 3.042
796 H GLU 93 H GLU 93 12.404 -6.968 3.853
797 HA GLU 93 HA GLU 93 14.059 -4.915 5.163
798 HB2 GLU 93 HB2 GLU 93 15.111 -7.107 5.218
799 HB3 GLU 93 HB3 GLU 93 14.864 -7.305 3.490
800 HG2 GLU 93 HG2 GLU 93 16.378 -5.395 3.098
801 HG3 GLU 93 HG3 GLU 93 16.678 -5.320 4.834
802 H TYR 94 H TYR 94 12.312 -5.764 2.369
803 HA TYR 94 HA TYR 94 13.968 -4.523 0.411
804 HB2 TYR 94 HB2 TYR 94 11.071 -5.371 0.275
805 HB3 TYR 94 HB3 TYR 94 12.040 -4.873 -1.108
806 HD1 TYR 94 HD1 TYR 94 13.903 -6.298 -1.886
807 HD2 TYR 94 HD2 TYR 94 11.292 -7.557 1.229
808 HE1 TYR 94 HE1 TYR 94 14.681 -8.610 -2.175
809 HE2 TYR 94 HE2 TYR 94 12.070 -9.875 0.952
810 HH TYR 94 HH TYR 94 14.823 -10.695 -0.730
811 H ASN 95 H ASN 95 10.976 -3.513 2.044
812 HA ASN 95 HA ASN 95 9.675 -1.709 1.872
813 HB2 ASN 95 HB2 ASN 95 11.823 -0.887 3.049
814 HB3 ASN 95 HB3 ASN 95 12.169 -0.075 1.520
815 HD21 ASN 95 HD21 ASN 95 10.669 1.450 0.739
816 HD22 ASN 95 HD22 ASN 95 9.603 2.249 1.819
817 HA PRO 96 HA PRO 96 10.177 -1.895 -2.718
818 HB2 PRO 96 HB2 PRO 96 7.615 -2.554 -3.278
819 HB3 PRO 96 HB3 PRO 96 8.825 -3.743 -2.775
820 HG2 PRO 96 HG2 PRO 96 6.715 -2.380 -1.141
821 HG3 PRO 96 HG3 PRO 96 7.183 -4.091 -1.159
822 HD2 PRO 96 HD2 PRO 96 8.035 -2.375 0.741
823 HD3 PRO 96 HD3 PRO 96 9.034 -3.727 0.168
824 H ALA 97 H ALA 97 8.578 0.221 -0.685
825 HA ALA 97 HA ALA 97 7.098 1.714 -2.615
826 HB1 ALA 97 HB1 ALA 97 6.973 3.445 -0.887
827 HB2 ALA 97 HB2 ALA 97 8.166 2.573 0.075
828 HB3 ALA 97 HB3 ALA 97 6.583 1.857 -0.228
829 H ALA 98 H ALA 98 10.391 1.432 -1.774
830 HA ALA 98 HA ALA 98 11.266 4.001 -2.677
831 HB1 ALA 98 HB1 ALA 98 13.513 3.066 -2.460
832 HB2 ALA 98 HB2 ALA 98 12.825 1.457 -2.229
833 HB3 ALA 98 HB3 ALA 98 12.538 2.720 -1.034
834 H ALA 99 H ALA 99 10.099 1.316 -4.272
835 HA ALA 99 HA ALA 99 11.783 1.351 -6.584
836 HB1 ALA 99 HB1 ALA 99 10.483 -0.629 -5.986
837 HB2 ALA 99 HB2 ALA 99 10.081 -0.064 -7.606
838 HB3 ALA 99 HB3 ALA 99 8.988 0.265 -6.263
839 H PHE 100 H PHE 100 9.347 3.372 -5.413
840 HA PHE 100 HA PHE 100 9.180 4.686 -8.044
841 HB2 PHE 100 HB2 PHE 100 7.022 3.553 -7.189
842 HB3 PHE 100 HB3 PHE 100 6.981 4.831 -5.979
843 HD1 PHE 100 HD2 PHE 100 6.857 7.228 -6.754
844 HD2 PHE 100 HD1 PHE 100 6.262 3.920 -9.368
845 HE1 PHE 100 HE2 PHE 100 5.731 8.707 -8.363
846 HE2 PHE 100 HE1 PHE 100 5.135 5.396 -10.981
847 HZ PHE 100 HZ PHE 100 4.867 7.794 -10.478
848 H ASP 101 H ASP 101 8.248 5.416 -4.700
849 HA ASP 101 HA ASP 101 8.819 7.017 -3.222
850 HB2 ASP 101 HB2 ASP 101 11.120 6.264 -3.609
851 HB3 ASP 101 HB3 ASP 101 11.266 7.389 -4.957
852 HA PRO 102 HA PRO 102 7.015 10.593 -5.180
853 HB2 PRO 102 HB2 PRO 102 6.477 11.960 -2.913
854 HB3 PRO 102 HB3 PRO 102 5.528 10.559 -3.423
855 HG2 PRO 102 HG2 PRO 102 7.727 10.719 -1.397
856 HG3 PRO 102 HG3 PRO 102 6.182 9.856 -1.304
857 HD2 PRO 102 HD2 PRO 102 8.535 8.636 -1.918
858 HD3 PRO 102 HD3 PRO 102 6.963 8.072 -2.521
859 H GLY 103 H GLY 103 9.807 10.571 -3.133
860 HA2 GLY 103 HA2 GLY 103 11.658 11.909 -3.078
861 HA3 GLY 103 HA3 GLY 103 11.063 12.662 -4.549
862 H ASP 104 H ASP 104 11.053 14.763 -4.277
863 HA ASP 104 HA ASP 104 10.355 15.889 -1.646
864 HB2 ASP 104 HB2 ASP 104 11.613 17.841 -2.268
865 HB3 ASP 104 HB3 ASP 104 12.603 16.437 -2.655
866 H ALA 105 H ALA 105 8.709 15.075 -4.196
867 HA ALA 105 HA ALA 105 7.691 17.260 -5.513
868 HB1 ALA 105 HB1 ALA 105 6.145 14.790 -4.752
869 HB2 ALA 105 HB2 ALA 105 7.246 14.919 -6.123
870 HB3 ALA 105 HB3 ALA 105 5.778 15.895 -6.076
871 H GLY 106 H GLY 106 6.750 19.021 -4.808
872 HA2 GLY 106 HA2 GLY 106 4.999 18.865 -2.433
873 HA3 GLY 106 HA3 GLY 106 5.869 20.308 -2.942
874 H GLY 107 H GLY 107 2.883 19.232 -2.688
875 HA2 GLY 107 HA2 GLY 107 1.992 19.857 -5.403
876 HA3 GLY 107 HA3 GLY 107 1.014 19.144 -4.132
877 H LYS 108 H LYS 108 2.361 21.484 -2.452
878 HA LYS 108 HA LYS 108 1.606 23.401 -1.571
879 HB2 LYS 108 HB2 LYS 108 0.865 23.837 -4.444
880 HB3 LYS 108 HB3 LYS 108 0.466 25.026 -3.210
881 HG2 LYS 108 HG2 LYS 108 3.233 24.011 -3.837
882 HG3 LYS 108 HG3 LYS 108 2.559 25.564 -4.341
883 HD2 LYS 108 HD2 LYS 108 3.054 24.641 -1.508
884 HD3 LYS 108 HD3 LYS 108 3.938 25.892 -2.382
885 HE2 LYS 108 HE2 LYS 108 1.802 27.141 -2.597
886 HE3 LYS 108 HE3 LYS 108 1.050 25.952 -1.546
887 HZ1 LYS 108 HZ1 LYS 108 2.761 26.548 0.145
888 HZ2 LYS 108 HZ2 LYS 108 1.659 27.784 -0.214
889 HZ3 LYS 108 HZ3 LYS 108 3.231 27.841 -0.851
890 H LEU 109 H LEU 109 0.056 23.584 -0.175
891 HA LEU 109 HA LEU 109 -2.329 22.011 -0.474
892 HB2 LEU 109 HB2 LEU 109 -0.932 22.497 1.655
893 HB3 LEU 109 HB3 LEU 109 -1.832 23.995 1.729
894 HG LEU 109 HG LEU 109 -2.653 22.027 3.153
895 HD11 LEU 109 HD11 LEU 109 -4.565 23.421 1.290
896 HD12 LEU 109 HD12 LEU 109 -3.978 24.025 2.841
897 HD13 LEU 109 HD13 LEU 109 -5.010 22.595 2.783
898 HD21 LEU 109 HD21 LEU 109 -3.711 21.141 0.473
899 HD22 LEU 109 HD22 LEU 109 -4.123 20.438 2.038
900 HD23 LEU 109 HD23 LEU 109 -2.475 20.312 1.422
901 H GLU 110 H GLU 110 -1.493 25.398 -0.719
902 HA GLU 110 HA GLU 110 -4.163 26.346 -0.928
903 HB2 GLU 110 HB2 GLU 110 -1.610 27.558 -2.004
904 HB3 GLU 110 HB3 GLU 110 -3.161 28.377 -1.914
905 HG2 GLU 110 HG2 GLU 110 -2.157 29.177 -0.048
906 HG3 GLU 110 HG3 GLU 110 -2.983 27.777 0.624
907 H HIS 111 H HIS 111 -5.334 25.182 -2.353
908 HA HIS 111 HA HIS 111 -4.334 24.956 -5.103
909 HB2 HIS 111 HB2 HIS 111 -5.120 22.916 -3.656
910 HB3 HIS 111 HB3 HIS 111 -6.735 23.469 -4.088
911 HD1 HIS 111 HD1 HIS 111 -3.500 22.758 -5.980
912 HD2 HIS 111 HD2 HIS 111 -7.612 22.229 -6.320
913 HE1 HIS 111 HE1 HIS 111 -3.848 21.495 -8.128
914 HE2 HIS 111 HE2 HIS 111 -6.317 21.004 -8.199
915 H HIS 112 H HIS 112 -7.410 25.522 -3.358
916 HA HIS 112 HA HIS 112 -7.817 27.790 -5.164
917 HB2 HIS 112 HB2 HIS 112 -9.215 25.759 -5.865
918 HB3 HIS 112 HB3 HIS 112 -10.127 26.019 -4.380
919 HD1 HIS 112 HD1 HIS 112 -9.542 27.444 -7.777
920 HD2 HIS 112 HD2 HIS 112 -11.783 28.300 -4.379
921 HE1 HIS 112 HE1 HIS 112 -11.181 29.213 -8.472
922 HE2 HIS 112 HE2 HIS 112 -12.345 29.886 -6.347
923 H HIS 113 H HIS 113 -9.508 26.206 -2.436
924 HA HIS 113 HA HIS 113 -9.967 26.892 -0.318
925 HB2 HIS 113 HB2 HIS 113 -7.747 28.845 -0.919
926 HB3 HIS 113 HB3 HIS 113 -8.573 28.802 0.632
927 HD1 HIS 113 HD1 HIS 113 -6.803 27.915 2.132
928 HD2 HIS 113 HD2 HIS 113 -7.210 25.652 -1.336
929 HE1 HIS 113 HE1 HIS 113 -5.282 25.937 2.432
930 HE2 HIS 113 HE2 HIS 113 -5.421 24.669 0.257
931 H HIS 114 H HIS 114 -10.417 29.048 0.999
932 HA HIS 114 HA HIS 114 -11.546 30.960 1.355
933 HB2 HIS 114 HB2 HIS 114 -10.143 31.803 -0.593
934 HB3 HIS 114 HB3 HIS 114 -11.550 31.512 -1.610
935 HD1 HIS 114 HD1 HIS 114 -10.053 33.973 0.618
936 HD2 HIS 114 HD2 HIS 114 -13.861 33.128 -0.821
937 HE1 HIS 114 HE1 HIS 114 -11.415 36.047 1.034
938 HE2 HIS 114 HE2 HIS 114 -13.767 35.408 0.397
939 H HIS 115 H HIS 115 -12.803 29.709 -1.745
940 HA HIS 115 HA HIS 115 -14.897 29.260 -2.483
941 HB2 HIS 115 HB2 HIS 115 -15.486 29.078 0.471
942 HB3 HIS 115 HB3 HIS 115 -16.720 28.826 -0.757
943 HD1 HIS 115 HD1 HIS 115 -16.672 26.633 -2.064
944 HD2 HIS 115 HD2 HIS 115 -13.562 27.014 0.672
945 HE1 HIS 115 HE1 HIS 115 -15.626 24.348 -1.899
946 HE2 HIS 115 HE2 HIS 115 -13.926 24.554 -0.051
947 H HIS 116 H HIS 116 -15.837 30.827 -3.573
948 HA HIS 116 HA HIS 116 -17.626 32.639 -2.310
949 HB2 HIS 116 HB2 HIS 116 -16.596 34.738 -2.696
950 HB3 HIS 116 HB3 HIS 116 -15.373 33.756 -1.907
951 HD1 HIS 116 HD1 HIS 116 -15.830 35.982 -4.663
952 HD2 HIS 116 HD2 HIS 116 -13.481 32.622 -3.956
953 HE1 HIS 116 HE1 HIS 116 -13.979 36.077 -6.360
954 HE2 HIS 116 HE2 HIS 116 -12.482 34.127 -5.815
Start of MODEL 11
1 H1 MET 1 H1 MET 1 4.554 -13.865 14.613
2 H2 MET 1 H2 MET 1 6.204 -14.031 14.262
3 H3 MET 1 H3 MET 1 5.456 -15.099 15.346
4 HA MET 1 HA MET 1 4.818 -14.859 12.465
5 HB2 MET 1 HB2 MET 1 6.383 -16.959 13.987
6 HB3 MET 1 HB3 MET 1 5.783 -17.180 12.351
7 HG2 MET 1 HG2 MET 1 8.085 -16.595 12.236
8 HG3 MET 1 HG3 MET 1 7.139 -15.236 11.639
9 HE1 MET 1 HE1 MET 1 10.313 -13.638 13.377
10 HE2 MET 1 HE2 MET 1 9.378 -13.709 11.884
11 HE3 MET 1 HE3 MET 1 10.218 -15.147 12.467
12 H ALA 2 H ALA 2 3.438 -16.641 11.729
13 HA ALA 2 HA ALA 2 1.553 -17.466 13.822
14 HB1 ALA 2 HB1 ALA 2 1.216 -17.491 10.824
15 HB2 ALA 2 HB2 ALA 2 0.586 -16.261 11.920
16 HB3 ALA 2 HB3 ALA 2 -0.016 -17.917 12.010
17 H GLU 3 H GLU 3 3.256 -18.985 14.481
18 HA GLU 3 HA GLU 3 3.998 -21.093 14.772
19 HB2 GLU 3 HB2 GLU 3 1.725 -21.856 14.436
20 HB3 GLU 3 HB3 GLU 3 1.924 -21.791 12.691
21 HG2 GLU 3 HG2 GLU 3 3.587 -23.561 12.800
22 HG3 GLU 3 HG3 GLU 3 3.428 -23.613 14.554
23 H LYS 4 H LYS 4 3.334 -20.980 11.275
24 HA LYS 4 HA LYS 4 5.905 -22.274 10.827
25 HB2 LYS 4 HB2 LYS 4 5.049 -22.521 8.481
26 HB3 LYS 4 HB3 LYS 4 4.072 -23.309 9.713
27 HG2 LYS 4 HG2 LYS 4 2.454 -21.515 9.636
28 HG3 LYS 4 HG3 LYS 4 3.463 -20.621 8.496
29 HD2 LYS 4 HD2 LYS 4 3.209 -22.433 6.865
30 HD3 LYS 4 HD3 LYS 4 2.184 -23.309 8.004
31 HE2 LYS 4 HE2 LYS 4 0.520 -21.594 7.930
32 HE3 LYS 4 HE3 LYS 4 1.573 -20.540 6.988
33 HZ1 LYS 4 HZ1 LYS 4 -0.083 -21.588 5.591
34 HZ2 LYS 4 HZ2 LYS 4 0.436 -23.130 6.072
35 HZ3 LYS 4 HZ3 LYS 4 1.468 -22.132 5.169
36 H ASN 5 H ASN 5 4.264 -19.237 9.991
37 HA ASN 5 HA ASN 5 6.779 -18.121 9.072
38 HB2 ASN 5 HB2 ASN 5 5.744 -19.424 7.139
39 HB3 ASN 5 HB3 ASN 5 4.451 -18.230 7.147
40 HD21 ASN 5 HD21 ASN 5 7.822 -17.512 7.814
41 HD22 ASN 5 HD22 ASN 5 8.092 -16.591 6.368
42 H ALA 6 H ALA 6 6.343 -15.794 8.205
43 HA ALA 6 HA ALA 6 4.809 -14.403 10.202
44 HB1 ALA 6 HB1 ALA 6 6.973 -13.553 9.409
45 HB2 ALA 6 HB2 ALA 6 5.679 -12.379 9.171
46 HB3 ALA 6 HB3 ALA 6 6.282 -13.313 7.802
47 H TYR 7 H TYR 7 3.354 -12.542 9.471
48 HA TYR 7 HA TYR 7 1.292 -13.747 7.855
49 HB2 TYR 7 HB2 TYR 7 -0.053 -11.724 8.537
50 HB3 TYR 7 HB3 TYR 7 0.481 -12.768 9.842
51 HD1 TYR 7 HD2 TYR 7 2.272 -12.018 11.374
52 HD2 TYR 7 HD1 TYR 7 0.678 -9.442 8.387
53 HE1 TYR 7 HE2 TYR 7 3.203 -10.077 12.561
54 HE2 TYR 7 HE1 TYR 7 1.602 -7.492 9.568
55 HH TYR 7 HH TYR 7 2.304 -6.891 11.893
56 H THR 8 H THR 8 -0.032 -11.933 6.561
57 HA THR 8 HA THR 8 1.813 -11.237 4.403
58 HB THR 8 HB THR 8 -0.264 -11.066 3.040
59 HG1 THR 8 HG1 THR 8 -2.206 -11.902 4.082
60 HG21 THR 8 HG21 THR 8 0.965 -13.181 3.156
61 HG22 THR 8 HG22 THR 8 -0.772 -13.466 3.030
62 HG23 THR 8 HG23 THR 8 0.042 -13.646 4.585
63 H VAL 9 H VAL 9 1.059 -9.258 3.063
64 HA VAL 9 HA VAL 9 1.111 -6.964 4.714
65 HB VAL 9 HB VAL 9 0.673 -5.676 2.611
66 HG11 VAL 9 HG11 VAL 9 2.939 -6.141 3.317
67 HG12 VAL 9 HG12 VAL 9 2.825 -6.258 1.561
68 HG13 VAL 9 HG13 VAL 9 2.886 -7.724 2.539
69 HG21 VAL 9 HG21 VAL 9 0.737 -8.405 1.326
70 HG22 VAL 9 HG22 VAL 9 0.703 -6.857 0.480
71 HG23 VAL 9 HG23 VAL 9 -0.678 -7.360 1.453
72 H ALA 10 H ALA 10 -1.478 -8.848 3.355
73 HA ALA 10 HA ALA 10 -3.570 -6.986 3.626
74 HB1 ALA 10 HB1 ALA 10 -5.056 -8.923 3.694
75 HB2 ALA 10 HB2 ALA 10 -3.671 -9.983 3.955
76 HB3 ALA 10 HB3 ALA 10 -3.833 -9.103 2.436
77 H GLN 11 H GLN 11 -2.150 -9.293 5.896
78 HA GLN 11 HA GLN 11 -3.872 -8.519 8.058
79 HB2 GLN 11 HB2 GLN 11 -1.296 -10.108 8.057
80 HB3 GLN 11 HB3 GLN 11 -2.357 -9.917 9.445
81 HG2 GLN 11 HG2 GLN 11 -2.975 -11.321 6.857
82 HG3 GLN 11 HG3 GLN 11 -2.768 -12.047 8.451
83 HE21 GLN 11 HE21 GLN 11 -4.414 -11.850 9.981
84 HE22 GLN 11 HE22 GLN 11 -6.018 -11.356 9.541
85 H LEU 12 H LEU 12 -0.685 -7.649 6.899
86 HA LEU 12 HA LEU 12 0.146 -6.083 9.084
87 HB2 LEU 12 HB2 LEU 12 1.643 -6.788 7.263
88 HB3 LEU 12 HB3 LEU 12 0.775 -5.754 6.146
89 HG LEU 12 HG LEU 12 1.483 -3.782 7.499
90 HD11 LEU 12 HD11 LEU 12 1.865 -4.881 9.625
91 HD12 LEU 12 HD12 LEU 12 3.336 -4.074 9.083
92 HD13 LEU 12 HD13 LEU 12 3.181 -5.824 8.928
93 HD21 LEU 12 HD21 LEU 12 3.795 -3.779 6.693
94 HD22 LEU 12 HD22 LEU 12 2.682 -4.408 5.479
95 HD23 LEU 12 HD23 LEU 12 3.695 -5.517 6.406
96 H ALA 13 H ALA 13 -1.635 -5.241 6.128
97 HA ALA 13 HA ALA 13 -1.950 -2.498 6.709
98 HB1 ALA 13 HB1 ALA 13 -3.699 -2.530 4.997
99 HB2 ALA 13 HB2 ALA 13 -3.679 -4.295 5.010
100 HB3 ALA 13 HB3 ALA 13 -2.260 -3.400 4.469
101 H ASP 14 H ASP 14 -3.679 -5.336 7.720
102 HA ASP 14 HA ASP 14 -5.988 -4.031 8.741
103 HB2 ASP 14 HB2 ASP 14 -5.935 -6.445 8.272
104 HB3 ASP 14 HB3 ASP 14 -4.730 -6.673 9.535
105 H GLU 15 H GLU 15 -2.966 -5.149 10.208
106 HA GLU 15 HA GLU 15 -3.444 -4.107 12.789
107 HB2 GLU 15 HB2 GLU 15 -1.778 -5.840 12.332
108 HB3 GLU 15 HB3 GLU 15 -0.851 -4.715 11.354
109 HG2 GLU 15 HG2 GLU 15 -0.165 -3.485 13.218
110 HG3 GLU 15 HG3 GLU 15 -1.405 -4.197 14.252
111 H TYR 16 H TYR 16 -1.937 -2.812 9.898
112 HA TYR 16 HA TYR 16 -1.061 -0.338 10.888
113 HB2 TYR 16 HB2 TYR 16 -0.350 -1.162 8.737
114 HB3 TYR 16 HB3 TYR 16 -2.005 -1.207 8.150
115 HD1 TYR 16 HD2 TYR 16 0.793 1.026 9.053
116 HD2 TYR 16 HD1 TYR 16 -3.035 0.724 7.225
117 HE1 TYR 16 HE2 TYR 16 1.082 3.269 8.086
118 HE2 TYR 16 HE1 TYR 16 -2.754 2.962 6.248
119 HH TYR 16 HH TYR 16 -1.452 5.021 6.707
120 H PHE 17 H PHE 17 -4.178 -1.384 9.607
121 HA PHE 17 HA PHE 17 -5.436 1.108 9.452
122 HB2 PHE 17 HB2 PHE 17 -6.319 -0.947 8.409
123 HB3 PHE 17 HB3 PHE 17 -6.671 -1.605 10.001
124 HD1 PHE 17 HD1 PHE 17 -7.665 0.835 7.469
125 HD2 PHE 17 HD2 PHE 17 -8.575 -0.847 11.271
126 HE1 PHE 17 HE1 PHE 17 -9.907 1.841 7.375
127 HE2 PHE 17 HE2 PHE 17 -10.817 0.160 11.182
128 HZ PHE 17 HZ PHE 17 -11.488 1.504 9.235
129 H GLU 18 H GLU 18 -5.508 -1.295 12.088
130 HA GLU 18 HA GLU 18 -7.193 0.283 13.735
131 HB2 GLU 18 HB2 GLU 18 -6.632 -1.344 15.512
132 HB3 GLU 18 HB3 GLU 18 -7.152 -2.108 14.017
133 HG2 GLU 18 HG2 GLU 18 -4.826 -2.581 13.447
134 HG3 GLU 18 HG3 GLU 18 -4.306 -1.820 14.950
135 H ARG 19 H ARG 19 -3.806 0.314 13.167
136 HA ARG 19 HA ARG 19 -3.158 1.682 15.626
137 HB2 ARG 19 HB2 ARG 19 -1.666 0.628 13.323
138 HB3 ARG 19 HB3 ARG 19 -1.003 2.102 14.008
139 HG2 ARG 19 HG2 ARG 19 0.060 0.167 14.982
140 HG3 ARG 19 HG3 ARG 19 -0.879 1.023 16.203
141 HD2 ARG 19 HD2 ARG 19 -2.627 -0.610 16.095
142 HD3 ARG 19 HD3 ARG 19 -1.885 -1.387 14.698
143 HE ARG 19 HE ARG 19 -0.137 -1.358 16.958
144 HH11 ARG 19 HH11 ARG 19 -2.888 -2.998 15.570
145 HH12 ARG 19 HH12 ARG 19 -2.549 -4.519 16.327
146 HH21 ARG 19 HH21 ARG 19 0.333 -3.377 17.977
147 HH22 ARG 19 HH22 ARG 19 -0.718 -4.735 17.696
148 H MET 20 H MET 20 -3.218 2.623 12.159
149 HA MET 20 HA MET 20 -2.668 5.363 13.017
150 HB2 MET 20 HB2 MET 20 -1.256 4.343 11.273
151 HB3 MET 20 HB3 MET 20 -2.668 4.200 10.232
152 HG2 MET 20 HG2 MET 20 -2.886 6.590 10.118
153 HG3 MET 20 HG3 MET 20 -1.594 6.801 11.297
154 HE1 MET 20 HE1 MET 20 1.561 5.635 9.332
155 HE2 MET 20 HE2 MET 20 0.555 4.656 10.399
156 HE3 MET 20 HE3 MET 20 0.940 6.321 10.832
157 H ILE 21 H ILE 21 -5.266 3.514 11.602
158 HA ILE 21 HA ILE 21 -6.715 5.892 10.722
159 HB ILE 21 HB ILE 21 -7.742 3.046 10.784
160 HG12 ILE 21 HG12 ILE 21 -5.611 3.119 9.547
161 HG13 ILE 21 HG13 ILE 21 -6.969 2.831 8.465
162 HG21 ILE 21 HG21 ILE 21 -9.184 3.819 8.952
163 HG22 ILE 21 HG22 ILE 21 -8.502 5.438 9.104
164 HG23 ILE 21 HG23 ILE 21 -9.446 4.751 10.426
165 HD11 ILE 21 HD11 ILE 21 -5.564 5.459 8.875
166 HD12 ILE 21 HD12 ILE 21 -6.927 5.176 7.793
167 HD13 ILE 21 HD13 ILE 21 -5.381 4.382 7.491
168 H ALA 22 H ALA 22 -5.997 5.221 13.589
169 HA ALA 22 HA ALA 22 -8.700 5.366 14.736
170 HB1 ALA 22 HB1 ALA 22 -7.300 3.560 15.611
171 HB2 ALA 22 HB2 ALA 22 -7.679 4.745 16.860
172 HB3 ALA 22 HB3 ALA 22 -6.085 4.740 16.104
173 H GLY 23 H GLY 23 -6.105 7.274 13.839
174 HA2 GLY 23 HA2 GLY 23 -6.243 9.146 16.058
175 HA3 GLY 23 HA3 GLY 23 -5.215 9.281 14.638
176 H ARG 24 H ARG 24 -6.428 9.737 12.565
177 HA ARG 24 HA ARG 24 -8.952 11.056 12.822
178 HB2 ARG 24 HB2 ARG 24 -8.255 13.201 11.928
179 HB3 ARG 24 HB3 ARG 24 -7.400 12.884 13.429
180 HG2 ARG 24 HG2 ARG 24 -5.404 12.941 12.434
181 HG3 ARG 24 HG3 ARG 24 -5.961 12.005 11.044
182 HD2 ARG 24 HD2 ARG 24 -6.983 13.971 10.083
183 HD3 ARG 24 HD3 ARG 24 -6.559 14.918 11.504
184 HE ARG 24 HE ARG 24 -4.197 13.856 10.474
185 HH11 ARG 24 HH11 ARG 24 -6.688 16.122 9.503
186 HH12 ARG 24 HH12 ARG 24 -5.630 17.035 8.472
187 HH21 ARG 24 HH21 ARG 24 -2.806 15.056 9.137
188 HH22 ARG 24 HH22 ARG 24 -3.416 16.428 8.257
189 H TRP 25 H TRP 25 -10.041 10.529 11.132
190 HA TRP 25 HA TRP 25 -8.762 10.194 8.555
191 HB2 TRP 25 HB2 TRP 25 -9.593 7.932 8.221
192 HB3 TRP 25 HB3 TRP 25 -8.555 7.995 9.635
193 HD1 TRP 25 HD1 TRP 25 -11.828 6.776 8.516
194 HE1 TRP 25 HE1 TRP 25 -13.252 5.973 10.507
195 HE3 TRP 25 HE3 TRP 25 -9.066 8.746 12.328
196 HZ2 TRP 25 HZ2 TRP 25 -13.209 6.158 13.315
197 HZ3 TRP 25 HZ3 TRP 25 -9.828 8.391 14.640
198 HH2 TRP 25 HH2 TRP 25 -11.852 7.132 15.116
199 H LYS 26 H LYS 26 -11.811 10.054 10.387
200 HA LYS 26 HA LYS 26 -13.816 11.053 10.017
201 HB2 LYS 26 HB2 LYS 26 -12.132 12.675 8.125
202 HB3 LYS 26 HB3 LYS 26 -13.846 12.985 8.351
203 HG2 LYS 26 HG2 LYS 26 -11.714 13.120 10.477
204 HG3 LYS 26 HG3 LYS 26 -12.518 14.490 9.706
205 HD2 LYS 26 HD2 LYS 26 -13.827 14.364 11.554
206 HD3 LYS 26 HD3 LYS 26 -14.671 13.160 10.580
207 HE2 LYS 26 HE2 LYS 26 -14.394 11.987 12.526
208 HE3 LYS 26 HE3 LYS 26 -12.932 11.524 11.663
209 HZ1 LYS 26 HZ1 LYS 26 -12.284 12.096 13.846
210 HZ2 LYS 26 HZ2 LYS 26 -13.187 13.532 13.831
211 HZ3 LYS 26 HZ3 LYS 26 -11.800 13.393 12.866
212 H HIS 27 H HIS 27 -12.822 8.782 8.245
213 HA HIS 27 HA HIS 27 -15.272 8.401 6.909
214 HB2 HIS 27 HB2 HIS 27 -14.283 8.168 4.559
215 HB3 HIS 27 HB3 HIS 27 -14.611 9.791 5.137
216 HD1 HIS 27 HD1 HIS 27 -12.784 11.414 4.788
217 HD2 HIS 27 HD2 HIS 27 -11.387 7.501 4.798
218 HE1 HIS 27 HE1 HIS 27 -10.348 11.564 4.196
219 HE2 HIS 27 HE2 HIS 27 -9.614 9.170 3.934
220 HA PRO 28 HA PRO 28 -12.973 4.844 8.535
221 HB2 PRO 28 HB2 PRO 28 -15.684 3.687 8.735
222 HB3 PRO 28 HB3 PRO 28 -14.458 3.906 9.986
223 HG2 PRO 28 HG2 PRO 28 -16.658 5.427 9.915
224 HG3 PRO 28 HG3 PRO 28 -15.088 6.091 10.411
225 HD2 PRO 28 HD2 PRO 28 -16.519 6.350 7.792
226 HD3 PRO 28 HD3 PRO 28 -15.613 7.573 8.709
227 H ASN 29 H ASN 29 -15.889 4.142 6.548
228 HA ASN 29 HA ASN 29 -14.627 1.773 5.530
229 HB2 ASN 29 HB2 ASN 29 -17.048 1.810 5.963
230 HB3 ASN 29 HB3 ASN 29 -17.248 3.074 4.753
231 HD21 ASN 29 HD21 ASN 29 -17.094 2.560 2.597
232 HD22 ASN 29 HD22 ASN 29 -17.119 0.936 2.029
233 H ILE 30 H ILE 30 -15.308 5.024 4.426
234 HA ILE 30 HA ILE 30 -14.830 4.764 1.708
235 HB ILE 30 HB ILE 30 -14.138 7.098 3.493
236 HG12 ILE 30 HG12 ILE 30 -16.498 6.491 3.586
237 HG13 ILE 30 HG13 ILE 30 -16.292 8.010 2.718
238 HG21 ILE 30 HG21 ILE 30 -14.219 8.463 1.459
239 HG22 ILE 30 HG22 ILE 30 -14.438 7.002 0.493
240 HG23 ILE 30 HG23 ILE 30 -12.937 7.255 1.385
241 HD11 ILE 30 HD11 ILE 30 -16.729 5.309 1.459
242 HD12 ILE 30 HD12 ILE 30 -16.550 6.839 0.599
243 HD13 ILE 30 HD13 ILE 30 -17.941 6.576 1.650
244 H VAL 31 H VAL 31 -12.465 5.384 4.311
245 HA VAL 31 HA VAL 31 -10.249 5.449 2.518
246 HB VAL 31 HB VAL 31 -10.217 6.506 4.791
247 HG11 VAL 31 HG11 VAL 31 -9.894 3.675 5.765
248 HG12 VAL 31 HG12 VAL 31 -11.262 4.742 6.083
249 HG13 VAL 31 HG13 VAL 31 -9.670 5.131 6.736
250 HG21 VAL 31 HG21 VAL 31 -7.883 5.945 5.277
251 HG22 VAL 31 HG22 VAL 31 -8.157 6.156 3.548
252 HG23 VAL 31 HG23 VAL 31 -8.007 4.535 4.224
253 H ARG 32 H ARG 32 -11.925 2.948 4.264
254 HA ARG 32 HA ARG 32 -9.902 0.963 4.004
255 HB2 ARG 32 HB2 ARG 32 -12.238 1.223 5.453
256 HB3 ARG 32 HB3 ARG 32 -12.630 -0.039 4.291
257 HG2 ARG 32 HG2 ARG 32 -10.096 -0.144 5.871
258 HG3 ARG 32 HG3 ARG 32 -11.621 -0.703 6.557
259 HD2 ARG 32 HD2 ARG 32 -11.793 -2.464 5.091
260 HD3 ARG 32 HD3 ARG 32 -10.801 -1.679 3.866
261 HE ARG 32 HE ARG 32 -9.065 -2.856 4.709
262 HH11 ARG 32 HH11 ARG 32 -11.265 -2.235 7.395
263 HH12 ARG 32 HH12 ARG 32 -10.239 -3.030 8.559
264 HH21 ARG 32 HH21 ARG 32 -7.755 -3.899 6.260
265 HH22 ARG 32 HH22 ARG 32 -8.278 -3.977 7.914
266 H SER 33 H SER 33 -12.740 1.882 2.114
267 HA SER 33 HA SER 33 -12.696 -0.212 0.252
268 HB2 SER 33 HB2 SER 33 -13.458 2.688 -0.194
269 HB3 SER 33 HB3 SER 33 -13.895 1.335 -1.237
270 HG SER 33 HG SER 33 -14.767 0.500 0.959
271 H ARG 34 H ARG 34 -10.834 2.765 0.481
272 HA ARG 34 HA ARG 34 -9.439 2.414 -1.981
273 HB2 ARG 34 HB2 ARG 34 -9.549 4.596 -0.832
274 HB3 ARG 34 HB3 ARG 34 -8.590 3.942 0.487
275 HG2 ARG 34 HG2 ARG 34 -6.750 3.522 -1.094
276 HG3 ARG 34 HG3 ARG 34 -7.710 4.268 -2.373
277 HD2 ARG 34 HD2 ARG 34 -7.746 6.363 -1.124
278 HD3 ARG 34 HD3 ARG 34 -6.804 5.614 0.165
279 HE ARG 34 HE ARG 34 -5.448 5.344 -2.310
280 HH11 ARG 34 HH11 ARG 34 -6.262 7.708 0.140
281 HH12 ARG 34 HH12 ARG 34 -4.888 8.719 -0.179
282 HH21 ARG 34 HH21 ARG 34 -3.618 6.674 -2.740
283 HH22 ARG 34 HH22 ARG 34 -3.384 8.135 -1.807
284 H ILE 35 H ILE 35 -8.751 1.570 1.393
285 HA ILE 35 HA ILE 35 -6.177 0.584 1.017
286 HB ILE 35 HB ILE 35 -8.280 -0.299 2.996
287 HG12 ILE 35 HG12 ILE 35 -5.909 1.565 3.273
288 HG13 ILE 35 HG13 ILE 35 -7.592 2.068 3.138
289 HG21 ILE 35 HG21 ILE 35 -6.418 -1.242 4.306
290 HG22 ILE 35 HG22 ILE 35 -5.324 -0.911 2.962
291 HG23 ILE 35 HG23 ILE 35 -6.640 -2.068 2.764
292 HD11 ILE 35 HD11 ILE 35 -6.399 0.449 5.379
293 HD12 ILE 35 HD12 ILE 35 -8.088 0.937 5.247
294 HD13 ILE 35 HD13 ILE 35 -6.830 2.158 5.436
295 H GLU 36 H GLU 36 -9.292 -1.104 0.697
296 HA GLU 36 HA GLU 36 -8.034 -3.635 0.205
297 HB2 GLU 36 HB2 GLU 36 -10.900 -2.783 -0.214
298 HB3 GLU 36 HB3 GLU 36 -10.306 -4.439 -0.255
299 HG2 GLU 36 HG2 GLU 36 -10.346 -2.582 2.109
300 HG3 GLU 36 HG3 GLU 36 -11.328 -4.025 1.865
301 H LYS 37 H LYS 37 -8.506 -0.940 -1.756
302 HA LYS 37 HA LYS 37 -8.527 -2.604 -4.174
303 HB2 LYS 37 HB2 LYS 37 -10.379 -1.073 -4.084
304 HB3 LYS 37 HB3 LYS 37 -9.314 0.275 -3.723
305 HG2 LYS 37 HG2 LYS 37 -8.832 -1.169 -6.257
306 HG3 LYS 37 HG3 LYS 37 -10.297 -0.190 -6.147
307 HD2 LYS 37 HD2 LYS 37 -7.493 0.772 -5.588
308 HD3 LYS 37 HD3 LYS 37 -8.413 1.082 -7.053
309 HE2 LYS 37 HE2 LYS 37 -10.110 2.261 -5.745
310 HE3 LYS 37 HE3 LYS 37 -9.184 1.953 -4.276
311 HZ1 LYS 37 HZ1 LYS 37 -8.690 4.139 -4.980
312 HZ2 LYS 37 HZ2 LYS 37 -8.412 3.654 -6.576
313 HZ3 LYS 37 HZ3 LYS 37 -7.320 3.201 -5.354
314 H ASP 38 H ASP 38 -6.984 0.215 -2.697
315 HA ASP 38 HA ASP 38 -4.911 0.456 -4.654
316 HB2 ASP 38 HB2 ASP 38 -5.538 1.711 -2.017
317 HB3 ASP 38 HB3 ASP 38 -3.892 1.829 -2.606
318 H ILE 39 H ILE 39 -4.994 -0.683 -1.289
319 HA ILE 39 HA ILE 39 -2.234 -1.483 -1.356
320 HB ILE 39 HB ILE 39 -4.292 -2.131 0.756
321 HG12 ILE 39 HG12 ILE 39 -4.245 0.280 0.416
322 HG13 ILE 39 HG13 ILE 39 -3.475 -0.128 1.944
323 HG21 ILE 39 HG21 ILE 39 -2.257 -3.446 0.917
324 HG22 ILE 39 HG22 ILE 39 -2.366 -2.296 2.249
325 HG23 ILE 39 HG23 ILE 39 -1.286 -1.974 0.893
326 HD11 ILE 39 HD11 ILE 39 -1.281 0.139 0.906
327 HD12 ILE 39 HD12 ILE 39 -2.248 1.608 0.783
328 HD13 ILE 39 HD13 ILE 39 -2.059 0.556 -0.620
329 H LYS 40 H LYS 40 -5.323 -3.011 -1.852
330 HA LYS 40 HA LYS 40 -3.939 -5.599 -2.132
331 HB2 LYS 40 HB2 LYS 40 -6.791 -5.063 -1.291
332 HB3 LYS 40 HB3 LYS 40 -6.195 -6.653 -1.728
333 HG2 LYS 40 HG2 LYS 40 -6.164 -6.620 0.602
334 HG3 LYS 40 HG3 LYS 40 -4.486 -6.346 0.136
335 HD2 LYS 40 HD2 LYS 40 -4.653 -4.019 0.604
336 HD3 LYS 40 HD3 LYS 40 -6.404 -4.117 0.790
337 HE2 LYS 40 HE2 LYS 40 -4.434 -5.543 2.570
338 HE3 LYS 40 HE3 LYS 40 -5.126 -3.963 2.935
339 HZ1 LYS 40 HZ1 LYS 40 -6.335 -5.735 4.048
340 HZ2 LYS 40 HZ2 LYS 40 -6.668 -6.480 2.562
341 HZ3 LYS 40 HZ3 LYS 40 -7.330 -4.960 2.916
342 HA PRO 41 HA PRO 41 -5.715 -4.643 -6.313
343 HB2 PRO 41 HB2 PRO 41 -3.425 -5.100 -7.709
344 HB3 PRO 41 HB3 PRO 41 -3.883 -3.505 -7.103
345 HG2 PRO 41 HG2 PRO 41 -1.923 -5.468 -5.999
346 HG3 PRO 41 HG3 PRO 41 -1.832 -3.699 -6.059
347 HD2 PRO 41 HD2 PRO 41 -2.509 -5.125 -3.821
348 HD3 PRO 41 HD3 PRO 41 -3.030 -3.456 -4.126
349 H ALA 42 H ALA 42 -3.054 -6.936 -5.750
350 HA ALA 42 HA ALA 42 -4.781 -9.211 -5.831
351 HB1 ALA 42 HB1 ALA 42 -2.865 -8.809 -8.135
352 HB2 ALA 42 HB2 ALA 42 -4.625 -8.794 -8.236
353 HB3 ALA 42 HB3 ALA 42 -3.780 -10.280 -7.805
354 H ILE 43 H ILE 43 -2.622 -7.817 -4.290
355 HA ILE 43 HA ILE 43 -0.740 -10.065 -4.040
356 HB ILE 43 HB ILE 43 1.005 -8.348 -3.428
357 HG12 ILE 43 HG12 ILE 43 -0.849 -6.414 -4.823
358 HG13 ILE 43 HG13 ILE 43 -0.727 -6.521 -3.072
359 HG21 ILE 43 HG21 ILE 43 1.539 -7.804 -5.761
360 HG22 ILE 43 HG22 ILE 43 -0.093 -8.268 -6.239
361 HG23 ILE 43 HG23 ILE 43 1.012 -9.478 -5.587
362 HD11 ILE 43 HD11 ILE 43 1.514 -5.827 -4.961
363 HD12 ILE 43 HD12 ILE 43 1.635 -5.916 -3.204
364 HD13 ILE 43 HD13 ILE 43 0.611 -4.693 -3.957
365 H GLY 44 H GLY 44 -3.197 -9.274 -2.532
366 HA2 GLY 44 HA2 GLY 44 -2.550 -8.089 -0.065
367 HA3 GLY 44 HA3 GLY 44 -3.913 -9.160 -0.346
368 H SER 45 H SER 45 -2.454 -11.457 -1.103
369 HA SER 45 HA SER 45 -1.456 -12.251 1.529
370 HB2 SER 45 HB2 SER 45 -2.242 -13.980 -0.827
371 HB3 SER 45 HB3 SER 45 -1.896 -14.532 0.813
372 HG SER 45 HG SER 45 -4.214 -14.070 0.024
373 H LEU 46 H LEU 46 0.135 -10.740 -0.508
374 HA LEU 46 HA LEU 46 2.064 -12.671 -1.495
375 HB2 LEU 46 HB2 LEU 46 1.305 -10.661 -2.790
376 HB3 LEU 46 HB3 LEU 46 2.162 -9.661 -1.633
377 HG LEU 46 HG LEU 46 4.261 -10.919 -2.275
378 HD11 LEU 46 HD11 LEU 46 2.507 -11.843 -4.545
379 HD12 LEU 46 HD12 LEU 46 3.227 -12.862 -3.298
380 HD13 LEU 46 HD13 LEU 46 4.260 -12.027 -4.456
381 HD21 LEU 46 HD21 LEU 46 3.803 -8.659 -3.041
382 HD22 LEU 46 HD22 LEU 46 2.876 -9.297 -4.400
383 HD23 LEU 46 HD23 LEU 46 4.610 -9.601 -4.295
384 H LYS 47 H LYS 47 1.727 -12.188 1.434
385 HA LYS 47 HA LYS 47 2.962 -12.037 3.318
386 HB2 LYS 47 HB2 LYS 47 5.162 -12.462 1.308
387 HB3 LYS 47 HB3 LYS 47 5.409 -12.496 3.047
388 HG2 LYS 47 HG2 LYS 47 3.467 -14.299 1.635
389 HG3 LYS 47 HG3 LYS 47 5.154 -14.729 1.935
390 HD2 LYS 47 HD2 LYS 47 3.021 -14.115 3.968
391 HD3 LYS 47 HD3 LYS 47 3.852 -15.654 3.706
392 HE2 LYS 47 HE2 LYS 47 5.112 -13.085 4.662
393 HE3 LYS 47 HE3 LYS 47 4.737 -14.488 5.653
394 HZ1 LYS 47 HZ1 LYS 47 6.326 -15.787 4.415
395 HZ2 LYS 47 HZ2 LYS 47 7.094 -14.388 4.994
396 HZ3 LYS 47 HZ3 LYS 47 6.637 -14.494 3.360
397 H VAL 48 H VAL 48 4.489 -10.741 4.558
398 HA VAL 48 HA VAL 48 4.731 -8.022 3.632
399 HB VAL 48 HB VAL 48 5.860 -9.281 6.144
400 HG11 VAL 48 HG11 VAL 48 5.398 -6.387 5.436
401 HG12 VAL 48 HG12 VAL 48 6.961 -7.195 5.529
402 HG13 VAL 48 HG13 VAL 48 5.987 -6.992 6.986
403 HG21 VAL 48 HG21 VAL 48 3.279 -7.768 5.758
404 HG22 VAL 48 HG22 VAL 48 3.923 -8.345 7.295
405 HG23 VAL 48 HG23 VAL 48 3.429 -9.500 6.056
406 H GLU 49 H GLU 49 6.732 -10.846 3.940
407 HA GLU 49 HA GLU 49 9.225 -9.435 3.496
408 HB2 GLU 49 HB2 GLU 49 8.730 -12.412 3.517
409 HB3 GLU 49 HB3 GLU 49 10.267 -11.591 3.727
410 HG2 GLU 49 HG2 GLU 49 9.691 -10.851 5.885
411 HG3 GLU 49 HG3 GLU 49 7.993 -11.275 5.655
412 H ASP 50 H ASP 50 6.774 -10.850 1.610
413 HA ASP 50 HA ASP 50 8.639 -11.650 -0.508
414 HB2 ASP 50 HB2 ASP 50 5.876 -12.566 0.243
415 HB3 ASP 50 HB3 ASP 50 6.575 -12.961 -1.318
416 H VAL 51 H VAL 51 6.926 -9.034 0.216
417 HA VAL 51 HA VAL 51 5.739 -8.616 -2.404
418 HB VAL 51 HB VAL 51 4.404 -7.818 -0.580
419 HG11 VAL 51 HG11 VAL 51 6.777 -6.158 0.257
420 HG12 VAL 51 HG12 VAL 51 6.099 -7.536 1.121
421 HG13 VAL 51 HG13 VAL 51 5.161 -6.052 0.959
422 HG21 VAL 51 HG21 VAL 51 5.675 -5.505 -2.039
423 HG22 VAL 51 HG22 VAL 51 4.148 -5.436 -1.160
424 HG23 VAL 51 HG23 VAL 51 4.301 -6.468 -2.581
425 H LYS 52 H LYS 52 7.110 -8.148 -3.960
426 HA LYS 52 HA LYS 52 9.446 -6.496 -3.379
427 HB2 LYS 52 HB2 LYS 52 10.231 -7.169 -5.651
428 HB3 LYS 52 HB3 LYS 52 10.032 -8.501 -4.535
429 HG2 LYS 52 HG2 LYS 52 7.888 -7.790 -6.499
430 HG3 LYS 52 HG3 LYS 52 9.264 -8.790 -6.961
431 HD2 LYS 52 HD2 LYS 52 7.287 -9.385 -4.753
432 HD3 LYS 52 HD3 LYS 52 7.346 -10.169 -6.332
433 HE2 LYS 52 HE2 LYS 52 9.524 -10.257 -4.240
434 HE3 LYS 52 HE3 LYS 52 8.368 -11.544 -4.568
435 HZ1 LYS 52 HZ1 LYS 52 10.452 -10.520 -6.426
436 HZ2 LYS 52 HZ2 LYS 52 9.283 -11.674 -6.840
437 HZ3 LYS 52 HZ3 LYS 52 10.434 -12.028 -5.652
438 HA PRO 53 HA PRO 53 7.968 -2.809 -5.073
439 HB2 PRO 53 HB2 PRO 53 10.096 -1.877 -6.523
440 HB3 PRO 53 HB3 PRO 53 10.019 -1.849 -4.759
441 HG2 PRO 53 HG2 PRO 53 11.381 -3.805 -6.563
442 HG3 PRO 53 HG3 PRO 53 11.963 -3.081 -5.051
443 HD2 PRO 53 HD2 PRO 53 10.974 -5.581 -5.148
444 HD3 PRO 53 HD3 PRO 53 10.724 -4.530 -3.741
445 H ARG 54 H ARG 54 9.027 -5.226 -7.299
446 HA ARG 54 HA ARG 54 8.432 -4.028 -9.746
447 HB2 ARG 54 HB2 ARG 54 9.351 -6.462 -9.005
448 HB3 ARG 54 HB3 ARG 54 7.693 -6.881 -9.411
449 HG2 ARG 54 HG2 ARG 54 9.672 -5.530 -11.227
450 HG3 ARG 54 HG3 ARG 54 9.168 -7.217 -11.303
451 HD2 ARG 54 HD2 ARG 54 7.178 -6.724 -12.262
452 HD3 ARG 54 HD3 ARG 54 7.006 -5.209 -11.375
453 HE ARG 54 HE ARG 54 8.874 -5.468 -13.640
454 HH11 ARG 54 HH11 ARG 54 6.120 -3.929 -12.110
455 HH12 ARG 54 HH12 ARG 54 6.159 -2.532 -13.145
456 HH21 ARG 54 HH21 ARG 54 8.912 -3.657 -15.026
457 HH22 ARG 54 HH22 ARG 54 7.740 -2.383 -14.815
458 H HIS 55 H HIS 55 6.379 -5.889 -7.552
459 HA HIS 55 HA HIS 55 4.024 -5.642 -9.123
460 HB2 HIS 55 HB2 HIS 55 4.436 -6.399 -6.229
461 HB3 HIS 55 HB3 HIS 55 2.860 -6.398 -7.011
462 HD1 HIS 55 HD1 HIS 55 4.094 -8.997 -5.873
463 HD2 HIS 55 HD2 HIS 55 4.402 -7.783 -9.835
464 HE1 HIS 55 HE1 HIS 55 4.539 -11.093 -7.187
465 HE2 HIS 55 HE2 HIS 55 4.554 -10.362 -9.604
466 H ILE 56 H ILE 56 5.452 -3.775 -6.535
467 HA ILE 56 HA ILE 56 3.323 -2.061 -5.931
468 HB ILE 56 HB ILE 56 6.286 -1.449 -5.945
469 HG12 ILE 56 HG12 ILE 56 5.754 -3.356 -4.525
470 HG13 ILE 56 HG13 ILE 56 6.167 -1.967 -3.532
471 HG21 ILE 56 HG21 ILE 56 4.027 -0.023 -4.546
472 HG22 ILE 56 HG22 ILE 56 4.979 0.594 -5.896
473 HG23 ILE 56 HG23 ILE 56 5.745 0.317 -4.333
474 HD11 ILE 56 HD11 ILE 56 3.819 -1.572 -3.073
475 HD12 ILE 56 HD12 ILE 56 4.280 -3.215 -2.624
476 HD13 ILE 56 HD13 ILE 56 3.375 -2.928 -4.110
477 H ASP 57 H ASP 57 5.770 -1.908 -8.488
478 HA ASP 57 HA ASP 57 5.023 0.606 -9.539
479 HB2 ASP 57 HB2 ASP 57 7.128 -0.352 -10.183
480 HB3 ASP 57 HB3 ASP 57 6.344 -1.794 -10.816
481 H ASP 58 H ASP 58 3.918 -2.674 -10.161
482 HA ASP 58 HA ASP 58 2.329 -2.129 -12.412
483 HB2 ASP 58 HB2 ASP 58 2.365 -4.345 -10.402
484 HB3 ASP 58 HB3 ASP 58 1.049 -4.248 -11.567
485 H VAL 59 H VAL 59 1.434 -2.221 -8.954
486 HA VAL 59 HA VAL 59 -1.304 -1.719 -9.470
487 HB VAL 59 HB VAL 59 -0.622 -2.672 -7.335
488 HG11 VAL 59 HG11 VAL 59 0.413 -1.330 -5.589
489 HG12 VAL 59 HG12 VAL 59 0.569 0.022 -6.709
490 HG13 VAL 59 HG13 VAL 59 1.474 -1.467 -6.992
491 HG21 VAL 59 HG21 VAL 59 -2.754 -1.539 -7.436
492 HG22 VAL 59 HG22 VAL 59 -1.981 -0.001 -7.057
493 HG23 VAL 59 HG23 VAL 59 -2.012 -1.291 -5.855
494 H LEU 60 H LEU 60 1.436 0.434 -8.857
495 HA LEU 60 HA LEU 60 -0.086 2.825 -8.718
496 HB2 LEU 60 HB2 LEU 60 2.791 2.433 -9.560
497 HB3 LEU 60 HB3 LEU 60 2.050 3.973 -9.171
498 HG LEU 60 HG LEU 60 2.447 1.682 -7.247
499 HD11 LEU 60 HD11 LEU 60 4.104 3.132 -6.201
500 HD12 LEU 60 HD12 LEU 60 3.846 4.344 -7.457
501 HD13 LEU 60 HD13 LEU 60 4.536 2.776 -7.874
502 HD21 LEU 60 HD21 LEU 60 1.385 4.469 -6.786
503 HD22 LEU 60 HD22 LEU 60 1.708 3.268 -5.536
504 HD23 LEU 60 HD23 LEU 60 0.445 2.978 -6.732
505 H LYS 61 H LYS 61 1.413 1.058 -11.375
506 HA LYS 61 HA LYS 61 0.909 2.861 -13.456
507 HB2 LYS 61 HB2 LYS 61 2.359 1.055 -13.879
508 HB3 LYS 61 HB3 LYS 61 1.224 -0.123 -13.241
509 HG2 LYS 61 HG2 LYS 61 -0.229 0.701 -15.280
510 HG3 LYS 61 HG3 LYS 61 1.361 1.125 -15.922
511 HD2 LYS 61 HD2 LYS 61 0.711 -1.129 -16.579
512 HD3 LYS 61 HD3 LYS 61 2.128 -1.165 -15.538
513 HE2 LYS 61 HE2 LYS 61 0.646 -1.659 -13.620
514 HE3 LYS 61 HE3 LYS 61 -0.723 -1.716 -14.727
515 HZ1 LYS 61 HZ1 LYS 61 -0.015 -3.925 -14.329
516 HZ2 LYS 61 HZ2 LYS 61 1.606 -3.553 -14.643
517 HZ3 LYS 61 HZ3 LYS 61 0.473 -3.541 -15.907
518 H ALA 62 H ALA 62 -1.104 0.438 -11.891
519 HA ALA 62 HA ALA 62 -3.267 0.659 -13.738
520 HB1 ALA 62 HB1 ALA 62 -4.528 -0.656 -12.116
521 HB2 ALA 62 HB2 ALA 62 -3.253 -0.419 -10.921
522 HB3 ALA 62 HB3 ALA 62 -2.929 -1.350 -12.383
523 H VAL 63 H VAL 63 -2.697 1.951 -10.454
524 HA VAL 63 HA VAL 63 -5.201 3.249 -10.298
525 HB VAL 63 HB VAL 63 -4.289 4.490 -8.377
526 HG11 VAL 63 HG11 VAL 63 -5.185 2.254 -8.061
527 HG12 VAL 63 HG12 VAL 63 -3.843 2.550 -6.956
528 HG13 VAL 63 HG13 VAL 63 -3.599 1.556 -8.391
529 HG21 VAL 63 HG21 VAL 63 -2.008 4.051 -7.602
530 HG22 VAL 63 HG22 VAL 63 -2.029 4.873 -9.162
531 HG23 VAL 63 HG23 VAL 63 -1.688 3.144 -9.079
532 H MET 64 H MET 64 -2.180 4.230 -11.734
533 HA MET 64 HA MET 64 -2.893 7.007 -11.871
534 HB2 MET 64 HB2 MET 64 -0.912 7.311 -13.204
535 HB3 MET 64 HB3 MET 64 -0.528 6.240 -11.868
536 HG2 MET 64 HG2 MET 64 -0.621 4.329 -13.340
537 HG3 MET 64 HG3 MET 64 -1.113 5.360 -14.683
538 HE1 MET 64 HE1 MET 64 1.777 4.567 -12.120
539 HE2 MET 64 HE2 MET 64 1.538 6.304 -11.931
540 HE3 MET 64 HE3 MET 64 3.025 5.690 -12.656
541 H LYS 65 H LYS 65 -3.572 4.206 -13.778
542 HA LYS 65 HA LYS 65 -4.330 5.832 -16.068
543 HB2 LYS 65 HB2 LYS 65 -4.500 3.822 -17.336
544 HB3 LYS 65 HB3 LYS 65 -2.986 3.815 -16.453
545 HG2 LYS 65 HG2 LYS 65 -3.613 1.702 -16.063
546 HG3 LYS 65 HG3 LYS 65 -4.462 2.471 -14.720
547 HD2 LYS 65 HD2 LYS 65 -6.456 2.664 -16.262
548 HD3 LYS 65 HD3 LYS 65 -5.588 1.592 -17.368
549 HE2 LYS 65 HE2 LYS 65 -5.299 0.104 -15.322
550 HE3 LYS 65 HE3 LYS 65 -6.595 1.052 -14.610
551 HZ1 LYS 65 HZ1 LYS 65 -8.004 0.463 -16.492
552 HZ2 LYS 65 HZ2 LYS 65 -7.489 -0.913 -15.652
553 HZ3 LYS 65 HZ3 LYS 65 -6.768 -0.507 -17.134
554 H ARG 66 H ARG 66 -5.755 3.694 -13.689
555 HA ARG 66 HA ARG 66 -8.417 4.153 -14.761
556 HB2 ARG 66 HB2 ARG 66 -9.220 2.656 -13.031
557 HB3 ARG 66 HB3 ARG 66 -7.833 1.940 -13.836
558 HG2 ARG 66 HG2 ARG 66 -7.279 1.464 -11.693
559 HG3 ARG 66 HG3 ARG 66 -6.549 3.066 -11.804
560 HD2 ARG 66 HD2 ARG 66 -7.770 2.941 -9.750
561 HD3 ARG 66 HD3 ARG 66 -8.650 4.008 -10.843
562 HE ARG 66 HE ARG 66 -9.436 1.179 -10.566
563 HH11 ARG 66 HH11 ARG 66 -10.185 4.594 -10.329
564 HH12 ARG 66 HH12 ARG 66 -11.863 4.335 -9.967
565 HH21 ARG 66 HH21 ARG 66 -11.663 0.833 -10.122
566 HH22 ARG 66 HH22 ARG 66 -12.704 2.199 -9.863
567 H GLY 67 H GLY 67 -6.382 5.957 -12.986
568 HA2 GLY 67 HA2 GLY 67 -8.599 7.493 -11.856
569 HA3 GLY 67 HA3 GLY 67 -7.315 6.984 -10.768
570 H ALA 68 H ALA 68 -5.636 8.295 -10.526
571 HA ALA 68 HA ALA 68 -4.938 10.191 -12.624
572 HB1 ALA 68 HB1 ALA 68 -5.069 12.120 -11.154
573 HB2 ALA 68 HB2 ALA 68 -5.656 11.104 -9.839
574 HB3 ALA 68 HB3 ALA 68 -6.647 11.341 -11.278
575 HA PRO 69 HA PRO 69 -0.840 9.274 -11.261
576 HB2 PRO 69 HB2 PRO 69 0.379 11.654 -11.920
577 HB3 PRO 69 HB3 PRO 69 0.033 10.354 -13.062
578 HG2 PRO 69 HG2 PRO 69 -1.492 12.869 -12.536
579 HG3 PRO 69 HG3 PRO 69 -1.148 12.065 -14.079
580 HD2 PRO 69 HD2 PRO 69 -3.547 11.867 -12.878
581 HD3 PRO 69 HD3 PRO 69 -2.841 10.518 -13.794
582 H SER 70 H SER 70 -2.443 12.196 -10.159
583 HA SER 70 HA SER 70 -0.608 12.813 -8.088
584 HB2 SER 70 HB2 SER 70 -2.263 14.444 -8.994
585 HB3 SER 70 HB3 SER 70 -3.552 13.515 -8.230
586 HG SER 70 HG SER 70 -2.586 15.418 -7.061
587 H ILE 71 H ILE 71 -3.364 10.680 -8.352
588 HA ILE 71 HA ILE 71 -3.494 10.073 -5.552
589 HB ILE 71 HB ILE 71 -4.581 8.503 -7.900
590 HG12 ILE 71 HG12 ILE 71 -5.952 10.540 -6.128
591 HG13 ILE 71 HG13 ILE 71 -5.434 10.828 -7.785
592 HG21 ILE 71 HG21 ILE 71 -4.432 7.135 -5.912
593 HG22 ILE 71 HG22 ILE 71 -6.121 7.535 -6.226
594 HG23 ILE 71 HG23 ILE 71 -5.236 8.381 -4.957
595 HD11 ILE 71 HD11 ILE 71 -7.811 10.395 -7.692
596 HD12 ILE 71 HD12 ILE 71 -7.519 8.849 -6.893
597 HD13 ILE 71 HD13 ILE 71 -6.984 9.098 -8.554
598 H ALA 72 H ALA 72 -1.974 8.710 -8.406
599 HA ALA 72 HA ALA 72 -1.108 6.272 -7.407
600 HB1 ALA 72 HB1 ALA 72 -0.990 6.931 -9.778
601 HB2 ALA 72 HB2 ALA 72 0.530 6.265 -9.182
602 HB3 ALA 72 HB3 ALA 72 0.353 8.007 -9.391
603 H ASN 73 H ASN 73 0.621 9.403 -7.358
604 HA ASN 73 HA ASN 73 2.888 8.300 -6.031
605 HB2 ASN 73 HB2 ASN 73 3.759 10.505 -5.895
606 HB3 ASN 73 HB3 ASN 73 2.908 10.409 -7.428
607 HD21 ASN 73 HD21 ASN 73 1.192 11.733 -7.796
608 HD22 ASN 73 HD22 ASN 73 0.670 12.952 -6.684
609 H ASP 74 H ASP 74 -0.103 9.712 -4.969
610 HA ASP 74 HA ASP 74 0.647 10.155 -2.267
611 HB2 ASP 74 HB2 ASP 74 -1.290 11.272 -3.247
612 HB3 ASP 74 HB3 ASP 74 -2.084 9.719 -3.492
613 H THR 75 H THR 75 -0.979 7.483 -3.937
614 HA THR 75 HA THR 75 -1.304 5.824 -1.684
615 HB THR 75 HB THR 75 -0.993 5.033 -4.589
616 HG1 THR 75 HG1 THR 75 -3.504 4.853 -3.839
617 HG21 THR 75 HG21 THR 75 -2.201 2.991 -3.939
618 HG22 THR 75 HG22 THR 75 -2.173 3.515 -2.254
619 HG23 THR 75 HG23 THR 75 -0.665 3.132 -3.085
620 H LEU 76 H LEU 76 1.381 6.251 -3.944
621 HA LEU 76 HA LEU 76 3.038 4.169 -3.083
622 HB2 LEU 76 HB2 LEU 76 3.457 5.653 -5.051
623 HB3 LEU 76 HB3 LEU 76 3.885 6.945 -3.951
624 HG LEU 76 HG LEU 76 5.412 4.354 -3.915
625 HD11 LEU 76 HD11 LEU 76 5.386 5.111 -6.239
626 HD12 LEU 76 HD12 LEU 76 6.982 5.318 -5.521
627 HD13 LEU 76 HD13 LEU 76 5.922 6.712 -5.729
628 HD21 LEU 76 HD21 LEU 76 5.791 5.946 -2.092
629 HD22 LEU 76 HD22 LEU 76 6.163 7.207 -3.266
630 HD23 LEU 76 HD23 LEU 76 7.218 5.800 -3.119
631 H ARG 77 H ARG 77 2.651 7.456 -1.854
632 HA ARG 77 HA ARG 77 4.529 7.307 0.238
633 HB2 ARG 77 HB2 ARG 77 2.040 8.974 -0.130
634 HB3 ARG 77 HB3 ARG 77 3.162 9.200 1.205
635 HG2 ARG 77 HG2 ARG 77 3.915 9.395 -1.704
636 HG3 ARG 77 HG3 ARG 77 3.510 10.771 -0.673
637 HD2 ARG 77 HD2 ARG 77 5.339 10.158 0.838
638 HD3 ARG 77 HD3 ARG 77 5.761 8.818 -0.222
639 HE ARG 77 HE ARG 77 6.835 10.285 -1.604
640 HH11 ARG 77 HH11 ARG 77 4.699 12.127 0.485
641 HH12 ARG 77 HH12 ARG 77 5.343 13.664 -0.009
642 HH21 ARG 77 HH21 ARG 77 7.690 12.286 -2.232
643 HH22 ARG 77 HH22 ARG 77 7.038 13.752 -1.565
644 H TRP 78 H TRP 78 1.089 6.580 0.092
645 HA TRP 78 HA TRP 78 0.669 5.964 2.798
646 HB2 TRP 78 HB2 TRP 78 -1.106 6.291 1.046
647 HB3 TRP 78 HB3 TRP 78 -0.712 4.695 0.424
648 HD1 TRP 78 HD1 TRP 78 -1.475 2.580 1.891
649 HE1 TRP 78 HE1 TRP 78 -3.237 2.338 3.751
650 HE3 TRP 78 HE3 TRP 78 -2.164 7.522 3.011
651 HZ2 TRP 78 HZ2 TRP 78 -4.729 4.015 5.458
652 HZ3 TRP 78 HZ3 TRP 78 -3.782 8.117 4.767
653 HH2 TRP 78 HH2 TRP 78 -5.038 6.398 5.964
654 H LEU 79 H LEU 79 1.603 3.906 0.057
655 HA LEU 79 HA LEU 79 1.803 1.457 1.383
656 HB2 LEU 79 HB2 LEU 79 3.460 2.545 -0.899
657 HB3 LEU 79 HB3 LEU 79 3.481 0.871 -0.378
658 HG LEU 79 HG LEU 79 1.003 2.268 -1.370
659 HD11 LEU 79 HD11 LEU 79 1.367 1.066 -3.470
660 HD12 LEU 79 HD12 LEU 79 2.921 0.487 -2.868
661 HD13 LEU 79 HD13 LEU 79 2.668 2.210 -3.145
662 HD21 LEU 79 HD21 LEU 79 0.190 -0.035 -1.649
663 HD22 LEU 79 HD22 LEU 79 0.565 0.342 0.032
664 HD23 LEU 79 HD23 LEU 79 1.680 -0.636 -0.922
665 H LYS 80 H LYS 80 4.138 4.077 1.049
666 HA LYS 80 HA LYS 80 6.357 2.853 2.179
667 HB2 LYS 80 HB2 LYS 80 6.191 5.032 0.883
668 HB3 LYS 80 HB3 LYS 80 5.617 5.778 2.365
669 HG2 LYS 80 HG2 LYS 80 8.222 4.318 2.274
670 HG3 LYS 80 HG3 LYS 80 8.085 5.999 1.757
671 HD2 LYS 80 HD2 LYS 80 7.216 4.976 4.451
672 HD3 LYS 80 HD3 LYS 80 8.778 5.696 4.116
673 HE2 LYS 80 HE2 LYS 80 7.589 7.739 3.312
674 HE3 LYS 80 HE3 LYS 80 6.086 7.006 3.863
675 HZ1 LYS 80 HZ1 LYS 80 6.932 6.990 6.109
676 HZ2 LYS 80 HZ2 LYS 80 7.021 8.561 5.484
677 HZ3 LYS 80 HZ3 LYS 80 8.421 7.610 5.600
678 H ARG 81 H ARG 81 3.633 4.579 3.642
679 HA ARG 81 HA ARG 81 4.598 4.622 6.295
680 HB2 ARG 81 HB2 ARG 81 1.761 4.540 5.254
681 HB3 ARG 81 HB3 ARG 81 2.186 4.807 6.935
682 HG2 ARG 81 HG2 ARG 81 3.372 6.853 6.307
683 HG3 ARG 81 HG3 ARG 81 2.914 6.585 4.621
684 HD2 ARG 81 HD2 ARG 81 0.581 6.789 5.160
685 HD3 ARG 81 HD3 ARG 81 0.938 6.848 6.884
686 HE ARG 81 HE ARG 81 1.819 8.970 5.024
687 HH11 ARG 81 HH11 ARG 81 0.226 7.899 7.957
688 HH12 ARG 81 HH12 ARG 81 0.007 9.502 8.596
689 HH21 ARG 81 HH21 ARG 81 1.549 11.104 5.861
690 HH22 ARG 81 HH22 ARG 81 0.793 11.328 7.414
691 H MET 82 H MET 82 2.589 2.285 4.546
692 HA MET 82 HA MET 82 2.116 0.554 6.715
693 HB2 MET 82 HB2 MET 82 0.801 0.514 4.629
694 HB3 MET 82 HB3 MET 82 2.202 -0.108 3.767
695 HG2 MET 82 HG2 MET 82 2.165 -2.106 5.212
696 HG3 MET 82 HG3 MET 82 0.706 -1.488 5.983
697 HE1 MET 82 HE1 MET 82 1.751 -1.322 2.180
698 HE2 MET 82 HE2 MET 82 0.955 -2.766 1.552
699 HE3 MET 82 HE3 MET 82 2.289 -2.920 2.694
700 H PHE 83 H PHE 83 4.581 0.461 4.146
701 HA PHE 83 HA PHE 83 5.818 -1.913 5.045
702 HB2 PHE 83 HB2 PHE 83 6.896 0.358 3.373
703 HB3 PHE 83 HB3 PHE 83 7.795 -1.119 3.698
704 HD1 PHE 83 HD2 PHE 83 6.010 -3.270 3.358
705 HD2 PHE 83 HD1 PHE 83 6.125 0.410 1.227
706 HE1 PHE 83 HE2 PHE 83 4.922 -4.353 1.437
707 HE2 PHE 83 HE1 PHE 83 5.038 -0.667 -0.699
708 HZ PHE 83 HZ PHE 83 4.435 -3.051 -0.595
709 H ASN 84 H ASN 84 6.384 1.491 5.797
710 HA ASN 84 HA ASN 84 8.722 1.219 7.298
711 HB2 ASN 84 HB2 ASN 84 7.940 3.410 6.692
712 HB3 ASN 84 HB3 ASN 84 6.436 3.178 7.577
713 HD21 ASN 84 HD21 ASN 84 6.367 3.623 9.705
714 HD22 ASN 84 HD22 ASN 84 7.704 4.212 10.626
715 H TYR 85 H TYR 85 5.366 0.681 8.208
716 HA TYR 85 HA TYR 85 5.822 0.335 10.976
717 HB2 TYR 85 HB2 TYR 85 3.573 0.713 9.974
718 HB3 TYR 85 HB3 TYR 85 3.636 -0.909 9.286
719 HD1 TYR 85 HD1 TYR 85 3.845 0.872 12.557
720 HD2 TYR 85 HD2 TYR 85 2.794 -2.706 10.509
721 HE1 TYR 85 HE1 TYR 85 2.929 -0.044 14.647
722 HE2 TYR 85 HE2 TYR 85 1.875 -3.633 12.594
723 HH TYR 85 HH TYR 85 1.429 -1.707 15.428
724 H ALA 86 H ALA 86 6.076 -1.811 8.213
725 HA ALA 86 HA ALA 86 6.304 -4.230 9.660
726 HB1 ALA 86 HB1 ALA 86 7.195 -5.174 7.605
727 HB2 ALA 86 HB2 ALA 86 7.415 -3.555 6.940
728 HB3 ALA 86 HB3 ALA 86 5.791 -4.162 7.266
729 H ILE 87 H ILE 87 8.606 -1.737 8.763
730 HA ILE 87 HA ILE 87 10.947 -3.150 9.503
731 HB ILE 87 HB ILE 87 10.375 -0.210 9.199
732 HG12 ILE 87 HG12 ILE 87 12.148 -0.418 7.444
733 HG13 ILE 87 HG13 ILE 87 12.214 -2.144 7.767
734 HG21 ILE 87 HG21 ILE 87 11.907 -0.353 11.073
735 HG22 ILE 87 HG22 ILE 87 12.739 0.269 9.648
736 HG23 ILE 87 HG23 ILE 87 12.974 -1.408 10.144
737 HD11 ILE 87 HD11 ILE 87 9.892 -2.353 7.046
738 HD12 ILE 87 HD12 ILE 87 10.920 -1.670 5.786
739 HD13 ILE 87 HD13 ILE 87 9.847 -0.622 6.714
740 H LYS 88 H LYS 88 8.886 -0.860 11.330
741 HA LYS 88 HA LYS 88 10.392 -1.215 13.727
742 HB2 LYS 88 HB2 LYS 88 8.531 -0.048 14.861
743 HB3 LYS 88 HB3 LYS 88 9.147 0.827 13.470
744 HG2 LYS 88 HG2 LYS 88 7.248 0.089 12.147
745 HG3 LYS 88 HG3 LYS 88 6.640 -0.835 13.524
746 HD2 LYS 88 HD2 LYS 88 7.108 2.143 13.575
747 HD3 LYS 88 HD3 LYS 88 5.555 1.400 13.195
748 HE2 LYS 88 HE2 LYS 88 5.445 0.386 15.377
749 HE3 LYS 88 HE3 LYS 88 7.078 0.934 15.758
750 HZ1 LYS 88 HZ1 LYS 88 6.358 3.176 15.811
751 HZ2 LYS 88 HZ2 LYS 88 5.243 2.295 16.737
752 HZ3 LYS 88 HZ3 LYS 88 4.834 2.794 15.169
753 H ARG 89 H ARG 89 7.881 -2.980 12.194
754 HA ARG 89 HA ARG 89 7.181 -4.596 14.463
755 HB2 ARG 89 HB2 ARG 89 6.506 -4.468 11.615
756 HB3 ARG 89 HB3 ARG 89 6.612 -6.112 12.225
757 HG2 ARG 89 HG2 ARG 89 4.921 -3.934 13.423
758 HG3 ARG 89 HG3 ARG 89 4.344 -5.198 12.332
759 HD2 ARG 89 HD2 ARG 89 5.071 -6.898 13.940
760 HD3 ARG 89 HD3 ARG 89 5.625 -5.627 15.026
761 HE ARG 89 HE ARG 89 2.798 -5.682 14.237
762 HH11 ARG 89 HH11 ARG 89 5.287 -6.074 16.695
763 HH12 ARG 89 HH12 ARG 89 4.148 -6.135 18.006
764 HH21 ARG 89 HH21 ARG 89 1.313 -5.795 15.965
765 HH22 ARG 89 HH22 ARG 89 1.901 -5.985 17.597
766 H HIS 90 H HIS 90 9.839 -4.365 12.440
767 HA HIS 90 HA HIS 90 11.814 -5.456 12.345
768 HB2 HIS 90 HB2 HIS 90 10.670 -7.116 14.598
769 HB3 HIS 90 HB3 HIS 90 12.334 -7.214 14.031
770 HD1 HIS 90 HD1 HIS 90 11.397 -6.321 16.938
771 HD2 HIS 90 HD2 HIS 90 12.599 -3.815 13.843
772 HE1 HIS 90 HE1 HIS 90 12.194 -4.205 18.044
773 HE2 HIS 90 HE2 HIS 90 13.112 -2.795 16.162
774 H ILE 91 H ILE 91 9.253 -6.379 10.988
775 HA ILE 91 HA ILE 91 9.680 -9.170 10.443
776 HB ILE 91 HB ILE 91 8.064 -7.171 8.843
777 HG12 ILE 91 HG12 ILE 91 7.137 -9.067 11.011
778 HG13 ILE 91 HG13 ILE 91 7.344 -7.330 11.220
779 HG21 ILE 91 HG21 ILE 91 8.602 -9.207 7.615
780 HG22 ILE 91 HG22 ILE 91 6.884 -9.152 8.009
781 HG23 ILE 91 HG23 ILE 91 7.971 -10.187 8.938
782 HD11 ILE 91 HD11 ILE 91 5.631 -6.933 9.523
783 HD12 ILE 91 HD12 ILE 91 5.019 -7.890 10.872
784 HD13 ILE 91 HD13 ILE 91 5.416 -8.675 9.343
785 H ILE 92 H ILE 92 9.917 -6.239 8.458
786 HA ILE 92 HA ILE 92 12.189 -7.459 7.044
787 HB ILE 92 HB ILE 92 11.499 -6.217 5.007
788 HG12 ILE 92 HG12 ILE 92 8.934 -5.699 6.539
789 HG13 ILE 92 HG13 ILE 92 10.145 -4.484 6.145
790 HG21 ILE 92 HG21 ILE 92 9.631 -7.700 4.390
791 HG22 ILE 92 HG22 ILE 92 9.468 -8.167 6.084
792 HG23 ILE 92 HG23 ILE 92 10.943 -8.557 5.199
793 HD11 ILE 92 HD11 ILE 92 8.532 -6.057 4.150
794 HD12 ILE 92 HD12 ILE 92 9.717 -4.804 3.775
795 HD13 ILE 92 HD13 ILE 92 8.235 -4.389 4.637
796 H GLU 93 H GLU 93 13.769 -5.946 6.280
797 HA GLU 93 HA GLU 93 13.702 -3.392 7.740
798 HB2 GLU 93 HB2 GLU 93 16.092 -5.123 7.074
799 HB3 GLU 93 HB3 GLU 93 16.161 -3.565 7.891
800 HG2 GLU 93 HG2 GLU 93 14.879 -4.461 9.749
801 HG3 GLU 93 HG3 GLU 93 14.745 -6.011 8.922
802 H TYR 94 H TYR 94 12.868 -4.202 4.985
803 HA TYR 94 HA TYR 94 14.389 -2.144 3.556
804 HB2 TYR 94 HB2 TYR 94 13.475 -4.799 2.424
805 HB3 TYR 94 HB3 TYR 94 14.129 -3.475 1.466
806 HD1 TYR 94 HD2 TYR 94 16.504 -2.730 1.905
807 HD2 TYR 94 HD1 TYR 94 14.904 -6.337 3.496
808 HE1 TYR 94 HE2 TYR 94 18.782 -3.564 2.292
809 HE2 TYR 94 HE1 TYR 94 17.182 -7.178 3.891
810 HH TYR 94 HH TYR 94 19.489 -6.762 2.900
811 H ASN 95 H ASN 95 13.181 -0.732 2.417
812 HA ASN 95 HA ASN 95 10.275 -1.126 2.503
813 HB2 ASN 95 HB2 ASN 95 10.888 0.673 3.940
814 HB3 ASN 95 HB3 ASN 95 11.970 1.356 2.735
815 HD21 ASN 95 HD21 ASN 95 10.991 3.317 2.872
816 HD22 ASN 95 HD22 ASN 95 9.450 3.618 2.167
817 HA PRO 96 HA PRO 96 11.428 -1.573 -1.914
818 HB2 PRO 96 HB2 PRO 96 8.875 -2.437 -2.582
819 HB3 PRO 96 HB3 PRO 96 10.220 -3.486 -2.124
820 HG2 PRO 96 HG2 PRO 96 7.952 -2.465 -0.463
821 HG3 PRO 96 HG3 PRO 96 8.721 -4.063 -0.457
822 HD2 PRO 96 HD2 PRO 96 9.252 -2.272 1.449
823 HD3 PRO 96 HD3 PRO 96 10.529 -3.325 0.802
824 H ALA 97 H ALA 97 8.815 0.219 -0.459
825 HA ALA 97 HA ALA 97 7.926 1.460 -2.880
826 HB1 ALA 97 HB1 ALA 97 6.414 1.189 -1.002
827 HB2 ALA 97 HB2 ALA 97 6.595 2.895 -1.409
828 HB3 ALA 97 HB3 ALA 97 7.434 2.229 -0.008
829 H ALA 98 H ALA 98 10.461 2.051 -0.618
830 HA ALA 98 HA ALA 98 10.685 4.877 -1.116
831 HB1 ALA 98 HB1 ALA 98 12.701 4.771 0.230
832 HB2 ALA 98 HB2 ALA 98 12.659 3.008 0.184
833 HB3 ALA 98 HB3 ALA 98 11.386 3.899 1.019
834 H ALA 99 H ALA 99 11.430 2.217 -2.945
835 HA ALA 99 HA ALA 99 13.937 3.122 -4.034
836 HB1 ALA 99 HB1 ALA 99 13.712 1.245 -5.576
837 HB2 ALA 99 HB2 ALA 99 12.058 0.979 -5.027
838 HB3 ALA 99 HB3 ALA 99 13.406 0.732 -3.916
839 H PHE 100 H PHE 100 10.816 4.166 -4.377
840 HA PHE 100 HA PHE 100 11.376 5.246 -7.056
841 HB2 PHE 100 HB2 PHE 100 8.638 4.409 -6.078
842 HB3 PHE 100 HB3 PHE 100 9.057 4.995 -7.684
843 HD1 PHE 100 HD1 PHE 100 10.734 3.561 -9.034
844 HD2 PHE 100 HD2 PHE 100 8.579 2.133 -5.654
845 HE1 PHE 100 HE1 PHE 100 11.100 1.248 -9.785
846 HE2 PHE 100 HE2 PHE 100 8.941 -0.184 -6.400
847 HZ PHE 100 HZ PHE 100 10.205 -0.628 -8.466
848 H ASP 101 H ASP 101 11.666 7.375 -6.804
849 HA ASP 101 HA ASP 101 9.941 8.822 -4.924
850 HB2 ASP 101 HB2 ASP 101 12.381 9.329 -4.902
851 HB3 ASP 101 HB3 ASP 101 12.254 9.880 -6.569
852 HA PRO 102 HA PRO 102 7.190 9.268 -8.304
853 HB2 PRO 102 HB2 PRO 102 5.798 11.248 -6.662
854 HB3 PRO 102 HB3 PRO 102 5.240 9.683 -7.257
855 HG2 PRO 102 HG2 PRO 102 5.833 10.146 -4.675
856 HG3 PRO 102 HG3 PRO 102 6.033 8.559 -5.425
857 HD2 PRO 102 HD2 PRO 102 8.073 10.615 -4.726
858 HD3 PRO 102 HD3 PRO 102 8.192 8.843 -4.686
859 H GLY 103 H GLY 103 8.299 10.293 -9.842
860 HA2 GLY 103 HA2 GLY 103 8.621 11.933 -11.404
861 HA3 GLY 103 HA3 GLY 103 7.284 12.774 -10.638
862 H ASP 104 H ASP 104 7.748 14.716 -9.952
863 HA ASP 104 HA ASP 104 10.544 15.376 -9.311
864 HB2 ASP 104 HB2 ASP 104 9.778 16.603 -11.240
865 HB3 ASP 104 HB3 ASP 104 8.297 17.073 -10.418
866 H ALA 105 H ALA 105 7.485 16.996 -8.630
867 HA ALA 105 HA ALA 105 7.169 16.408 -5.942
868 HB1 ALA 105 HB1 ALA 105 9.357 17.478 -5.594
869 HB2 ALA 105 HB2 ALA 105 8.061 18.388 -4.818
870 HB3 ALA 105 HB3 ALA 105 8.749 18.957 -6.340
871 H GLY 106 H GLY 106 7.221 19.153 -8.168
872 HA2 GLY 106 HA2 GLY 106 5.416 20.299 -9.074
873 HA3 GLY 106 HA3 GLY 106 4.338 19.349 -8.064
874 H GLY 107 H GLY 107 3.666 21.875 -8.246
875 HA2 GLY 107 HA2 GLY 107 3.145 22.936 -5.925
876 HA3 GLY 107 HA3 GLY 107 4.859 23.323 -5.995
877 H LYS 108 H LYS 108 5.058 23.848 -8.734
878 HA LYS 108 HA LYS 108 3.120 25.855 -9.435
879 HB2 LYS 108 HB2 LYS 108 4.648 27.732 -9.517
880 HB3 LYS 108 HB3 LYS 108 4.571 27.103 -7.879
881 HG2 LYS 108 HG2 LYS 108 6.689 25.967 -8.188
882 HG3 LYS 108 HG3 LYS 108 6.763 26.529 -9.860
883 HD2 LYS 108 HD2 LYS 108 6.802 28.846 -9.076
884 HD3 LYS 108 HD3 LYS 108 6.727 28.278 -7.405
885 HE2 LYS 108 HE2 LYS 108 8.842 27.075 -7.756
886 HE3 LYS 108 HE3 LYS 108 8.929 27.729 -9.388
887 HZ1 LYS 108 HZ1 LYS 108 9.116 29.925 -8.530
888 HZ2 LYS 108 HZ2 LYS 108 10.256 28.974 -7.715
889 HZ3 LYS 108 HZ3 LYS 108 8.811 29.411 -6.944
890 H LEU 109 H LEU 109 4.540 27.216 -11.377
891 HA LEU 109 HA LEU 109 5.823 25.365 -13.127
892 HB2 LEU 109 HB2 LEU 109 3.860 25.546 -14.834
893 HB3 LEU 109 HB3 LEU 109 3.852 24.308 -13.595
894 HG LEU 109 HG LEU 109 2.318 25.723 -12.241
895 HD11 LEU 109 HD11 LEU 109 2.885 27.911 -13.120
896 HD12 LEU 109 HD12 LEU 109 1.162 27.593 -13.318
897 HD13 LEU 109 HD13 LEU 109 2.247 27.462 -14.702
898 HD21 LEU 109 HD21 LEU 109 1.439 23.951 -13.640
899 HD22 LEU 109 HD22 LEU 109 1.378 25.044 -15.023
900 HD23 LEU 109 HD23 LEU 109 0.337 25.327 -13.629
901 H GLU 110 H GLU 110 5.471 26.305 -15.534
902 HA GLU 110 HA GLU 110 6.535 29.003 -15.421
903 HB2 GLU 110 HB2 GLU 110 6.141 27.088 -17.732
904 HB3 GLU 110 HB3 GLU 110 7.007 28.615 -17.817
905 HG2 GLU 110 HG2 GLU 110 8.779 27.817 -16.533
906 HG3 GLU 110 HG3 GLU 110 7.837 26.461 -15.913
907 H HIS 111 H HIS 111 5.776 30.101 -17.775
908 HA HIS 111 HA HIS 111 2.978 30.743 -17.354
909 HB2 HIS 111 HB2 HIS 111 4.935 32.351 -18.030
910 HB3 HIS 111 HB3 HIS 111 4.618 31.764 -19.657
911 HD1 HIS 111 HD1 HIS 111 3.539 33.781 -20.702
912 HD2 HIS 111 HD2 HIS 111 1.856 32.790 -17.028
913 HE1 HIS 111 HE1 HIS 111 1.554 35.304 -20.428
914 HE2 HIS 111 HE2 HIS 111 0.679 34.824 -18.115
915 H HIS 112 H HIS 112 4.430 28.260 -18.658
916 HA HIS 112 HA HIS 112 3.227 27.891 -21.207
917 HB2 HIS 112 HB2 HIS 112 5.306 26.752 -20.184
918 HB3 HIS 112 HB3 HIS 112 4.171 25.710 -19.340
919 HD1 HIS 112 HD1 HIS 112 3.893 23.550 -20.487
920 HD2 HIS 112 HD2 HIS 112 4.634 26.643 -23.173
921 HE1 HIS 112 HE1 HIS 112 3.973 22.479 -22.759
922 HE2 HIS 112 HE2 HIS 112 4.596 24.336 -24.340
923 H HIS 113 H HIS 113 1.424 26.594 -21.751
924 HA HIS 113 HA HIS 113 -0.649 25.690 -21.559
925 HB2 HIS 113 HB2 HIS 113 0.529 24.935 -18.942
926 HB3 HIS 113 HB3 HIS 113 -1.224 24.864 -19.073
927 HD1 HIS 113 HD1 HIS 113 1.377 22.628 -19.168
928 HD2 HIS 113 HD2 HIS 113 -1.705 23.410 -21.852
929 HE1 HIS 113 HE1 HIS 113 1.111 20.530 -20.532
930 HE2 HIS 113 HE2 HIS 113 -0.926 20.937 -21.954
931 H HIS 114 H HIS 114 0.240 28.489 -20.177
932 HA HIS 114 HA HIS 114 -2.475 29.055 -19.209
933 HB2 HIS 114 HB2 HIS 114 0.173 30.320 -18.595
934 HB3 HIS 114 HB3 HIS 114 -1.317 31.241 -18.382
935 HD1 HIS 114 HD1 HIS 114 0.641 30.239 -16.040
936 HD2 HIS 114 HD2 HIS 114 -2.995 28.544 -17.162
937 HE1 HIS 114 HE1 HIS 114 -0.196 29.008 -14.014
938 HE2 HIS 114 HE2 HIS 114 -2.326 27.877 -14.755
939 H HIS 115 H HIS 115 -0.740 29.226 -21.932
940 HA HIS 115 HA HIS 115 -2.726 30.820 -23.181
941 HB2 HIS 115 HB2 HIS 115 -1.419 32.615 -24.060
942 HB3 HIS 115 HB3 HIS 115 -1.164 32.606 -22.321
943 HD1 HIS 115 HD1 HIS 115 0.586 31.950 -25.577
944 HD2 HIS 115 HD2 HIS 115 1.453 32.110 -21.514
945 HE1 HIS 115 HE1 HIS 115 3.094 31.996 -25.422
946 HE2 HIS 115 HE2 HIS 115 3.578 32.341 -22.969
947 H HIS 116 H HIS 116 -2.624 30.665 -25.474
948 HA HIS 116 HA HIS 116 -1.145 28.282 -26.318
949 HB2 HIS 116 HB2 HIS 116 -3.590 28.332 -26.635
950 HB3 HIS 116 HB3 HIS 116 -3.427 29.756 -27.653
951 HD1 HIS 116 HD1 HIS 116 -2.662 26.052 -27.627
952 HD2 HIS 116 HD2 HIS 116 -2.815 29.248 -30.289
953 HE1 HIS 116 HE1 HIS 116 -2.492 25.038 -29.924
954 HE2 HIS 116 HE2 HIS 116 -2.801 26.969 -31.516
Start of MODEL 12
1 H1 MET 1 H1 MET 1 1.123 -19.091 13.334
2 H2 MET 1 H2 MET 1 1.057 -20.559 12.489
3 H3 MET 1 H3 MET 1 0.301 -19.182 11.854
4 HA MET 1 HA MET 1 3.213 -19.573 12.235
5 HB2 MET 1 HB2 MET 1 2.236 -20.869 10.371
6 HB3 MET 1 HB3 MET 1 1.543 -19.397 9.714
7 HG2 MET 1 HG2 MET 1 4.488 -19.583 10.135
8 HG3 MET 1 HG3 MET 1 3.745 -20.360 8.738
9 HE1 MET 1 HE1 MET 1 1.331 -18.377 8.132
10 HE2 MET 1 HE2 MET 1 2.369 -19.029 6.865
11 HE3 MET 1 HE3 MET 1 2.058 -17.296 6.943
12 H ALA 2 H ALA 2 0.674 -17.465 10.881
13 HA ALA 2 HA ALA 2 2.440 -15.168 11.455
14 HB1 ALA 2 HB1 ALA 2 1.517 -14.035 9.511
15 HB2 ALA 2 HB2 ALA 2 0.482 -15.421 9.169
16 HB3 ALA 2 HB3 ALA 2 2.234 -15.575 9.032
17 H GLU 3 H GLU 3 0.500 -16.377 13.202
18 HA GLU 3 HA GLU 3 -1.876 -14.690 13.023
19 HB2 GLU 3 HB2 GLU 3 -1.248 -16.941 14.937
20 HB3 GLU 3 HB3 GLU 3 -2.804 -16.146 14.741
21 HG2 GLU 3 HG2 GLU 3 -1.380 -17.827 12.692
22 HG3 GLU 3 HG3 GLU 3 -2.804 -18.284 13.627
23 H LYS 4 H LYS 4 1.030 -14.098 14.132
24 HA LYS 4 HA LYS 4 0.023 -12.478 16.347
25 HB2 LYS 4 HB2 LYS 4 2.037 -12.999 17.697
26 HB3 LYS 4 HB3 LYS 4 0.988 -14.386 17.451
27 HG2 LYS 4 HG2 LYS 4 2.489 -15.208 15.703
28 HG3 LYS 4 HG3 LYS 4 3.540 -13.814 15.957
29 HD2 LYS 4 HD2 LYS 4 3.895 -14.530 18.283
30 HD3 LYS 4 HD3 LYS 4 2.880 -15.942 17.989
31 HE2 LYS 4 HE2 LYS 4 4.439 -16.683 16.246
32 HE3 LYS 4 HE3 LYS 4 5.461 -15.284 16.577
33 HZ1 LYS 4 HZ1 LYS 4 4.799 -17.413 18.537
34 HZ2 LYS 4 HZ2 LYS 4 5.840 -16.101 18.798
35 HZ3 LYS 4 HZ3 LYS 4 6.252 -17.300 17.673
36 H ASN 5 H ASN 5 2.639 -13.096 14.057
37 HA ASN 5 HA ASN 5 2.876 -10.290 13.509
38 HB2 ASN 5 HB2 ASN 5 4.357 -10.648 15.545
39 HB3 ASN 5 HB3 ASN 5 5.349 -11.698 14.540
40 HD21 ASN 5 HD21 ASN 5 7.161 -10.393 14.653
41 HD22 ASN 5 HD22 ASN 5 7.246 -8.845 13.876
42 H ALA 6 H ALA 6 4.725 -9.996 11.828
43 HA ALA 6 HA ALA 6 5.394 -10.406 9.702
44 HB1 ALA 6 HB1 ALA 6 6.829 -12.060 10.826
45 HB2 ALA 6 HB2 ALA 6 6.367 -12.564 9.201
46 HB3 ALA 6 HB3 ALA 6 5.572 -13.278 10.605
47 H TYR 7 H TYR 7 3.019 -9.857 9.453
48 HA TYR 7 HA TYR 7 1.189 -11.954 8.759
49 HB2 TYR 7 HB2 TYR 7 0.902 -9.014 8.133
50 HB3 TYR 7 HB3 TYR 7 -0.378 -10.205 8.283
51 HD1 TYR 7 HD1 TYR 7 -1.018 -11.040 10.557
52 HD2 TYR 7 HD2 TYR 7 1.744 -7.848 10.009
53 HE1 TYR 7 HE1 TYR 7 -1.379 -10.328 12.887
54 HE2 TYR 7 HE2 TYR 7 1.394 -7.135 12.333
55 HH TYR 7 HH TYR 7 -0.382 -7.316 14.053
56 H THR 8 H THR 8 -0.081 -11.557 6.605
57 HA THR 8 HA THR 8 1.726 -11.527 4.367
58 HB THR 8 HB THR 8 -0.456 -11.577 3.043
59 HG1 THR 8 HG1 THR 8 -1.847 -12.432 5.276
60 HG21 THR 8 HG21 THR 8 0.843 -13.601 3.537
61 HG22 THR 8 HG22 THR 8 -0.890 -13.925 3.560
62 HG23 THR 8 HG23 THR 8 -0.002 -13.765 5.076
63 H VAL 9 H VAL 9 1.094 -10.024 2.462
64 HA VAL 9 HA VAL 9 1.507 -7.369 3.352
65 HB VAL 9 HB VAL 9 2.341 -8.249 1.188
66 HG11 VAL 9 HG11 VAL 9 0.426 -9.514 0.458
67 HG12 VAL 9 HG12 VAL 9 0.837 -8.300 -0.753
68 HG13 VAL 9 HG13 VAL 9 -0.536 -8.043 0.324
69 HG21 VAL 9 HG21 VAL 9 1.906 -6.221 -0.127
70 HG22 VAL 9 HG22 VAL 9 2.290 -5.863 1.556
71 HG23 VAL 9 HG23 VAL 9 0.619 -5.784 0.997
72 H ALA 10 H ALA 10 -1.338 -9.202 2.598
73 HA ALA 10 HA ALA 10 -3.125 -6.984 2.383
74 HB1 ALA 10 HB1 ALA 10 -4.898 -8.658 2.551
75 HB2 ALA 10 HB2 ALA 10 -3.707 -9.879 3.000
76 HB3 ALA 10 HB3 ALA 10 -3.662 -9.152 1.394
77 H GLN 11 H GLN 11 -2.338 -9.300 4.970
78 HA GLN 11 HA GLN 11 -4.109 -8.195 6.878
79 HB2 GLN 11 HB2 GLN 11 -1.679 -9.955 7.151
80 HB3 GLN 11 HB3 GLN 11 -2.640 -9.450 8.533
81 HG2 GLN 11 HG2 GLN 11 -3.945 -10.795 6.212
82 HG3 GLN 11 HG3 GLN 11 -3.072 -11.741 7.413
83 HE21 GLN 11 HE21 GLN 11 -4.889 -8.819 8.148
84 HE22 GLN 11 HE22 GLN 11 -6.114 -9.611 9.079
85 H LEU 12 H LEU 12 -0.938 -7.276 5.847
86 HA LEU 12 HA LEU 12 -0.110 -5.801 8.087
87 HB2 LEU 12 HB2 LEU 12 1.343 -6.343 6.163
88 HB3 LEU 12 HB3 LEU 12 0.425 -5.230 5.167
89 HG LEU 12 HG LEU 12 1.142 -3.365 6.636
90 HD11 LEU 12 HD11 LEU 12 2.952 -3.732 8.229
91 HD12 LEU 12 HD12 LEU 12 2.871 -5.468 7.931
92 HD13 LEU 12 HD13 LEU 12 1.508 -4.637 8.682
93 HD21 LEU 12 HD21 LEU 12 3.468 -3.301 5.870
94 HD22 LEU 12 HD22 LEU 12 2.374 -3.846 4.599
95 HD23 LEU 12 HD23 LEU 12 3.375 -5.014 5.462
96 H ALA 13 H ALA 13 -2.377 -5.109 5.531
97 HA ALA 13 HA ALA 13 -2.655 -2.326 5.991
98 HB1 ALA 13 HB1 ALA 13 -4.727 -2.522 4.712
99 HB2 ALA 13 HB2 ALA 13 -4.629 -4.280 4.820
100 HB3 ALA 13 HB3 ALA 13 -3.403 -3.381 3.925
101 H ASP 14 H ASP 14 -4.340 -5.179 7.227
102 HA ASP 14 HA ASP 14 -6.273 -3.858 8.784
103 HB2 ASP 14 HB2 ASP 14 -4.949 -6.546 9.241
104 HB3 ASP 14 HB3 ASP 14 -6.383 -5.981 10.087
105 H GLU 15 H GLU 15 -3.002 -4.926 9.496
106 HA GLU 15 HA GLU 15 -2.970 -4.202 12.223
107 HB2 GLU 15 HB2 GLU 15 -1.358 -5.760 11.333
108 HB3 GLU 15 HB3 GLU 15 -0.763 -4.568 10.191
109 HG2 GLU 15 HG2 GLU 15 0.790 -4.881 12.019
110 HG3 GLU 15 HG3 GLU 15 0.140 -3.245 12.018
111 H TYR 16 H TYR 16 -2.028 -2.480 9.279
112 HA TYR 16 HA TYR 16 -0.892 -0.268 10.657
113 HB2 TYR 16 HB2 TYR 16 -0.171 -0.810 8.406
114 HB3 TYR 16 HB3 TYR 16 -1.797 -0.546 7.786
115 HD1 TYR 16 HD1 TYR 16 1.102 1.170 9.343
116 HD2 TYR 16 HD2 TYR 16 -2.515 1.608 7.145
117 HE1 TYR 16 HE1 TYR 16 1.642 3.533 8.930
118 HE2 TYR 16 HE2 TYR 16 -1.982 3.970 6.729
119 HH TYR 16 HH TYR 16 -0.637 5.747 7.686
120 H PHE 17 H PHE 17 -4.072 -0.766 9.096
121 HA PHE 17 HA PHE 17 -4.811 1.966 9.340
122 HB2 PHE 17 HB2 PHE 17 -6.725 1.412 8.237
123 HB3 PHE 17 HB3 PHE 17 -5.821 -0.052 7.877
124 HD1 PHE 17 HD2 PHE 17 -6.278 -2.121 9.190
125 HD2 PHE 17 HD1 PHE 17 -8.689 1.364 9.531
126 HE1 PHE 17 HE2 PHE 17 -8.067 -3.462 10.216
127 HE2 PHE 17 HE1 PHE 17 -10.483 0.032 10.553
128 HZ PHE 17 HZ PHE 17 -10.172 -2.386 10.899
129 H GLU 18 H GLU 18 -5.080 -0.788 11.444
130 HA GLU 18 HA GLU 18 -7.061 0.180 13.194
131 HB2 GLU 18 HB2 GLU 18 -5.529 -2.126 12.937
132 HB3 GLU 18 HB3 GLU 18 -5.019 -1.453 14.480
133 HG2 GLU 18 HG2 GLU 18 -7.853 -2.064 13.687
134 HG3 GLU 18 HG3 GLU 18 -6.838 -3.060 14.725
135 H ARG 19 H ARG 19 -3.767 1.049 12.768
136 HA ARG 19 HA ARG 19 -3.613 2.190 15.462
137 HB2 ARG 19 HB2 ARG 19 -1.360 2.192 13.475
138 HB3 ARG 19 HB3 ARG 19 -1.278 2.264 15.228
139 HG2 ARG 19 HG2 ARG 19 -1.948 -0.121 13.527
140 HG3 ARG 19 HG3 ARG 19 -0.518 0.120 14.530
141 HD2 ARG 19 HD2 ARG 19 -1.945 0.117 16.532
142 HD3 ARG 19 HD3 ARG 19 -3.358 -0.160 15.515
143 HE ARG 19 HE ARG 19 -1.404 -2.149 15.014
144 HH11 ARG 19 HH11 ARG 19 -3.837 -1.223 17.385
145 HH12 ARG 19 HH12 ARG 19 -3.983 -2.836 18.023
146 HH21 ARG 19 HH21 ARG 19 -1.618 -4.224 15.834
147 HH22 ARG 19 HH22 ARG 19 -2.710 -4.538 17.156
148 H MET 20 H MET 20 -3.256 3.119 12.054
149 HA MET 20 HA MET 20 -2.873 5.908 12.848
150 HB2 MET 20 HB2 MET 20 -2.716 4.609 10.125
151 HB3 MET 20 HB3 MET 20 -2.321 6.284 10.476
152 HG2 MET 20 HG2 MET 20 -0.902 3.886 11.612
153 HG3 MET 20 HG3 MET 20 -0.335 4.870 10.265
154 HE1 MET 20 HE1 MET 20 1.449 4.233 12.812
155 HE2 MET 20 HE2 MET 20 2.154 5.816 13.137
156 HE3 MET 20 HE3 MET 20 1.999 5.243 11.475
157 H ILE 21 H ILE 21 -5.294 3.872 11.432
158 HA ILE 21 HA ILE 21 -6.892 6.209 10.605
159 HB ILE 21 HB ILE 21 -7.360 3.316 9.860
160 HG12 ILE 21 HG12 ILE 21 -5.808 5.456 8.380
161 HG13 ILE 21 HG13 ILE 21 -5.151 3.971 9.058
162 HG21 ILE 21 HG21 ILE 21 -8.336 5.912 8.671
163 HG22 ILE 21 HG22 ILE 21 -9.299 4.747 9.582
164 HG23 ILE 21 HG23 ILE 21 -8.645 4.310 8.004
165 HD11 ILE 21 HD11 ILE 21 -5.396 3.801 6.654
166 HD12 ILE 21 HD12 ILE 21 -7.116 4.165 6.788
167 HD13 ILE 21 HD13 ILE 21 -6.476 2.670 7.469
168 H ALA 22 H ALA 22 -6.476 5.249 13.329
169 HA ALA 22 HA ALA 22 -9.249 4.551 14.016
170 HB1 ALA 22 HB1 ALA 22 -8.389 3.702 16.128
171 HB2 ALA 22 HB2 ALA 22 -6.754 4.173 15.662
172 HB3 ALA 22 HB3 ALA 22 -7.599 2.911 14.765
173 H GLY 23 H GLY 23 -7.561 7.190 13.590
174 HA2 GLY 23 HA2 GLY 23 -8.232 8.533 16.106
175 HA3 GLY 23 HA3 GLY 23 -7.282 9.212 14.790
176 H ARG 24 H ARG 24 -8.270 10.475 13.315
177 HA ARG 24 HA ARG 24 -11.209 10.423 13.264
178 HB2 ARG 24 HB2 ARG 24 -10.277 12.498 14.326
179 HB3 ARG 24 HB3 ARG 24 -9.493 12.870 12.799
180 HG2 ARG 24 HG2 ARG 24 -12.451 12.430 12.886
181 HG3 ARG 24 HG3 ARG 24 -11.770 13.976 13.392
182 HD2 ARG 24 HD2 ARG 24 -10.841 14.373 11.255
183 HD3 ARG 24 HD3 ARG 24 -11.118 12.712 10.741
184 HE ARG 24 HE ARG 24 -13.549 14.071 11.395
185 HH11 ARG 24 HH11 ARG 24 -11.129 13.656 8.900
186 HH12 ARG 24 HH12 ARG 24 -12.218 14.024 7.602
187 HH21 ARG 24 HH21 ARG 24 -15.003 14.534 9.669
188 HH22 ARG 24 HH22 ARG 24 -14.405 14.530 8.029
189 H TRP 25 H TRP 25 -11.336 9.052 11.565
190 HA TRP 25 HA TRP 25 -10.142 9.958 9.041
191 HB2 TRP 25 HB2 TRP 25 -10.171 7.653 8.298
192 HB3 TRP 25 HB3 TRP 25 -9.376 7.732 9.854
193 HD1 TRP 25 HD1 TRP 25 -11.960 5.903 8.043
194 HE1 TRP 25 HE1 TRP 25 -13.282 4.360 9.618
195 HE3 TRP 25 HE3 TRP 25 -10.402 7.775 12.525
196 HZ2 TRP 25 HZ2 TRP 25 -13.629 3.985 12.377
197 HZ3 TRP 25 HZ3 TRP 25 -11.280 6.767 14.587
198 HH2 TRP 25 HH2 TRP 25 -12.860 4.912 14.513
199 H LYS 26 H LYS 26 -13.026 8.514 10.475
200 HA LYS 26 HA LYS 26 -15.226 8.730 10.075
201 HB2 LYS 26 HB2 LYS 26 -14.149 11.199 9.180
202 HB3 LYS 26 HB3 LYS 26 -15.384 10.704 8.028
203 HG2 LYS 26 HG2 LYS 26 -16.228 12.118 9.885
204 HG3 LYS 26 HG3 LYS 26 -17.033 10.550 9.751
205 HD2 LYS 26 HD2 LYS 26 -15.468 9.698 11.510
206 HD3 LYS 26 HD3 LYS 26 -14.887 11.352 11.718
207 HE2 LYS 26 HE2 LYS 26 -17.080 12.079 12.392
208 HE3 LYS 26 HE3 LYS 26 -17.757 10.488 12.048
209 HZ1 LYS 26 HZ1 LYS 26 -16.405 9.547 13.793
210 HZ2 LYS 26 HZ2 LYS 26 -17.331 10.822 14.425
211 HZ3 LYS 26 HZ3 LYS 26 -15.682 11.049 14.103
212 H HIS 27 H HIS 27 -16.772 7.881 8.790
213 HA HIS 27 HA HIS 27 -17.565 6.382 7.269
214 HB2 HIS 27 HB2 HIS 27 -17.024 8.703 5.958
215 HB3 HIS 27 HB3 HIS 27 -16.060 7.573 5.017
216 HD1 HIS 27 HD1 HIS 27 -18.355 8.915 3.626
217 HD2 HIS 27 HD2 HIS 27 -18.775 5.320 5.684
218 HE1 HIS 27 HE1 HIS 27 -20.391 7.805 2.649
219 HE2 HIS 27 HE2 HIS 27 -20.729 5.722 4.026
220 HA PRO 28 HA PRO 28 -13.370 4.257 7.742
221 HB2 PRO 28 HB2 PRO 28 -14.609 1.853 8.478
222 HB3 PRO 28 HB3 PRO 28 -13.950 3.066 9.579
223 HG2 PRO 28 HG2 PRO 28 -16.766 2.636 8.696
224 HG3 PRO 28 HG3 PRO 28 -16.147 3.115 10.287
225 HD2 PRO 28 HD2 PRO 28 -17.268 4.901 8.653
226 HD3 PRO 28 HD3 PRO 28 -15.853 5.329 9.638
227 H ASN 29 H ASN 29 -16.318 3.157 6.116
228 HA ASN 29 HA ASN 29 -15.161 1.027 4.673
229 HB2 ASN 29 HB2 ASN 29 -17.537 1.096 4.880
230 HB3 ASN 29 HB3 ASN 29 -17.619 2.713 4.191
231 HD21 ASN 29 HD21 ASN 29 -17.579 2.975 2.008
232 HD22 ASN 29 HD22 ASN 29 -17.662 1.660 0.893
233 H ILE 30 H ILE 30 -15.359 4.472 4.060
234 HA ILE 30 HA ILE 30 -14.768 4.418 1.300
235 HB ILE 30 HB ILE 30 -14.322 6.576 3.368
236 HG12 ILE 30 HG12 ILE 30 -16.661 6.032 2.973
237 HG13 ILE 30 HG13 ILE 30 -16.292 7.606 2.279
238 HG21 ILE 30 HG21 ILE 30 -14.092 6.808 0.370
239 HG22 ILE 30 HG22 ILE 30 -12.754 6.883 1.514
240 HG23 ILE 30 HG23 ILE 30 -13.994 8.137 1.525
241 HD11 ILE 30 HD11 ILE 30 -16.172 6.614 0.061
242 HD12 ILE 30 HD12 ILE 30 -17.728 6.287 0.823
243 HD13 ILE 30 HD13 ILE 30 -16.501 5.023 0.748
244 H VAL 31 H VAL 31 -12.650 4.921 4.126
245 HA VAL 31 HA VAL 31 -10.286 5.023 2.545
246 HB VAL 31 HB VAL 31 -10.417 6.098 4.754
247 HG11 VAL 31 HG11 VAL 31 -10.401 3.296 5.857
248 HG12 VAL 31 HG12 VAL 31 -11.729 4.454 5.958
249 HG13 VAL 31 HG13 VAL 31 -10.212 4.774 6.801
250 HG21 VAL 31 HG21 VAL 31 -8.209 5.407 5.573
251 HG22 VAL 31 HG22 VAL 31 -8.245 5.610 3.821
252 HG23 VAL 31 HG23 VAL 31 -8.278 3.992 4.521
253 H ARG 32 H ARG 32 -12.001 2.456 4.245
254 HA ARG 32 HA ARG 32 -10.048 0.454 4.102
255 HB2 ARG 32 HB2 ARG 32 -12.208 0.299 5.368
256 HB3 ARG 32 HB3 ARG 32 -13.037 0.064 3.838
257 HG2 ARG 32 HG2 ARG 32 -12.751 -2.076 4.807
258 HG3 ARG 32 HG3 ARG 32 -11.599 -1.961 3.475
259 HD2 ARG 32 HD2 ARG 32 -9.860 -1.303 5.160
260 HD3 ARG 32 HD3 ARG 32 -11.033 -1.671 6.422
261 HE ARG 32 HE ARG 32 -10.319 -3.762 4.483
262 HH11 ARG 32 HH11 ARG 32 -10.359 -2.570 7.770
263 HH12 ARG 32 HH12 ARG 32 -9.732 -4.040 8.453
264 HH21 ARG 32 HH21 ARG 32 -9.462 -5.681 5.375
265 HH22 ARG 32 HH22 ARG 32 -9.153 -5.784 7.085
266 H SER 33 H SER 33 -12.565 1.398 1.804
267 HA SER 33 HA SER 33 -12.190 -0.553 -0.132
268 HB2 SER 33 HB2 SER 33 -14.050 1.088 -0.106
269 HB3 SER 33 HB3 SER 33 -12.919 2.358 -0.569
270 HG SER 33 HG SER 33 -13.804 0.125 -2.074
271 H ARG 34 H ARG 34 -10.627 2.639 0.131
272 HA ARG 34 HA ARG 34 -9.059 2.453 -2.186
273 HB2 ARG 34 HB2 ARG 34 -8.888 4.069 0.322
274 HB3 ARG 34 HB3 ARG 34 -7.500 4.044 -0.754
275 HG2 ARG 34 HG2 ARG 34 -8.877 5.963 -1.222
276 HG3 ARG 34 HG3 ARG 34 -8.921 4.847 -2.586
277 HD2 ARG 34 HD2 ARG 34 -11.093 4.043 -1.910
278 HD3 ARG 34 HD3 ARG 34 -11.038 5.019 -0.444
279 HE ARG 34 HE ARG 34 -10.723 6.710 -2.671
280 HH11 ARG 34 HH11 ARG 34 -13.190 4.727 -1.149
281 HH12 ARG 34 HH12 ARG 34 -14.501 5.706 -1.723
282 HH21 ARG 34 HH21 ARG 34 -12.461 8.008 -3.392
283 HH22 ARG 34 HH22 ARG 34 -14.095 7.577 -2.977
284 H ILE 35 H ILE 35 -8.393 1.437 1.136
285 HA ILE 35 HA ILE 35 -5.690 0.768 0.754
286 HB ILE 35 HB ILE 35 -7.661 -0.430 2.704
287 HG12 ILE 35 HG12 ILE 35 -5.670 1.818 3.060
288 HG13 ILE 35 HG13 ILE 35 -7.407 2.032 2.871
289 HG21 ILE 35 HG21 ILE 35 -5.682 -1.831 2.424
290 HG22 ILE 35 HG22 ILE 35 -5.694 -1.057 4.010
291 HG23 ILE 35 HG23 ILE 35 -4.647 -0.437 2.734
292 HD11 ILE 35 HD11 ILE 35 -6.041 0.592 5.133
293 HD12 ILE 35 HD12 ILE 35 -7.782 0.808 4.943
294 HD13 ILE 35 HD13 ILE 35 -6.743 2.209 5.194
295 H GLU 36 H GLU 36 -8.650 -1.099 0.268
296 HA GLU 36 HA GLU 36 -7.139 -3.551 -0.003
297 HB2 GLU 36 HB2 GLU 36 -10.110 -3.104 -0.249
298 HB3 GLU 36 HB3 GLU 36 -9.299 -4.658 -0.102
299 HG2 GLU 36 HG2 GLU 36 -8.434 -3.911 2.110
300 HG3 GLU 36 HG3 GLU 36 -9.448 -2.478 1.961
301 H LYS 37 H LYS 37 -8.927 -1.371 -2.186
302 HA LYS 37 HA LYS 37 -8.273 -3.288 -4.322
303 HB2 LYS 37 HB2 LYS 37 -10.073 -2.280 -5.660
304 HB3 LYS 37 HB3 LYS 37 -10.646 -2.977 -4.156
305 HG2 LYS 37 HG2 LYS 37 -11.843 -1.012 -4.325
306 HG3 LYS 37 HG3 LYS 37 -10.523 -0.578 -3.240
307 HD2 LYS 37 HD2 LYS 37 -10.912 1.171 -4.899
308 HD3 LYS 37 HD3 LYS 37 -9.321 0.444 -5.114
309 HE2 LYS 37 HE2 LYS 37 -10.455 0.804 -7.257
310 HE3 LYS 37 HE3 LYS 37 -10.155 -0.905 -6.950
311 HZ1 LYS 37 HZ1 LYS 37 -12.409 -1.280 -6.470
312 HZ2 LYS 37 HZ2 LYS 37 -12.420 -0.291 -7.850
313 HZ3 LYS 37 HZ3 LYS 37 -12.754 0.376 -6.322
314 H ASP 38 H ASP 38 -7.161 -0.422 -3.105
315 HA ASP 38 HA ASP 38 -6.129 0.349 -5.761
316 HB2 ASP 38 HB2 ASP 38 -7.573 2.052 -4.507
317 HB3 ASP 38 HB3 ASP 38 -6.240 2.197 -3.371
318 H ILE 39 H ILE 39 -5.298 0.421 -2.304
319 HA ILE 39 HA ILE 39 -2.500 0.646 -2.770
320 HB ILE 39 HB ILE 39 -3.952 -0.183 -0.251
321 HG12 ILE 39 HG12 ILE 39 -2.955 2.526 -1.159
322 HG13 ILE 39 HG13 ILE 39 -4.641 2.028 -1.088
323 HG21 ILE 39 HG21 ILE 39 -1.925 0.488 0.922
324 HG22 ILE 39 HG22 ILE 39 -1.141 0.846 -0.617
325 HG23 ILE 39 HG23 ILE 39 -1.591 -0.812 -0.222
326 HD11 ILE 39 HD11 ILE 39 -4.088 3.425 0.799
327 HD12 ILE 39 HD12 ILE 39 -2.772 2.340 1.251
328 HD13 ILE 39 HD13 ILE 39 -4.444 1.787 1.346
329 H LYS 40 H LYS 40 -4.564 -2.084 -1.745
330 HA LYS 40 HA LYS 40 -2.434 -3.916 -2.653
331 HB2 LYS 40 HB2 LYS 40 -4.426 -4.076 -0.443
332 HB3 LYS 40 HB3 LYS 40 -4.002 -5.569 -1.264
333 HG2 LYS 40 HG2 LYS 40 -2.662 -5.256 0.726
334 HG3 LYS 40 HG3 LYS 40 -1.659 -5.216 -0.722
335 HD2 LYS 40 HD2 LYS 40 -1.705 -2.744 -0.634
336 HD3 LYS 40 HD3 LYS 40 -2.600 -2.849 0.884
337 HE2 LYS 40 HE2 LYS 40 -0.785 -3.990 1.937
338 HE3 LYS 40 HE3 LYS 40 0.101 -4.090 0.419
339 HZ1 LYS 40 HZ1 LYS 40 0.973 -2.322 1.768
340 HZ2 LYS 40 HZ2 LYS 40 -0.553 -1.616 1.917
341 HZ3 LYS 40 HZ3 LYS 40 0.214 -1.656 0.410
342 HA PRO 41 HA PRO 41 -6.276 -4.118 -5.375
343 HB2 PRO 41 HB2 PRO 41 -5.098 -3.813 -7.793
344 HB3 PRO 41 HB3 PRO 41 -5.570 -2.447 -6.777
345 HG2 PRO 41 HG2 PRO 41 -2.877 -3.685 -7.158
346 HG3 PRO 41 HG3 PRO 41 -3.319 -1.971 -7.044
347 HD2 PRO 41 HD2 PRO 41 -2.270 -3.387 -4.966
348 HD3 PRO 41 HD3 PRO 41 -3.366 -2.008 -4.751
349 H ALA 42 H ALA 42 -3.124 -5.632 -5.966
350 HA ALA 42 HA ALA 42 -4.545 -8.089 -6.701
351 HB1 ALA 42 HB1 ALA 42 -2.121 -7.009 -8.129
352 HB2 ALA 42 HB2 ALA 42 -3.770 -7.014 -8.754
353 HB3 ALA 42 HB3 ALA 42 -2.930 -8.539 -8.469
354 H ILE 43 H ILE 43 -2.568 -6.705 -4.559
355 HA ILE 43 HA ILE 43 -0.939 -9.122 -4.194
356 HB ILE 43 HB ILE 43 0.500 -7.577 -2.727
357 HG12 ILE 43 HG12 ILE 43 -0.723 -5.444 -4.484
358 HG13 ILE 43 HG13 ILE 43 -1.262 -5.726 -2.834
359 HG21 ILE 43 HG21 ILE 43 1.799 -6.838 -4.676
360 HG22 ILE 43 HG22 ILE 43 0.427 -7.213 -5.720
361 HG23 ILE 43 HG23 ILE 43 1.247 -8.505 -4.843
362 HD11 ILE 43 HD11 ILE 43 1.505 -4.916 -3.703
363 HD12 ILE 43 HD12 ILE 43 1.015 -5.247 -2.041
364 HD13 ILE 43 HD13 ILE 43 0.305 -3.891 -2.917
365 H GLY 44 H GLY 44 -2.192 -10.319 -2.896
366 HA2 GLY 44 HA2 GLY 44 -2.581 -9.292 -0.175
367 HA3 GLY 44 HA3 GLY 44 -3.959 -9.992 -1.013
368 H SER 45 H SER 45 -2.676 -12.065 -2.347
369 HA SER 45 HA SER 45 -2.481 -13.978 -0.208
370 HB2 SER 45 HB2 SER 45 -2.169 -14.423 -3.184
371 HB3 SER 45 HB3 SER 45 -2.582 -15.627 -1.962
372 HG SER 45 HG SER 45 -4.354 -13.712 -1.696
373 H LEU 46 H LEU 46 -0.331 -12.055 -0.368
374 HA LEU 46 HA LEU 46 1.894 -13.935 -0.392
375 HB2 LEU 46 HB2 LEU 46 3.361 -12.182 -1.463
376 HB3 LEU 46 HB3 LEU 46 2.228 -12.984 -2.530
377 HG LEU 46 HG LEU 46 1.451 -10.355 -1.336
378 HD11 LEU 46 HD11 LEU 46 3.732 -9.995 -2.141
379 HD12 LEU 46 HD12 LEU 46 2.558 -9.194 -3.187
380 HD13 LEU 46 HD13 LEU 46 3.302 -10.710 -3.695
381 HD21 LEU 46 HD21 LEU 46 0.317 -10.127 -3.499
382 HD22 LEU 46 HD22 LEU 46 -0.159 -11.612 -2.676
383 HD23 LEU 46 HD23 LEU 46 0.990 -11.674 -4.013
384 H LYS 47 H LYS 47 3.805 -12.996 0.793
385 HA LYS 47 HA LYS 47 2.755 -11.613 3.123
386 HB2 LYS 47 HB2 LYS 47 5.357 -13.037 2.614
387 HB3 LYS 47 HB3 LYS 47 5.049 -12.115 4.080
388 HG2 LYS 47 HG2 LYS 47 2.884 -13.649 4.128
389 HG3 LYS 47 HG3 LYS 47 3.945 -14.717 3.203
390 HD2 LYS 47 HD2 LYS 47 4.561 -13.492 5.889
391 HD3 LYS 47 HD3 LYS 47 4.115 -15.173 5.597
392 HE2 LYS 47 HE2 LYS 47 6.131 -15.583 4.409
393 HE3 LYS 47 HE3 LYS 47 6.524 -13.868 4.352
394 HZ1 LYS 47 HZ1 LYS 47 6.222 -15.196 6.958
395 HZ2 LYS 47 HZ2 LYS 47 7.159 -13.838 6.540
396 HZ3 LYS 47 HZ3 LYS 47 7.662 -15.396 6.084
397 H VAL 48 H VAL 48 4.642 -10.235 4.227
398 HA VAL 48 HA VAL 48 4.767 -7.894 2.532
399 HB VAL 48 HB VAL 48 5.867 -8.178 5.333
400 HG11 VAL 48 HG11 VAL 48 5.485 -5.765 5.443
401 HG12 VAL 48 HG12 VAL 48 4.905 -5.780 3.778
402 HG13 VAL 48 HG13 VAL 48 6.585 -6.186 4.129
403 HG21 VAL 48 HG21 VAL 48 3.705 -7.306 6.121
404 HG22 VAL 48 HG22 VAL 48 3.553 -8.892 5.366
405 HG23 VAL 48 HG23 VAL 48 3.069 -7.443 4.483
406 H GLU 49 H GLU 49 6.956 -10.257 3.909
407 HA GLU 49 HA GLU 49 9.353 -8.923 3.075
408 HB2 GLU 49 HB2 GLU 49 9.098 -11.877 3.622
409 HB3 GLU 49 HB3 GLU 49 10.510 -10.853 3.828
410 HG2 GLU 49 HG2 GLU 49 9.908 -11.036 5.997
411 HG3 GLU 49 HG3 GLU 49 8.900 -9.654 5.570
412 H ASP 50 H ASP 50 6.953 -10.638 1.469
413 HA ASP 50 HA ASP 50 8.803 -11.609 -0.593
414 HB2 ASP 50 HB2 ASP 50 7.308 -13.256 0.601
415 HB3 ASP 50 HB3 ASP 50 5.943 -12.477 -0.193
416 H VAL 51 H VAL 51 6.489 -9.207 0.001
417 HA VAL 51 HA VAL 51 5.599 -8.968 -2.717
418 HB VAL 51 HB VAL 51 4.108 -8.158 -0.994
419 HG11 VAL 51 HG11 VAL 51 6.221 -6.124 -0.308
420 HG12 VAL 51 HG12 VAL 51 5.738 -7.496 0.690
421 HG13 VAL 51 HG13 VAL 51 4.591 -6.195 0.365
422 HG21 VAL 51 HG21 VAL 51 5.189 -5.907 -2.681
423 HG22 VAL 51 HG22 VAL 51 3.627 -5.908 -1.863
424 HG23 VAL 51 HG23 VAL 51 3.949 -7.072 -3.147
425 H LYS 52 H LYS 52 7.504 -8.975 -3.851
426 HA LYS 52 HA LYS 52 9.665 -7.227 -3.392
427 HB2 LYS 52 HB2 LYS 52 8.930 -8.532 -6.010
428 HB3 LYS 52 HB3 LYS 52 10.529 -8.026 -5.489
429 HG2 LYS 52 HG2 LYS 52 8.892 -10.283 -4.347
430 HG3 LYS 52 HG3 LYS 52 10.348 -10.420 -5.331
431 HD2 LYS 52 HD2 LYS 52 11.678 -9.410 -3.593
432 HD3 LYS 52 HD3 LYS 52 10.234 -9.090 -2.628
433 HE2 LYS 52 HE2 LYS 52 9.832 -11.528 -2.500
434 HE3 LYS 52 HE3 LYS 52 11.343 -11.795 -3.370
435 HZ1 LYS 52 HZ1 LYS 52 11.097 -10.439 -0.736
436 HZ2 LYS 52 HZ2 LYS 52 12.541 -10.739 -1.566
437 HZ3 LYS 52 HZ3 LYS 52 11.618 -12.032 -0.977
438 HA PRO 53 HA PRO 53 8.716 -3.259 -4.901
439 HB2 PRO 53 HB2 PRO 53 10.926 -3.589 -6.883
440 HB3 PRO 53 HB3 PRO 53 10.625 -2.278 -5.737
441 HG2 PRO 53 HG2 PRO 53 12.497 -4.093 -5.237
442 HG3 PRO 53 HG3 PRO 53 11.461 -3.477 -3.937
443 HD2 PRO 53 HD2 PRO 53 11.385 -6.105 -5.338
444 HD3 PRO 53 HD3 PRO 53 11.005 -5.712 -3.651
445 H ARG 54 H ARG 54 9.279 -5.646 -7.451
446 HA ARG 54 HA ARG 54 8.319 -4.236 -9.645
447 HB2 ARG 54 HB2 ARG 54 9.464 -6.499 -9.588
448 HB3 ARG 54 HB3 ARG 54 7.894 -7.182 -9.195
449 HG2 ARG 54 HG2 ARG 54 7.005 -6.260 -11.305
450 HG3 ARG 54 HG3 ARG 54 8.631 -5.699 -11.705
451 HD2 ARG 54 HD2 ARG 54 9.383 -8.096 -11.376
452 HD3 ARG 54 HD3 ARG 54 7.674 -8.523 -11.354
453 HE ARG 54 HE ARG 54 7.872 -7.151 -13.651
454 HH11 ARG 54 HH11 ARG 54 9.718 -9.787 -12.276
455 HH12 ARG 54 HH12 ARG 54 10.244 -10.400 -13.818
456 HH21 ARG 54 HH21 ARG 54 8.530 -7.956 -15.681
457 HH22 ARG 54 HH22 ARG 54 9.550 -9.365 -15.767
458 H HIS 55 H HIS 55 6.578 -6.006 -7.167
459 HA HIS 55 HA HIS 55 4.045 -6.041 -8.422
460 HB2 HIS 55 HB2 HIS 55 4.843 -6.194 -5.510
461 HB3 HIS 55 HB3 HIS 55 3.184 -6.382 -6.070
462 HD1 HIS 55 HD1 HIS 55 5.616 -8.471 -4.891
463 HD2 HIS 55 HD2 HIS 55 3.493 -8.448 -8.454
464 HE1 HIS 55 HE1 HIS 55 5.721 -10.835 -5.750
465 HE2 HIS 55 HE2 HIS 55 4.494 -10.784 -7.953
466 H ILE 56 H ILE 56 5.717 -3.715 -6.458
467 HA ILE 56 HA ILE 56 3.535 -2.030 -5.835
468 HB ILE 56 HB ILE 56 6.459 -1.291 -6.079
469 HG12 ILE 56 HG12 ILE 56 6.152 -3.141 -4.519
470 HG13 ILE 56 HG13 ILE 56 6.541 -1.668 -3.638
471 HG21 ILE 56 HG21 ILE 56 4.207 0.069 -4.607
472 HG22 ILE 56 HG22 ILE 56 5.021 0.662 -6.054
473 HG23 ILE 56 HG23 ILE 56 5.908 0.532 -4.535
474 HD11 ILE 56 HD11 ILE 56 4.816 -2.938 -2.508
475 HD12 ILE 56 HD12 ILE 56 3.802 -2.876 -3.950
476 HD13 ILE 56 HD13 ILE 56 4.178 -1.393 -3.072
477 H ASP 57 H ASP 57 5.681 -2.240 -8.624
478 HA ASP 57 HA ASP 57 4.898 0.218 -9.803
479 HB2 ASP 57 HB2 ASP 57 6.908 -1.073 -10.514
480 HB3 ASP 57 HB3 ASP 57 5.845 -2.284 -11.222
481 H ASP 58 H ASP 58 3.672 -3.073 -9.995
482 HA ASP 58 HA ASP 58 1.749 -2.676 -11.994
483 HB2 ASP 58 HB2 ASP 58 2.032 -4.693 -9.794
484 HB3 ASP 58 HB3 ASP 58 0.573 -4.658 -10.779
485 H VAL 59 H VAL 59 1.565 -2.174 -8.496
486 HA VAL 59 HA VAL 59 -1.250 -1.703 -8.520
487 HB VAL 59 HB VAL 59 -1.110 -1.047 -6.258
488 HG11 VAL 59 HG11 VAL 59 1.040 -3.095 -6.740
489 HG12 VAL 59 HG12 VAL 59 -0.691 -3.404 -6.613
490 HG13 VAL 59 HG13 VAL 59 0.206 -2.817 -5.212
491 HG21 VAL 59 HG21 VAL 59 1.849 -0.629 -6.628
492 HG22 VAL 59 HG22 VAL 59 0.987 -0.529 -5.093
493 HG23 VAL 59 HG23 VAL 59 0.633 0.624 -6.379
494 H LEU 60 H LEU 60 1.594 0.310 -8.902
495 HA LEU 60 HA LEU 60 0.289 2.816 -8.775
496 HB2 LEU 60 HB2 LEU 60 2.818 1.986 -10.202
497 HB3 LEU 60 HB3 LEU 60 2.281 3.647 -10.036
498 HG LEU 60 HG LEU 60 3.024 1.805 -7.764
499 HD11 LEU 60 HD11 LEU 60 4.953 3.281 -7.504
500 HD12 LEU 60 HD12 LEU 60 4.456 4.186 -8.934
501 HD13 LEU 60 HD13 LEU 60 4.949 2.499 -9.085
502 HD21 LEU 60 HD21 LEU 60 2.816 3.811 -6.367
503 HD22 LEU 60 HD22 LEU 60 1.281 3.382 -7.122
504 HD23 LEU 60 HD23 LEU 60 2.234 4.718 -7.763
505 H LYS 61 H LYS 61 1.103 0.661 -11.466
506 HA LYS 61 HA LYS 61 0.132 2.099 -13.618
507 HB2 LYS 61 HB2 LYS 61 -0.114 -0.868 -13.092
508 HB3 LYS 61 HB3 LYS 61 -0.347 -0.105 -14.658
509 HG2 LYS 61 HG2 LYS 61 1.879 0.297 -14.953
510 HG3 LYS 61 HG3 LYS 61 2.210 0.339 -13.220
511 HD2 LYS 61 HD2 LYS 61 3.143 -1.655 -14.286
512 HD3 LYS 61 HD3 LYS 61 1.937 -2.060 -13.076
513 HE2 LYS 61 HE2 LYS 61 0.300 -2.511 -14.756
514 HE3 LYS 61 HE3 LYS 61 1.355 -1.886 -16.021
515 HZ1 LYS 61 HZ1 LYS 61 1.327 -4.326 -15.936
516 HZ2 LYS 61 HZ2 LYS 61 1.928 -4.281 -14.349
517 HZ3 LYS 61 HZ3 LYS 61 2.875 -3.703 -15.634
518 H ALA 62 H ALA 62 -1.609 -0.216 -11.606
519 HA ALA 62 HA ALA 62 -4.133 -0.006 -12.699
520 HB1 ALA 62 HB1 ALA 62 -4.991 -0.819 -10.571
521 HB2 ALA 62 HB2 ALA 62 -3.462 -0.414 -9.790
522 HB3 ALA 62 HB3 ALA 62 -3.515 -1.668 -11.028
523 H VAL 63 H VAL 63 -2.902 1.928 -9.924
524 HA VAL 63 HA VAL 63 -5.326 3.408 -9.737
525 HB VAL 63 HB VAL 63 -3.983 3.170 -7.765
526 HG11 VAL 63 HG11 VAL 63 -1.846 4.760 -9.160
527 HG12 VAL 63 HG12 VAL 63 -1.780 3.044 -8.755
528 HG13 VAL 63 HG13 VAL 63 -1.831 4.251 -7.470
529 HG21 VAL 63 HG21 VAL 63 -4.075 6.038 -8.679
530 HG22 VAL 63 HG22 VAL 63 -3.823 5.516 -7.015
531 HG23 VAL 63 HG23 VAL 63 -5.342 5.151 -7.832
532 H MET 64 H MET 64 -2.534 3.763 -11.730
533 HA MET 64 HA MET 64 -3.048 6.517 -12.380
534 HB2 MET 64 HB2 MET 64 -1.319 4.413 -13.678
535 HB3 MET 64 HB3 MET 64 -1.488 6.039 -14.326
536 HG2 MET 64 HG2 MET 64 -0.620 6.958 -12.233
537 HG3 MET 64 HG3 MET 64 -0.433 5.324 -11.600
538 HE1 MET 64 HE1 MET 64 3.270 6.444 -12.207
539 HE2 MET 64 HE2 MET 64 2.123 5.784 -11.041
540 HE3 MET 64 HE3 MET 64 1.927 7.434 -11.634
541 H LYS 65 H LYS 65 -3.957 3.378 -13.720
542 HA LYS 65 HA LYS 65 -4.978 4.589 -16.122
543 HB2 LYS 65 HB2 LYS 65 -5.560 2.328 -16.813
544 HB3 LYS 65 HB3 LYS 65 -3.915 2.422 -16.229
545 HG2 LYS 65 HG2 LYS 65 -4.561 0.469 -15.272
546 HG3 LYS 65 HG3 LYS 65 -4.996 1.596 -13.988
547 HD2 LYS 65 HD2 LYS 65 -6.787 -0.005 -14.379
548 HD3 LYS 65 HD3 LYS 65 -7.304 1.628 -14.798
549 HE2 LYS 65 HE2 LYS 65 -6.762 1.100 -17.177
550 HE3 LYS 65 HE3 LYS 65 -6.468 -0.566 -16.683
551 HZ1 LYS 65 HZ1 LYS 65 -9.029 0.922 -16.454
552 HZ2 LYS 65 HZ2 LYS 65 -8.770 -0.643 -15.848
553 HZ3 LYS 65 HZ3 LYS 65 -8.692 -0.355 -17.521
554 H ARG 66 H ARG 66 -6.416 3.103 -13.242
555 HA ARG 66 HA ARG 66 -9.034 4.023 -14.224
556 HB2 ARG 66 HB2 ARG 66 -9.990 2.539 -12.416
557 HB3 ARG 66 HB3 ARG 66 -9.197 1.727 -13.752
558 HG2 ARG 66 HG2 ARG 66 -8.481 0.550 -11.902
559 HG3 ARG 66 HG3 ARG 66 -7.138 1.648 -12.219
560 HD2 ARG 66 HD2 ARG 66 -8.042 3.170 -10.483
561 HD3 ARG 66 HD3 ARG 66 -9.289 1.972 -10.131
562 HE ARG 66 HE ARG 66 -7.125 0.492 -9.805
563 HH11 ARG 66 HH11 ARG 66 -7.819 3.718 -8.667
564 HH12 ARG 66 HH12 ARG 66 -6.721 3.629 -7.318
565 HH21 ARG 66 HH21 ARG 66 -5.638 0.376 -8.074
566 HH22 ARG 66 HH22 ARG 66 -5.433 1.749 -7.018
567 H GLY 67 H GLY 67 -6.726 5.372 -12.644
568 HA2 GLY 67 HA2 GLY 67 -8.604 6.942 -11.032
569 HA3 GLY 67 HA3 GLY 67 -7.120 6.368 -10.279
570 H ALA 68 H ALA 68 -5.921 8.147 -10.013
571 HA ALA 68 HA ALA 68 -5.127 9.614 -12.408
572 HB1 ALA 68 HB1 ALA 68 -6.948 10.928 -11.419
573 HB2 ALA 68 HB2 ALA 68 -5.406 11.776 -11.315
574 HB3 ALA 68 HB3 ALA 68 -6.073 10.983 -9.889
575 HA PRO 69 HA PRO 69 -1.072 9.064 -10.798
576 HB2 PRO 69 HB2 PRO 69 0.058 11.456 -11.626
577 HB3 PRO 69 HB3 PRO 69 -0.126 10.018 -12.633
578 HG2 PRO 69 HG2 PRO 69 -1.845 12.458 -12.482
579 HG3 PRO 69 HG3 PRO 69 -1.349 11.517 -13.902
580 HD2 PRO 69 HD2 PRO 69 -3.799 11.259 -12.868
581 HD3 PRO 69 HD3 PRO 69 -2.921 9.856 -13.510
582 H SER 70 H SER 70 -2.814 12.014 -10.081
583 HA SER 70 HA SER 70 -1.183 13.124 -8.122
584 HB2 SER 70 HB2 SER 70 -4.206 13.139 -8.056
585 HB3 SER 70 HB3 SER 70 -3.102 14.376 -7.452
586 HG SER 70 HG SER 70 -4.214 14.316 -9.800
587 H ILE 71 H ILE 71 -3.557 10.536 -7.920
588 HA ILE 71 HA ILE 71 -3.458 10.350 -5.058
589 HB ILE 71 HB ILE 71 -4.631 8.500 -7.144
590 HG12 ILE 71 HG12 ILE 71 -6.781 9.238 -5.942
591 HG13 ILE 71 HG13 ILE 71 -5.800 10.507 -5.219
592 HG21 ILE 71 HG21 ILE 71 -5.680 7.271 -5.308
593 HG22 ILE 71 HG22 ILE 71 -4.791 8.255 -4.144
594 HG23 ILE 71 HG23 ILE 71 -3.920 7.174 -5.232
595 HD11 ILE 71 HD11 ILE 71 -6.992 11.353 -7.133
596 HD12 ILE 71 HD12 ILE 71 -6.305 10.090 -8.154
597 HD13 ILE 71 HD13 ILE 71 -5.259 11.334 -7.466
598 H ALA 72 H ALA 72 -1.956 8.682 -7.772
599 HA ALA 72 HA ALA 72 -0.906 6.464 -6.496
600 HB1 ALA 72 HB1 ALA 72 -0.885 6.767 -8.914
601 HB2 ALA 72 HB2 ALA 72 0.724 6.372 -8.308
602 HB3 ALA 72 HB3 ALA 72 0.332 8.034 -8.750
603 H ASN 73 H ASN 73 0.530 9.692 -6.825
604 HA ASN 73 HA ASN 73 3.008 9.132 -5.625
605 HB2 ASN 73 HB2 ASN 73 1.467 11.740 -5.627
606 HB3 ASN 73 HB3 ASN 73 3.180 11.564 -5.265
607 HD21 ASN 73 HD21 ASN 73 1.783 13.071 -7.362
608 HD22 ASN 73 HD22 ASN 73 2.445 12.514 -8.850
609 H ASP 74 H ASP 74 -0.008 10.357 -4.266
610 HA ASP 74 HA ASP 74 0.888 10.626 -1.606
611 HB2 ASP 74 HB2 ASP 74 -1.182 11.662 -2.447
612 HB3 ASP 74 HB3 ASP 74 -1.912 10.069 -2.612
613 H THR 75 H THR 75 -0.624 7.927 -3.322
614 HA THR 75 HA THR 75 -0.919 6.170 -1.170
615 HB THR 75 HB THR 75 -0.289 5.447 -4.045
616 HG1 THR 75 HG1 THR 75 -2.711 5.231 -3.994
617 HG21 THR 75 HG21 THR 75 -1.693 3.879 -1.878
618 HG22 THR 75 HG22 THR 75 -0.075 3.553 -2.500
619 HG23 THR 75 HG23 THR 75 -1.478 3.367 -3.552
620 H LEU 76 H LEU 76 1.888 6.793 -3.253
621 HA LEU 76 HA LEU 76 3.548 4.750 -2.266
622 HB2 LEU 76 HB2 LEU 76 4.182 7.439 -3.469
623 HB3 LEU 76 HB3 LEU 76 5.424 6.287 -3.021
624 HG LEU 76 HG LEU 76 3.243 5.759 -5.043
625 HD11 LEU 76 HD11 LEU 76 6.160 6.421 -5.416
626 HD12 LEU 76 HD12 LEU 76 4.792 7.444 -5.854
627 HD13 LEU 76 HD13 LEU 76 5.055 5.915 -6.694
628 HD21 LEU 76 HD21 LEU 76 4.033 3.744 -3.908
629 HD22 LEU 76 HD22 LEU 76 5.700 4.178 -4.287
630 HD23 LEU 76 HD23 LEU 76 4.574 3.780 -5.586
631 H ARG 77 H ARG 77 2.927 8.027 -1.122
632 HA ARG 77 HA ARG 77 4.897 8.024 0.921
633 HB2 ARG 77 HB2 ARG 77 3.771 10.064 0.022
634 HB3 ARG 77 HB3 ARG 77 2.298 9.566 0.842
635 HG2 ARG 77 HG2 ARG 77 3.421 9.734 2.990
636 HG3 ARG 77 HG3 ARG 77 4.916 10.205 2.181
637 HD2 ARG 77 HD2 ARG 77 3.617 12.138 1.198
638 HD3 ARG 77 HD3 ARG 77 2.325 11.725 2.326
639 HE ARG 77 HE ARG 77 4.205 11.984 4.071
640 HH11 ARG 77 HH11 ARG 77 3.757 13.946 1.198
641 HH12 ARG 77 HH12 ARG 77 4.662 15.297 1.824
642 HH21 ARG 77 HH21 ARG 77 5.360 13.766 4.908
643 HH22 ARG 77 HH22 ARG 77 5.594 15.179 3.933
644 H TRP 78 H TRP 78 1.540 7.029 0.759
645 HA TRP 78 HA TRP 78 1.175 6.478 3.514
646 HB2 TRP 78 HB2 TRP 78 -0.593 6.738 1.663
647 HB3 TRP 78 HB3 TRP 78 -0.238 5.066 1.252
648 HD1 TRP 78 HD1 TRP 78 -1.265 3.192 2.794
649 HE1 TRP 78 HE1 TRP 78 -2.979 3.241 4.717
650 HE3 TRP 78 HE3 TRP 78 -1.332 8.222 3.703
651 HZ2 TRP 78 HZ2 TRP 78 -4.184 5.151 6.400
652 HZ3 TRP 78 HZ3 TRP 78 -2.795 9.079 5.485
653 HH2 TRP 78 HH2 TRP 78 -4.191 7.576 6.805
654 H LEU 79 H LEU 79 2.241 4.533 0.762
655 HA LEU 79 HA LEU 79 2.457 2.047 2.027
656 HB2 LEU 79 HB2 LEU 79 4.105 3.230 -0.209
657 HB3 LEU 79 HB3 LEU 79 4.161 1.545 0.269
658 HG LEU 79 HG LEU 79 1.701 2.949 -0.769
659 HD11 LEU 79 HD11 LEU 79 3.406 2.761 -2.500
660 HD12 LEU 79 HD12 LEU 79 2.065 1.658 -2.812
661 HD13 LEU 79 HD13 LEU 79 3.579 1.041 -2.154
662 HD21 LEU 79 HD21 LEU 79 2.254 0.032 -0.238
663 HD22 LEU 79 HD22 LEU 79 0.774 0.700 -0.928
664 HD23 LEU 79 HD23 LEU 79 1.221 1.080 0.735
665 H LYS 80 H LYS 80 4.767 4.715 1.772
666 HA LYS 80 HA LYS 80 7.017 3.595 2.892
667 HB2 LYS 80 HB2 LYS 80 6.748 5.854 1.871
668 HB3 LYS 80 HB3 LYS 80 5.930 6.374 3.336
669 HG2 LYS 80 HG2 LYS 80 8.033 5.725 4.573
670 HG3 LYS 80 HG3 LYS 80 8.797 5.598 2.983
671 HD2 LYS 80 HD2 LYS 80 7.482 8.027 4.185
672 HD3 LYS 80 HD3 LYS 80 9.187 7.785 3.852
673 HE2 LYS 80 HE2 LYS 80 7.084 7.756 1.715
674 HE3 LYS 80 HE3 LYS 80 7.945 9.209 2.194
675 HZ1 LYS 80 HZ1 LYS 80 9.062 8.334 0.327
676 HZ2 LYS 80 HZ2 LYS 80 9.063 6.763 0.960
677 HZ3 LYS 80 HZ3 LYS 80 10.040 7.957 1.663
678 H ARG 81 H ARG 81 4.502 5.463 4.562
679 HA ARG 81 HA ARG 81 5.292 5.089 7.187
680 HB2 ARG 81 HB2 ARG 81 2.467 5.215 6.116
681 HB3 ARG 81 HB3 ARG 81 2.928 5.462 7.791
682 HG2 ARG 81 HG2 ARG 81 4.094 7.476 7.242
683 HG3 ARG 81 HG3 ARG 81 3.864 7.192 5.514
684 HD2 ARG 81 HD2 ARG 81 1.469 7.418 5.759
685 HD3 ARG 81 HD3 ARG 81 1.632 7.573 7.505
686 HE ARG 81 HE ARG 81 2.841 9.698 7.045
687 HH11 ARG 81 HH11 ARG 81 0.699 8.374 4.613
688 HH12 ARG 81 HH12 ARG 81 0.295 9.917 3.927
689 HH21 ARG 81 HH21 ARG 81 2.292 11.743 6.170
690 HH22 ARG 81 HH22 ARG 81 1.164 11.843 4.847
691 H MET 82 H MET 82 3.233 3.032 5.179
692 HA MET 82 HA MET 82 2.426 1.260 7.211
693 HB2 MET 82 HB2 MET 82 1.249 1.549 5.063
694 HB3 MET 82 HB3 MET 82 2.595 0.785 4.232
695 HG2 MET 82 HG2 MET 82 2.171 -1.295 5.398
696 HG3 MET 82 HG3 MET 82 0.868 -0.536 6.311
697 HE1 MET 82 HE1 MET 82 -1.761 0.215 3.508
698 HE2 MET 82 HE2 MET 82 -0.492 1.298 4.081
699 HE3 MET 82 HE3 MET 82 -1.399 0.314 5.231
700 H PHE 83 H PHE 83 4.980 0.950 4.736
701 HA PHE 83 HA PHE 83 5.790 -1.625 5.615
702 HB2 PHE 83 HB2 PHE 83 7.117 0.435 3.864
703 HB3 PHE 83 HB3 PHE 83 7.891 -1.096 4.259
704 HD1 PHE 83 HD2 PHE 83 6.368 -3.219 3.833
705 HD2 PHE 83 HD1 PHE 83 5.875 0.556 1.931
706 HE1 PHE 83 HE2 PHE 83 5.166 -4.312 1.985
707 HE2 PHE 83 HE1 PHE 83 4.671 -0.530 0.081
708 HZ PHE 83 HZ PHE 83 4.317 -2.970 0.105
709 H ASN 84 H ASN 84 6.812 1.643 6.443
710 HA ASN 84 HA ASN 84 9.164 0.949 7.833
711 HB2 ASN 84 HB2 ASN 84 8.649 3.256 7.159
712 HB3 ASN 84 HB3 ASN 84 7.316 3.301 8.308
713 HD21 ASN 84 HD21 ASN 84 7.744 3.618 10.473
714 HD22 ASN 84 HD22 ASN 84 9.331 3.993 11.073
715 H TYR 85 H TYR 85 5.804 1.052 8.788
716 HA TYR 85 HA TYR 85 6.207 0.690 11.574
717 HB2 TYR 85 HB2 TYR 85 4.110 1.572 10.675
718 HB3 TYR 85 HB3 TYR 85 3.827 0.078 9.798
719 HD1 TYR 85 HD1 TYR 85 4.682 0.890 13.361
720 HD2 TYR 85 HD2 TYR 85 2.057 -1.075 10.652
721 HE1 TYR 85 HE1 TYR 85 3.378 0.024 15.258
722 HE2 TYR 85 HE2 TYR 85 0.747 -1.945 12.538
723 HH TYR 85 HH TYR 85 0.787 -2.315 14.801
724 H ALA 86 H ALA 86 5.890 -1.517 8.857
725 HA ALA 86 HA ALA 86 5.842 -3.879 10.476
726 HB1 ALA 86 HB1 ALA 86 6.217 -5.078 8.385
727 HB2 ALA 86 HB2 ALA 86 6.582 -3.561 7.564
728 HB3 ALA 86 HB3 ALA 86 4.958 -3.860 8.186
729 H ILE 87 H ILE 87 8.345 -1.937 8.934
730 HA ILE 87 HA ILE 87 10.505 -3.696 9.365
731 HB ILE 87 HB ILE 87 10.501 -0.680 9.159
732 HG12 ILE 87 HG12 ILE 87 11.156 -2.836 7.139
733 HG13 ILE 87 HG13 ILE 87 9.690 -1.860 7.160
734 HG21 ILE 87 HG21 ILE 87 12.906 -0.868 8.712
735 HG22 ILE 87 HG22 ILE 87 12.830 -2.598 9.044
736 HG23 ILE 87 HG23 ILE 87 12.499 -1.437 10.330
737 HD11 ILE 87 HD11 ILE 87 11.285 -1.074 5.498
738 HD12 ILE 87 HD12 ILE 87 12.484 -0.811 6.767
739 HD13 ILE 87 HD13 ILE 87 10.997 0.138 6.745
740 H LYS 88 H LYS 88 9.255 -0.990 11.329
741 HA LYS 88 HA LYS 88 11.194 -1.248 13.355
742 HB2 LYS 88 HB2 LYS 88 9.789 0.180 14.717
743 HB3 LYS 88 HB3 LYS 88 9.887 0.794 13.075
744 HG2 LYS 88 HG2 LYS 88 7.683 -0.004 12.579
745 HG3 LYS 88 HG3 LYS 88 7.588 -0.824 14.141
746 HD2 LYS 88 HD2 LYS 88 6.359 1.294 14.158
747 HD3 LYS 88 HD3 LYS 88 7.711 1.317 15.292
748 HE2 LYS 88 HE2 LYS 88 9.057 2.486 13.557
749 HE3 LYS 88 HE3 LYS 88 7.611 2.569 12.550
750 HZ1 LYS 88 HZ1 LYS 88 6.526 3.818 14.358
751 HZ2 LYS 88 HZ2 LYS 88 7.879 4.624 13.734
752 HZ3 LYS 88 HZ3 LYS 88 7.983 3.819 15.223
753 H ARG 89 H ARG 89 8.210 -2.911 12.755
754 HA ARG 89 HA ARG 89 8.151 -4.113 15.390
755 HB2 ARG 89 HB2 ARG 89 6.074 -3.540 14.069
756 HB3 ARG 89 HB3 ARG 89 6.477 -4.872 12.993
757 HG2 ARG 89 HG2 ARG 89 6.331 -6.436 14.854
758 HG3 ARG 89 HG3 ARG 89 5.969 -5.105 15.946
759 HD2 ARG 89 HD2 ARG 89 3.909 -4.652 14.744
760 HD3 ARG 89 HD3 ARG 89 4.281 -5.943 13.600
761 HE ARG 89 HE ARG 89 4.321 -7.289 15.898
762 HH11 ARG 89 HH11 ARG 89 2.034 -4.918 14.742
763 HH12 ARG 89 HH12 ARG 89 0.677 -5.647 15.535
764 HH21 ARG 89 HH21 ARG 89 2.535 -8.243 16.961
765 HH22 ARG 89 HH22 ARG 89 0.959 -7.520 16.809
766 H HIS 90 H HIS 90 10.131 -4.557 12.905
767 HA HIS 90 HA HIS 90 11.686 -6.144 12.452
768 HB2 HIS 90 HB2 HIS 90 10.437 -7.498 14.842
769 HB3 HIS 90 HB3 HIS 90 11.802 -8.182 13.963
770 HD1 HIS 90 HD1 HIS 90 11.141 -6.251 16.853
771 HD2 HIS 90 HD2 HIS 90 13.984 -6.070 13.820
772 HE1 HIS 90 HE1 HIS 90 13.049 -4.905 17.792
773 HE2 HIS 90 HE2 HIS 90 14.821 -4.929 15.991
774 H ILE 91 H ILE 91 9.111 -6.127 11.130
775 HA ILE 91 HA ILE 91 8.667 -8.941 10.495
776 HB ILE 91 HB ILE 91 7.397 -6.472 9.284
777 HG12 ILE 91 HG12 ILE 91 6.323 -8.433 11.327
778 HG13 ILE 91 HG13 ILE 91 6.827 -6.780 11.660
779 HG21 ILE 91 HG21 ILE 91 6.653 -9.382 8.995
780 HG22 ILE 91 HG22 ILE 91 7.399 -8.375 7.754
781 HG23 ILE 91 HG23 ILE 91 5.766 -8.015 8.319
782 HD11 ILE 91 HD11 ILE 91 4.547 -7.591 9.871
783 HD12 ILE 91 HD12 ILE 91 5.042 -5.938 10.241
784 HD13 ILE 91 HD13 ILE 91 4.407 -6.976 11.518
785 H ILE 92 H ILE 92 9.429 -5.986 8.661
786 HA ILE 92 HA ILE 92 11.038 -7.645 6.842
787 HB ILE 92 HB ILE 92 10.637 -5.861 5.121
788 HG12 ILE 92 HG12 ILE 92 8.472 -4.998 7.055
789 HG13 ILE 92 HG13 ILE 92 9.931 -4.082 6.682
790 HG21 ILE 92 HG21 ILE 92 9.472 -7.978 5.038
791 HG22 ILE 92 HG22 ILE 92 8.396 -6.673 4.534
792 HG23 ILE 92 HG23 ILE 92 8.240 -7.372 6.146
793 HD11 ILE 92 HD11 ILE 92 9.198 -3.884 4.357
794 HD12 ILE 92 HD12 ILE 92 8.027 -3.199 5.483
795 HD13 ILE 92 HD13 ILE 92 7.728 -4.777 4.754
796 H GLU 93 H GLU 93 12.705 -6.203 5.645
797 HA GLU 93 HA GLU 93 13.984 -4.463 7.647
798 HB2 GLU 93 HB2 GLU 93 15.043 -6.692 7.461
799 HB3 GLU 93 HB3 GLU 93 15.340 -6.393 5.756
800 HG2 GLU 93 HG2 GLU 93 16.874 -4.642 6.260
801 HG3 GLU 93 HG3 GLU 93 16.451 -4.693 7.973
802 H TYR 94 H TYR 94 12.717 -4.655 4.550
803 HA TYR 94 HA TYR 94 14.190 -2.258 3.723
804 HB2 TYR 94 HB2 TYR 94 13.644 -4.707 2.043
805 HB3 TYR 94 HB3 TYR 94 14.062 -3.148 1.342
806 HD1 TYR 94 HD2 TYR 94 16.282 -2.121 1.917
807 HD2 TYR 94 HD1 TYR 94 15.315 -6.146 2.888
808 HE1 TYR 94 HE2 TYR 94 18.671 -2.622 2.183
809 HE2 TYR 94 HE1 TYR 94 17.704 -6.658 3.163
810 HH TYR 94 HH TYR 94 19.876 -5.786 2.403
811 H ASN 95 H ASN 95 13.084 -1.066 1.966
812 HA ASN 95 HA ASN 95 10.152 -1.197 2.290
813 HB2 ASN 95 HB2 ASN 95 11.808 1.171 1.381
814 HB3 ASN 95 HB3 ASN 95 10.087 1.166 1.737
815 HD21 ASN 95 HD21 ASN 95 9.402 1.269 3.843
816 HD22 ASN 95 HD22 ASN 95 10.473 1.615 5.159
817 HA PRO 96 HA PRO 96 10.941 -2.750 -2.007
818 HB2 PRO 96 HB2 PRO 96 8.051 -3.384 -1.674
819 HB3 PRO 96 HB3 PRO 96 9.363 -4.402 -2.286
820 HG2 PRO 96 HG2 PRO 96 8.370 -4.791 0.154
821 HG3 PRO 96 HG3 PRO 96 10.110 -4.946 -0.154
822 HD2 PRO 96 HD2 PRO 96 8.603 -2.720 1.155
823 HD3 PRO 96 HD3 PRO 96 10.199 -3.391 1.552
824 H ALA 97 H ALA 97 8.329 -0.714 -0.793
825 HA ALA 97 HA ALA 97 7.542 0.167 -3.421
826 HB1 ALA 97 HB1 ALA 97 5.895 -0.025 -1.635
827 HB2 ALA 97 HB2 ALA 97 5.983 1.625 -2.252
828 HB3 ALA 97 HB3 ALA 97 6.744 1.218 -0.713
829 H ALA 98 H ALA 98 10.001 1.055 -1.263
830 HA ALA 98 HA ALA 98 10.006 3.880 -1.820
831 HB1 ALA 98 HB1 ALA 98 12.103 3.919 -0.569
832 HB2 ALA 98 HB2 ALA 98 12.127 2.155 -0.547
833 HB3 ALA 98 HB3 ALA 98 10.855 3.029 0.305
834 H ALA 99 H ALA 99 10.964 1.157 -3.523
835 HA ALA 99 HA ALA 99 13.312 2.153 -4.795
836 HB1 ALA 99 HB1 ALA 99 11.433 -0.031 -5.694
837 HB2 ALA 99 HB2 ALA 99 12.825 -0.243 -4.631
838 HB3 ALA 99 HB3 ALA 99 13.062 0.260 -6.305
839 H PHE 100 H PHE 100 10.089 2.991 -5.071
840 HA PHE 100 HA PHE 100 10.519 4.081 -7.774
841 HB2 PHE 100 HB2 PHE 100 7.912 3.341 -6.420
842 HB3 PHE 100 HB3 PHE 100 8.049 4.101 -8.003
843 HD1 PHE 100 HD2 PHE 100 8.846 2.844 -9.918
844 HD2 PHE 100 HD1 PHE 100 8.458 1.019 -6.099
845 HE1 PHE 100 HE2 PHE 100 9.043 0.626 -10.965
846 HE2 PHE 100 HE1 PHE 100 8.657 -1.202 -7.133
847 HZ PHE 100 HZ PHE 100 8.951 -1.401 -9.569
848 H ASP 101 H ASP 101 10.563 6.225 -7.943
849 HA ASP 101 HA ASP 101 9.931 7.790 -5.548
850 HB2 ASP 101 HB2 ASP 101 12.192 8.095 -6.344
851 HB3 ASP 101 HB3 ASP 101 11.619 8.446 -7.973
852 HA PRO 102 HA PRO 102 6.310 9.308 -7.688
853 HB2 PRO 102 HB2 PRO 102 5.544 11.049 -5.749
854 HB3 PRO 102 HB3 PRO 102 5.262 9.309 -5.647
855 HG2 PRO 102 HG2 PRO 102 7.403 10.957 -4.362
856 HG3 PRO 102 HG3 PRO 102 6.454 9.622 -3.683
857 HD2 PRO 102 HD2 PRO 102 8.995 9.314 -4.592
858 HD3 PRO 102 HD3 PRO 102 7.783 8.019 -4.649
859 H GLY 103 H GLY 103 8.832 11.321 -6.278
860 HA2 GLY 103 HA2 GLY 103 9.937 13.104 -7.252
861 HA3 GLY 103 HA3 GLY 103 8.821 13.017 -8.608
862 H ASP 104 H ASP 104 6.433 13.545 -7.740
863 HA ASP 104 HA ASP 104 6.683 16.148 -6.387
864 HB2 ASP 104 HB2 ASP 104 6.184 16.321 -8.816
865 HB3 ASP 104 HB3 ASP 104 4.727 15.363 -8.565
866 H ALA 105 H ALA 105 4.790 16.831 -5.182
867 HA ALA 105 HA ALA 105 3.434 14.504 -3.991
868 HB1 ALA 105 HB1 ALA 105 5.008 15.659 -2.499
869 HB2 ALA 105 HB2 ALA 105 3.348 15.745 -1.911
870 HB3 ALA 105 HB3 ALA 105 4.081 17.147 -2.690
871 H GLY 106 H GLY 106 2.761 16.805 -6.137
872 HA2 GLY 106 HA2 GLY 106 0.505 17.139 -6.880
873 HA3 GLY 106 HA3 GLY 106 -0.026 17.041 -5.205
874 H GLY 107 H GLY 107 0.163 18.847 -3.865
875 HA2 GLY 107 HA2 GLY 107 0.554 21.056 -3.293
876 HA3 GLY 107 HA3 GLY 107 1.470 21.244 -4.780
877 H LYS 108 H LYS 108 -1.606 19.897 -5.179
878 HA LYS 108 HA LYS 108 -2.957 22.420 -5.625
879 HB2 LYS 108 HB2 LYS 108 -3.466 21.915 -7.980
880 HB3 LYS 108 HB3 LYS 108 -1.739 22.119 -7.719
881 HG2 LYS 108 HG2 LYS 108 -1.608 19.599 -7.564
882 HG3 LYS 108 HG3 LYS 108 -3.260 19.577 -8.182
883 HD2 LYS 108 HD2 LYS 108 -2.540 20.788 -10.171
884 HD3 LYS 108 HD3 LYS 108 -0.889 20.848 -9.545
885 HE2 LYS 108 HE2 LYS 108 -1.037 18.309 -9.428
886 HE3 LYS 108 HE3 LYS 108 -2.467 18.460 -10.443
887 HZ1 LYS 108 HZ1 LYS 108 -0.453 18.059 -11.753
888 HZ2 LYS 108 HZ2 LYS 108 0.238 19.481 -11.143
889 HZ3 LYS 108 HZ3 LYS 108 -1.141 19.561 -12.126
890 H LEU 109 H LEU 109 -5.088 21.472 -7.119
891 HA LEU 109 HA LEU 109 -6.184 19.101 -5.986
892 HB2 LEU 109 HB2 LEU 109 -7.877 20.024 -4.566
893 HB3 LEU 109 HB3 LEU 109 -6.320 20.604 -4.012
894 HG LEU 109 HG LEU 109 -8.092 22.285 -5.776
895 HD11 LEU 109 HD11 LEU 109 -8.923 23.360 -3.745
896 HD12 LEU 109 HD12 LEU 109 -8.065 22.172 -2.763
897 HD13 LEU 109 HD13 LEU 109 -9.390 21.662 -3.810
898 HD21 LEU 109 HD21 LEU 109 -5.889 22.955 -3.825
899 HD22 LEU 109 HD22 LEU 109 -6.833 24.122 -4.750
900 HD23 LEU 109 HD23 LEU 109 -5.768 22.990 -5.584
901 H GLU 110 H GLU 110 -8.777 19.283 -6.318
902 HA GLU 110 HA GLU 110 -9.271 20.687 -8.848
903 HB2 GLU 110 HB2 GLU 110 -10.246 18.690 -9.857
904 HB3 GLU 110 HB3 GLU 110 -8.562 18.403 -9.436
905 HG2 GLU 110 HG2 GLU 110 -9.138 17.052 -7.606
906 HG3 GLU 110 HG3 GLU 110 -10.818 17.589 -7.633
907 H HIS 111 H HIS 111 -11.182 21.693 -8.826
908 HA HIS 111 HA HIS 111 -13.403 20.404 -7.399
909 HB2 HIS 111 HB2 HIS 111 -12.499 23.238 -7.195
910 HB3 HIS 111 HB3 HIS 111 -14.232 22.939 -7.214
911 HD1 HIS 111 HD1 HIS 111 -13.513 24.106 -4.689
912 HD2 HIS 111 HD2 HIS 111 -12.917 20.041 -5.340
913 HE1 HIS 111 HE1 HIS 111 -13.375 23.064 -2.405
914 HE2 HIS 111 HE2 HIS 111 -12.842 20.634 -2.826
915 H HIS 112 H HIS 112 -12.911 23.197 -9.559
916 HA HIS 112 HA HIS 112 -13.962 23.858 -11.477
917 HB2 HIS 112 HB2 HIS 112 -14.054 20.872 -11.989
918 HB3 HIS 112 HB3 HIS 112 -14.315 22.118 -13.200
919 HD1 HIS 112 HD1 HIS 112 -11.996 19.875 -13.094
920 HD2 HIS 112 HD2 HIS 112 -11.630 23.937 -12.267
921 HE1 HIS 112 HE1 HIS 112 -9.572 20.432 -13.467
922 HE2 HIS 112 HE2 HIS 112 -9.338 22.829 -12.719
923 H HIS 113 H HIS 113 -15.648 23.620 -9.219
924 HA HIS 113 HA HIS 113 -18.095 22.410 -10.329
925 HB2 HIS 113 HB2 HIS 113 -17.018 21.454 -8.184
926 HB3 HIS 113 HB3 HIS 113 -17.623 22.906 -7.396
927 HD1 HIS 113 HD1 HIS 113 -18.732 19.678 -8.915
928 HD2 HIS 113 HD2 HIS 113 -20.402 22.971 -6.994
929 HE1 HIS 113 HE1 HIS 113 -21.107 19.034 -8.395
930 HE2 HIS 113 HE2 HIS 113 -22.060 20.994 -7.120
931 H HIS 114 H HIS 114 -17.241 25.077 -10.933
932 HA HIS 114 HA HIS 114 -19.501 26.509 -9.697
933 HB2 HIS 114 HB2 HIS 114 -16.830 27.640 -10.558
934 HB3 HIS 114 HB3 HIS 114 -18.229 28.635 -10.170
935 HD1 HIS 114 HD1 HIS 114 -15.366 28.375 -8.637
936 HD2 HIS 114 HD2 HIS 114 -19.072 26.952 -7.405
937 HE1 HIS 114 HE1 HIS 114 -15.232 28.204 -6.130
938 HE2 HIS 114 HE2 HIS 114 -17.558 27.560 -5.404
939 H HIS 115 H HIS 115 -20.951 25.927 -11.264
940 HA HIS 115 HA HIS 115 -20.408 27.000 -13.961
941 HB2 HIS 115 HB2 HIS 115 -22.077 24.610 -13.162
942 HB3 HIS 115 HB3 HIS 115 -22.083 25.313 -14.774
943 HD1 HIS 115 HD1 HIS 115 -20.372 22.846 -12.729
944 HD2 HIS 115 HD2 HIS 115 -19.444 25.168 -16.060
945 HE1 HIS 115 HE1 HIS 115 -18.348 21.769 -13.771
946 HE2 HIS 115 HE2 HIS 115 -17.708 23.285 -15.687
947 H HIS 116 H HIS 116 -21.716 28.530 -14.679
948 HA HIS 116 HA HIS 116 -24.368 28.850 -13.449
949 HB2 HIS 116 HB2 HIS 116 -24.047 31.289 -13.269
950 HB3 HIS 116 HB3 HIS 116 -22.908 30.409 -12.258
951 HD1 HIS 116 HD1 HIS 116 -23.094 32.921 -14.925
952 HD2 HIS 116 HD2 HIS 116 -20.215 30.374 -13.326
953 HE1 HIS 116 HE1 HIS 116 -20.882 33.769 -15.777
954 HE2 HIS 116 HE2 HIS 116 -19.149 32.233 -14.778
Start of MODEL 13
1 H1 MET 1 H1 MET 1 -0.547 -11.921 18.249
2 H2 MET 1 H2 MET 1 -2.054 -11.538 18.924
3 H3 MET 1 H3 MET 1 -1.699 -11.083 17.331
4 HA MET 1 HA MET 1 -1.915 -13.876 18.299
5 HB2 MET 1 HB2 MET 1 -4.087 -12.658 18.249
6 HB3 MET 1 HB3 MET 1 -3.812 -12.286 16.554
7 HG2 MET 1 HG2 MET 1 -3.832 -14.668 16.023
8 HG3 MET 1 HG3 MET 1 -4.102 -15.044 17.724
9 HE1 MET 1 HE1 MET 1 -7.557 -15.933 16.134
10 HE2 MET 1 HE2 MET 1 -6.233 -16.498 17.154
11 HE3 MET 1 HE3 MET 1 -5.956 -16.190 15.440
12 H ALA 2 H ALA 2 -1.781 -11.694 15.501
13 HA ALA 2 HA ALA 2 -0.381 -13.813 14.008
14 HB1 ALA 2 HB1 ALA 2 -2.619 -13.349 13.092
15 HB2 ALA 2 HB2 ALA 2 -1.338 -12.909 11.962
16 HB3 ALA 2 HB3 ALA 2 -2.169 -11.655 12.880
17 H GLU 3 H GLU 3 1.680 -13.339 13.697
18 HA GLU 3 HA GLU 3 2.640 -10.930 12.620
19 HB2 GLU 3 HB2 GLU 3 2.098 -10.043 14.862
20 HB3 GLU 3 HB3 GLU 3 3.155 -11.244 15.585
21 HG2 GLU 3 HG2 GLU 3 5.079 -10.249 14.505
22 HG3 GLU 3 HG3 GLU 3 4.040 -9.087 13.682
23 H LYS 4 H LYS 4 3.324 -13.761 14.593
24 HA LYS 4 HA LYS 4 6.076 -13.816 13.616
25 HB2 LYS 4 HB2 LYS 4 6.401 -15.605 15.301
26 HB3 LYS 4 HB3 LYS 4 5.832 -14.094 15.993
27 HG2 LYS 4 HG2 LYS 4 3.540 -15.029 16.034
28 HG3 LYS 4 HG3 LYS 4 4.199 -16.565 15.468
29 HD2 LYS 4 HD2 LYS 4 5.575 -16.743 17.452
30 HD3 LYS 4 HD3 LYS 4 5.025 -15.158 18.003
31 HE2 LYS 4 HE2 LYS 4 2.716 -16.031 18.094
32 HE3 LYS 4 HE3 LYS 4 3.325 -17.621 17.635
33 HZ1 LYS 4 HZ1 LYS 4 4.165 -16.132 20.057
34 HZ2 LYS 4 HZ2 LYS 4 4.612 -17.714 19.637
35 HZ3 LYS 4 HZ3 LYS 4 3.001 -17.364 20.042
36 H ASN 5 H ASN 5 3.067 -15.618 13.367
37 HA ASN 5 HA ASN 5 4.449 -17.634 11.742
38 HB2 ASN 5 HB2 ASN 5 3.100 -18.563 13.539
39 HB3 ASN 5 HB3 ASN 5 1.686 -17.680 12.972
40 HD21 ASN 5 HD21 ASN 5 0.484 -19.542 12.675
41 HD22 ASN 5 HD22 ASN 5 0.789 -20.641 11.369
42 H ALA 6 H ALA 6 1.132 -16.347 11.594
43 HA ALA 6 HA ALA 6 1.527 -16.022 8.696
44 HB1 ALA 6 HB1 ALA 6 -0.828 -16.526 8.406
45 HB2 ALA 6 HB2 ALA 6 -1.037 -16.675 10.150
46 HB3 ALA 6 HB3 ALA 6 -0.029 -17.832 9.280
47 H TYR 7 H TYR 7 1.639 -13.962 8.134
48 HA TYR 7 HA TYR 7 -0.375 -12.091 8.975
49 HB2 TYR 7 HB2 TYR 7 1.446 -12.117 10.799
50 HB3 TYR 7 HB3 TYR 7 2.481 -11.352 9.601
51 HD1 TYR 7 HD2 TYR 7 -1.053 -10.882 10.746
52 HD2 TYR 7 HD1 TYR 7 2.724 -9.090 9.953
53 HE1 TYR 7 HE2 TYR 7 -1.964 -8.694 11.395
54 HE2 TYR 7 HE1 TYR 7 1.821 -6.897 10.601
55 HH TYR 7 HH TYR 7 -1.185 -6.539 12.184
56 H THR 8 H THR 8 -0.895 -11.611 6.912
57 HA THR 8 HA THR 8 1.216 -11.120 4.960
58 HB THR 8 HB THR 8 -0.727 -10.987 3.349
59 HG1 THR 8 HG1 THR 8 -2.742 -11.756 4.146
60 HG21 THR 8 HG21 THR 8 0.550 -13.047 3.597
61 HG22 THR 8 HG22 THR 8 -1.160 -13.415 3.369
62 HG23 THR 8 HG23 THR 8 -0.442 -13.518 4.977
63 H VAL 9 H VAL 9 0.713 -9.272 3.368
64 HA VAL 9 HA VAL 9 0.743 -6.824 4.751
65 HB VAL 9 HB VAL 9 0.543 -5.761 2.503
66 HG11 VAL 9 HG11 VAL 9 2.723 -6.372 3.379
67 HG12 VAL 9 HG12 VAL 9 2.675 -6.649 1.637
68 HG13 VAL 9 HG13 VAL 9 2.542 -8.009 2.751
69 HG21 VAL 9 HG21 VAL 9 0.360 -8.615 1.535
70 HG22 VAL 9 HG22 VAL 9 0.563 -7.193 0.513
71 HG23 VAL 9 HG23 VAL 9 -0.921 -7.404 1.444
72 H ALA 10 H ALA 10 -1.863 -8.707 3.451
73 HA ALA 10 HA ALA 10 -3.852 -6.686 3.428
74 HB1 ALA 10 HB1 ALA 10 -4.147 -8.807 2.251
75 HB2 ALA 10 HB2 ALA 10 -5.454 -8.537 3.404
76 HB3 ALA 10 HB3 ALA 10 -4.157 -9.668 3.791
77 H GLN 11 H GLN 11 -2.844 -9.075 5.847
78 HA GLN 11 HA GLN 11 -4.708 -8.261 7.832
79 HB2 GLN 11 HB2 GLN 11 -2.119 -9.808 8.004
80 HB3 GLN 11 HB3 GLN 11 -3.168 -9.529 9.386
81 HG2 GLN 11 HG2 GLN 11 -4.038 -10.916 6.864
82 HG3 GLN 11 HG3 GLN 11 -3.445 -11.748 8.301
83 HE21 GLN 11 HE21 GLN 11 -6.051 -9.891 6.937
84 HE22 GLN 11 HE22 GLN 11 -7.214 -10.235 8.173
85 H LEU 12 H LEU 12 -1.415 -7.365 7.037
86 HA LEU 12 HA LEU 12 -0.795 -5.742 9.217
87 HB2 LEU 12 HB2 LEU 12 0.727 -6.464 7.340
88 HB3 LEU 12 HB3 LEU 12 -0.030 -5.253 6.332
89 HG LEU 12 HG LEU 12 2.220 -4.642 7.301
90 HD11 LEU 12 HD11 LEU 12 0.730 -2.938 6.425
91 HD12 LEU 12 HD12 LEU 12 1.611 -2.347 7.834
92 HD13 LEU 12 HD13 LEU 12 -0.081 -2.827 7.988
93 HD21 LEU 12 HD21 LEU 12 0.633 -4.429 9.851
94 HD22 LEU 12 HD22 LEU 12 2.293 -3.877 9.613
95 HD23 LEU 12 HD23 LEU 12 1.912 -5.596 9.515
96 H ALA 13 H ALA 13 -2.535 -5.001 6.229
97 HA ALA 13 HA ALA 13 -2.818 -2.232 6.649
98 HB1 ALA 13 HB1 ALA 13 -4.505 -2.322 4.907
99 HB2 ALA 13 HB2 ALA 13 -4.597 -4.076 5.065
100 HB3 ALA 13 HB3 ALA 13 -3.118 -3.322 4.476
101 H ASP 14 H ASP 14 -4.557 -4.951 7.925
102 HA ASP 14 HA ASP 14 -6.932 -3.508 8.598
103 HB2 ASP 14 HB2 ASP 14 -6.848 -5.991 8.268
104 HB3 ASP 14 HB3 ASP 14 -5.946 -6.116 9.776
105 H GLU 15 H GLU 15 -4.000 -4.441 10.375
106 HA GLU 15 HA GLU 15 -4.880 -3.104 12.768
107 HB2 GLU 15 HB2 GLU 15 -3.218 -4.991 12.762
108 HB3 GLU 15 HB3 GLU 15 -2.057 -3.899 12.019
109 HG2 GLU 15 HG2 GLU 15 -2.142 -2.447 13.956
110 HG3 GLU 15 HG3 GLU 15 -3.361 -3.481 14.698
111 H TYR 16 H TYR 16 -3.104 -2.326 9.899
112 HA TYR 16 HA TYR 16 -1.866 0.054 10.646
113 HB2 TYR 16 HB2 TYR 16 -1.213 -0.887 8.590
114 HB3 TYR 16 HB3 TYR 16 -2.870 -0.987 8.007
115 HD1 TYR 16 HD2 TYR 16 -0.285 1.534 8.985
116 HD2 TYR 16 HD1 TYR 16 -3.661 0.625 6.562
117 HE1 TYR 16 HE2 TYR 16 -0.012 3.679 7.808
118 HE2 TYR 16 HE1 TYR 16 -3.398 2.760 5.377
119 HH TYR 16 HH TYR 16 -2.410 4.862 5.568
120 H PHE 17 H PHE 17 -5.168 -0.455 9.354
121 HA PHE 17 HA PHE 17 -5.662 2.344 9.155
122 HB2 PHE 17 HB2 PHE 17 -7.677 1.803 8.245
123 HB3 PHE 17 HB3 PHE 17 -6.930 0.226 8.088
124 HD1 PHE 17 HD1 PHE 17 -9.410 2.224 9.876
125 HD2 PHE 17 HD2 PHE 17 -7.657 -1.630 9.463
126 HE1 PHE 17 HE1 PHE 17 -11.276 1.247 11.144
127 HE2 PHE 17 HE2 PHE 17 -9.520 -2.614 10.733
128 HZ PHE 17 HZ PHE 17 -11.334 -1.178 11.574
129 H GLU 18 H GLU 18 -6.020 -0.018 11.684
130 HA GLU 18 HA GLU 18 -7.634 1.585 13.403
131 HB2 GLU 18 HB2 GLU 18 -7.418 -0.907 13.539
132 HB3 GLU 18 HB3 GLU 18 -5.781 -0.690 14.141
133 HG2 GLU 18 HG2 GLU 18 -6.660 0.512 16.082
134 HG3 GLU 18 HG3 GLU 18 -8.298 0.275 15.477
135 H ARG 19 H ARG 19 -4.299 1.484 12.620
136 HA ARG 19 HA ARG 19 -3.464 2.968 14.975
137 HB2 ARG 19 HB2 ARG 19 -2.120 1.557 12.762
138 HB3 ARG 19 HB3 ARG 19 -1.307 3.011 13.315
139 HG2 ARG 19 HG2 ARG 19 -0.409 1.107 14.457
140 HG3 ARG 19 HG3 ARG 19 -1.303 2.104 15.604
141 HD2 ARG 19 HD2 ARG 19 -3.153 0.585 15.579
142 HD3 ARG 19 HD3 ARG 19 -2.441 -0.338 14.253
143 HE ARG 19 HE ARG 19 -0.534 -0.623 16.031
144 HH11 ARG 19 HH11 ARG 19 -4.003 -0.818 16.523
145 HH12 ARG 19 HH12 ARG 19 -3.877 -1.889 17.882
146 HH21 ARG 19 HH21 ARG 19 -0.374 -2.033 17.804
147 HH22 ARG 19 HH22 ARG 19 -1.808 -2.585 18.610
148 H MET 20 H MET 20 -3.316 3.491 11.435
149 HA MET 20 HA MET 20 -2.529 6.247 11.904
150 HB2 MET 20 HB2 MET 20 -1.469 4.711 10.180
151 HB3 MET 20 HB3 MET 20 -2.944 4.893 9.241
152 HG2 MET 20 HG2 MET 20 -1.309 6.411 8.396
153 HG3 MET 20 HG3 MET 20 -2.565 7.341 9.212
154 HE1 MET 20 HE1 MET 20 0.681 9.433 9.909
155 HE2 MET 20 HE2 MET 20 -0.961 9.473 9.267
156 HE3 MET 20 HE3 MET 20 0.288 8.539 8.441
157 H ILE 21 H ILE 21 -5.364 4.500 10.919
158 HA ILE 21 HA ILE 21 -6.666 6.981 10.016
159 HB ILE 21 HB ILE 21 -7.790 4.191 9.768
160 HG12 ILE 21 HG12 ILE 21 -5.584 4.249 8.667
161 HG13 ILE 21 HG13 ILE 21 -6.887 4.105 7.493
162 HG21 ILE 21 HG21 ILE 21 -9.363 6.037 9.463
163 HG22 ILE 21 HG22 ILE 21 -9.090 5.177 7.947
164 HG23 ILE 21 HG23 ILE 21 -8.312 6.733 8.230
165 HD11 ILE 21 HD11 ILE 21 -5.166 5.639 6.729
166 HD12 ILE 21 HD12 ILE 21 -5.392 6.630 8.171
167 HD13 ILE 21 HD13 ILE 21 -6.693 6.485 6.989
168 H ALA 22 H ALA 22 -6.070 6.412 12.764
169 HA ALA 22 HA ALA 22 -8.761 6.115 13.899
170 HB1 ALA 22 HB1 ALA 22 -7.096 4.578 14.806
171 HB2 ALA 22 HB2 ALA 22 -7.636 5.718 16.038
172 HB3 ALA 22 HB3 ALA 22 -6.072 5.941 15.256
173 H GLY 23 H GLY 23 -8.787 7.489 16.116
174 HA2 GLY 23 HA2 GLY 23 -8.543 9.564 17.161
175 HA3 GLY 23 HA3 GLY 23 -7.527 10.086 15.826
176 H ARG 24 H ARG 24 -8.553 10.767 13.856
177 HA ARG 24 HA ARG 24 -11.416 11.299 14.016
178 HB2 ARG 24 HB2 ARG 24 -10.030 13.255 14.959
179 HB3 ARG 24 HB3 ARG 24 -9.500 13.519 13.306
180 HG2 ARG 24 HG2 ARG 24 -12.405 13.439 14.041
181 HG3 ARG 24 HG3 ARG 24 -11.447 14.911 14.186
182 HD2 ARG 24 HD2 ARG 24 -10.892 14.748 11.792
183 HD3 ARG 24 HD3 ARG 24 -11.909 13.313 11.669
184 HE ARG 24 HE ARG 24 -13.747 14.890 12.488
185 HH11 ARG 24 HH11 ARG 24 -11.048 15.908 10.518
186 HH12 ARG 24 HH12 ARG 24 -11.905 17.221 9.779
187 HH21 ARG 24 HH21 ARG 24 -14.895 16.598 11.530
188 HH22 ARG 24 HH22 ARG 24 -14.117 17.619 10.358
189 H TRP 25 H TRP 25 -11.972 10.138 12.280
190 HA TRP 25 HA TRP 25 -10.783 10.865 9.706
191 HB2 TRP 25 HB2 TRP 25 -10.563 8.547 9.029
192 HB3 TRP 25 HB3 TRP 25 -9.670 8.780 10.516
193 HD1 TRP 25 HD1 TRP 25 -12.155 6.582 8.964
194 HE1 TRP 25 HE1 TRP 25 -13.181 4.980 10.690
195 HE3 TRP 25 HE3 TRP 25 -10.495 8.809 13.253
196 HZ2 TRP 25 HZ2 TRP 25 -13.279 4.686 13.484
197 HZ3 TRP 25 HZ3 TRP 25 -11.105 7.804 15.412
198 HH2 TRP 25 HH2 TRP 25 -12.470 5.787 15.524
199 H LYS 26 H LYS 26 -13.337 9.104 11.383
200 HA LYS 26 HA LYS 26 -15.550 8.878 11.070
201 HB2 LYS 26 HB2 LYS 26 -15.224 11.160 9.124
202 HB3 LYS 26 HB3 LYS 26 -16.768 10.507 9.658
203 HG2 LYS 26 HG2 LYS 26 -16.112 11.080 11.998
204 HG3 LYS 26 HG3 LYS 26 -14.697 11.902 11.339
205 HD2 LYS 26 HD2 LYS 26 -16.464 13.502 11.754
206 HD3 LYS 26 HD3 LYS 26 -16.191 13.348 10.017
207 HE2 LYS 26 HE2 LYS 26 -18.108 11.847 9.842
208 HE3 LYS 26 HE3 LYS 26 -18.372 11.973 11.582
209 HZ1 LYS 26 HZ1 LYS 26 -19.853 13.433 10.382
210 HZ2 LYS 26 HZ2 LYS 26 -18.542 14.199 9.626
211 HZ3 LYS 26 HZ3 LYS 26 -18.758 14.350 11.303
212 H HIS 27 H HIS 27 -16.512 7.274 10.133
213 HA HIS 27 HA HIS 27 -17.082 5.637 8.682
214 HB2 HIS 27 HB2 HIS 27 -16.372 7.642 6.525
215 HB3 HIS 27 HB3 HIS 27 -17.277 6.152 6.285
216 HD1 HIS 27 HD1 HIS 27 -18.089 9.367 6.004
217 HD2 HIS 27 HD2 HIS 27 -19.475 6.516 8.699
218 HE1 HIS 27 HE1 HIS 27 -20.333 10.193 6.778
219 HE2 HIS 27 HE2 HIS 27 -21.046 8.564 8.557
220 HA PRO 28 HA PRO 28 -12.632 4.464 8.274
221 HB2 PRO 28 HB2 PRO 28 -12.960 2.009 9.421
222 HB3 PRO 28 HB3 PRO 28 -12.658 3.480 10.353
223 HG2 PRO 28 HG2 PRO 28 -15.240 2.066 9.821
224 HG3 PRO 28 HG3 PRO 28 -14.650 2.792 11.327
225 HD2 PRO 28 HD2 PRO 28 -16.447 4.024 9.727
226 HD3 PRO 28 HD3 PRO 28 -15.250 4.923 10.683
227 H ASN 29 H ASN 29 -15.649 3.075 7.300
228 HA ASN 29 HA ASN 29 -14.598 0.816 5.914
229 HB2 ASN 29 HB2 ASN 29 -16.862 0.540 5.022
230 HB3 ASN 29 HB3 ASN 29 -16.899 0.827 6.757
231 HD21 ASN 29 HD21 ASN 29 -18.975 1.190 4.752
232 HD22 ASN 29 HD22 ASN 29 -19.462 2.854 4.855
233 H ILE 30 H ILE 30 -15.476 4.094 4.978
234 HA ILE 30 HA ILE 30 -15.284 3.673 2.178
235 HB ILE 30 HB ILE 30 -14.994 6.252 3.735
236 HG12 ILE 30 HG12 ILE 30 -17.400 5.018 2.370
237 HG13 ILE 30 HG13 ILE 30 -17.148 5.114 4.110
238 HG21 ILE 30 HG21 ILE 30 -14.064 6.434 1.486
239 HG22 ILE 30 HG22 ILE 30 -15.560 7.358 1.622
240 HG23 ILE 30 HG23 ILE 30 -15.562 5.795 0.808
241 HD11 ILE 30 HD11 ILE 30 -17.227 7.547 3.988
242 HD12 ILE 30 HD12 ILE 30 -18.697 6.817 3.343
243 HD13 ILE 30 HD13 ILE 30 -17.473 7.451 2.243
244 H VAL 31 H VAL 31 -12.997 4.891 4.604
245 HA VAL 31 HA VAL 31 -10.907 5.316 2.708
246 HB VAL 31 HB VAL 31 -9.415 5.531 4.679
247 HG11 VAL 31 HG11 VAL 31 -12.007 7.062 4.871
248 HG12 VAL 31 HG12 VAL 31 -10.628 7.472 3.852
249 HG13 VAL 31 HG13 VAL 31 -10.476 7.536 5.608
250 HG21 VAL 31 HG21 VAL 31 -10.366 5.474 6.928
251 HG22 VAL 31 HG22 VAL 31 -10.478 3.899 6.144
252 HG23 VAL 31 HG23 VAL 31 -11.906 4.927 6.266
253 H ARG 32 H ARG 32 -11.989 2.623 4.631
254 HA ARG 32 HA ARG 32 -9.758 0.944 4.480
255 HB2 ARG 32 HB2 ARG 32 -11.581 0.367 5.917
256 HB3 ARG 32 HB3 ARG 32 -12.715 0.346 4.579
257 HG2 ARG 32 HG2 ARG 32 -12.208 -1.903 5.311
258 HG3 ARG 32 HG3 ARG 32 -11.613 -1.638 3.674
259 HD2 ARG 32 HD2 ARG 32 -9.373 -1.483 4.410
260 HD3 ARG 32 HD3 ARG 32 -9.860 -1.351 6.093
261 HE ARG 32 HE ARG 32 -10.233 -3.813 4.501
262 HH11 ARG 32 HH11 ARG 32 -9.337 -2.177 7.470
263 HH12 ARG 32 HH12 ARG 32 -9.026 -3.647 8.346
264 HH21 ARG 32 HH21 ARG 32 -9.774 -5.766 5.663
265 HH22 ARG 32 HH22 ARG 32 -9.260 -5.658 7.325
266 H SER 33 H SER 33 -12.399 1.488 2.189
267 HA SER 33 HA SER 33 -11.954 -0.581 0.415
268 HB2 SER 33 HB2 SER 33 -12.777 2.244 -0.312
269 HB3 SER 33 HB3 SER 33 -13.117 0.779 -1.234
270 HG SER 33 HG SER 33 -14.075 0.194 1.049
271 H ARG 34 H ARG 34 -10.329 2.557 0.599
272 HA ARG 34 HA ARG 34 -8.737 2.095 -1.733
273 HB2 ARG 34 HB2 ARG 34 -8.507 4.088 0.520
274 HB3 ARG 34 HB3 ARG 34 -7.382 4.033 -0.827
275 HG2 ARG 34 HG2 ARG 34 -9.182 4.503 -2.384
276 HG3 ARG 34 HG3 ARG 34 -10.348 4.494 -1.059
277 HD2 ARG 34 HD2 ARG 34 -9.271 6.404 -0.047
278 HD3 ARG 34 HD3 ARG 34 -7.996 6.369 -1.264
279 HE ARG 34 HE ARG 34 -9.591 7.118 -2.889
280 HH11 ARG 34 HH11 ARG 34 -10.781 7.109 0.398
281 HH12 ARG 34 HH12 ARG 34 -11.996 8.316 0.108
282 HH21 ARG 34 HH21 ARG 34 -11.162 8.694 -3.293
283 HH22 ARG 34 HH22 ARG 34 -12.210 9.230 -2.011
284 H ILE 35 H ILE 35 -8.241 1.792 1.748
285 HA ILE 35 HA ILE 35 -5.477 1.339 1.701
286 HB ILE 35 HB ILE 35 -7.515 0.435 3.739
287 HG12 ILE 35 HG12 ILE 35 -5.686 2.847 3.674
288 HG13 ILE 35 HG13 ILE 35 -7.417 2.878 3.355
289 HG21 ILE 35 HG21 ILE 35 -5.446 -0.851 3.931
290 HG22 ILE 35 HG22 ILE 35 -5.628 0.262 5.288
291 HG23 ILE 35 HG23 ILE 35 -4.515 0.645 3.976
292 HD11 ILE 35 HD11 ILE 35 -6.144 2.062 5.954
293 HD12 ILE 35 HD12 ILE 35 -7.873 2.194 5.629
294 HD13 ILE 35 HD13 ILE 35 -6.859 3.637 5.611
295 H GLU 36 H GLU 36 -8.180 -0.985 1.565
296 HA GLU 36 HA GLU 36 -6.247 -3.155 1.468
297 HB2 GLU 36 HB2 GLU 36 -8.291 -4.634 1.356
298 HB3 GLU 36 HB3 GLU 36 -8.082 -3.701 2.825
299 HG2 GLU 36 HG2 GLU 36 -9.844 -2.285 2.324
300 HG3 GLU 36 HG3 GLU 36 -9.833 -2.712 0.618
301 H LYS 37 H LYS 37 -8.775 -1.847 -0.700
302 HA LYS 37 HA LYS 37 -8.232 -3.805 -2.691
303 HB2 LYS 37 HB2 LYS 37 -10.399 -2.434 -2.103
304 HB3 LYS 37 HB3 LYS 37 -9.717 -1.266 -3.221
305 HG2 LYS 37 HG2 LYS 37 -10.408 -4.127 -3.836
306 HG3 LYS 37 HG3 LYS 37 -11.313 -2.699 -4.332
307 HD2 LYS 37 HD2 LYS 37 -8.494 -3.379 -5.154
308 HD3 LYS 37 HD3 LYS 37 -9.934 -3.590 -6.128
309 HE2 LYS 37 HE2 LYS 37 -8.791 -0.985 -5.148
310 HE3 LYS 37 HE3 LYS 37 -8.770 -1.581 -6.805
311 HZ1 LYS 37 HZ1 LYS 37 -11.224 -1.484 -6.774
312 HZ2 LYS 37 HZ2 LYS 37 -10.493 0.027 -6.573
313 HZ3 LYS 37 HZ3 LYS 37 -11.156 -0.767 -5.237
314 H ASP 38 H ASP 38 -7.766 -0.245 -2.562
315 HA ASP 38 HA ASP 38 -6.570 -0.274 -5.171
316 HB2 ASP 38 HB2 ASP 38 -6.839 1.965 -3.161
317 HB3 ASP 38 HB3 ASP 38 -6.231 2.165 -4.801
318 H ILE 39 H ILE 39 -5.365 0.104 -1.875
319 HA ILE 39 HA ILE 39 -2.674 0.628 -2.655
320 HB ILE 39 HB ILE 39 -3.731 -0.420 -0.021
321 HG12 ILE 39 HG12 ILE 39 -4.706 1.742 -0.605
322 HG13 ILE 39 HG13 ILE 39 -3.567 1.923 0.726
323 HG21 ILE 39 HG21 ILE 39 -1.068 0.837 -0.665
324 HG22 ILE 39 HG22 ILE 39 -1.351 -0.853 -0.246
325 HG23 ILE 39 HG23 ILE 39 -1.643 0.411 0.947
326 HD11 ILE 39 HD11 ILE 39 -1.886 2.759 -0.844
327 HD12 ILE 39 HD12 ILE 39 -3.350 3.740 -0.855
328 HD13 ILE 39 HD13 ILE 39 -3.047 2.595 -2.162
329 H LYS 40 H LYS 40 -4.562 -2.254 -2.232
330 HA LYS 40 HA LYS 40 -2.237 -3.808 -3.114
331 HB2 LYS 40 HB2 LYS 40 -4.144 -4.478 -0.916
332 HB3 LYS 40 HB3 LYS 40 -3.330 -5.753 -1.814
333 HG2 LYS 40 HG2 LYS 40 -1.233 -5.134 -1.044
334 HG3 LYS 40 HG3 LYS 40 -1.772 -3.515 -0.588
335 HD2 LYS 40 HD2 LYS 40 -2.644 -6.075 0.740
336 HD3 LYS 40 HD3 LYS 40 -1.415 -4.969 1.363
337 HE2 LYS 40 HE2 LYS 40 -4.282 -4.233 0.805
338 HE3 LYS 40 HE3 LYS 40 -3.630 -4.630 2.383
339 HZ1 LYS 40 HZ1 LYS 40 -2.592 -2.425 0.714
340 HZ2 LYS 40 HZ2 LYS 40 -2.233 -2.733 2.339
341 HZ3 LYS 40 HZ3 LYS 40 -3.785 -2.211 1.894
342 HA PRO 41 HA PRO 41 -5.876 -4.119 -5.936
343 HB2 PRO 41 HB2 PRO 41 -4.536 -3.805 -8.260
344 HB3 PRO 41 HB3 PRO 41 -5.013 -2.439 -7.248
345 HG2 PRO 41 HG2 PRO 41 -2.357 -3.786 -7.485
346 HG3 PRO 41 HG3 PRO 41 -2.729 -2.056 -7.365
347 HD2 PRO 41 HD2 PRO 41 -1.883 -3.567 -5.254
348 HD3 PRO 41 HD3 PRO 41 -2.905 -2.129 -5.082
349 H ALA 42 H ALA 42 -2.806 -5.796 -6.030
350 HA ALA 42 HA ALA 42 -4.171 -8.225 -6.878
351 HB1 ALA 42 HB1 ALA 42 -3.391 -7.184 -8.963
352 HB2 ALA 42 HB2 ALA 42 -2.549 -8.699 -8.635
353 HB3 ALA 42 HB3 ALA 42 -1.746 -7.159 -8.325
354 H ILE 43 H ILE 43 -2.798 -7.103 -4.477
355 HA ILE 43 HA ILE 43 -0.818 -9.230 -4.088
356 HB ILE 43 HB ILE 43 0.555 -7.503 -2.779
357 HG12 ILE 43 HG12 ILE 43 -0.914 -5.601 -4.614
358 HG13 ILE 43 HG13 ILE 43 -1.213 -5.729 -2.888
359 HG21 ILE 43 HG21 ILE 43 1.759 -6.808 -4.823
360 HG22 ILE 43 HG22 ILE 43 0.413 -7.412 -5.790
361 HG23 ILE 43 HG23 ILE 43 1.362 -8.527 -4.806
362 HD11 ILE 43 HD11 ILE 43 1.118 -5.065 -2.463
363 HD12 ILE 43 HD12 ILE 43 0.213 -3.843 -3.357
364 HD13 ILE 43 HD13 ILE 43 1.360 -4.884 -4.200
365 H GLY 44 H GLY 44 -3.591 -8.858 -3.160
366 HA2 GLY 44 HA2 GLY 44 -3.560 -8.165 -0.401
367 HA3 GLY 44 HA3 GLY 44 -4.793 -9.121 -1.210
368 H SER 45 H SER 45 -2.937 -11.156 -2.124
369 HA SER 45 HA SER 45 -2.710 -12.650 0.371
370 HB2 SER 45 HB2 SER 45 -2.244 -13.683 -2.431
371 HB3 SER 45 HB3 SER 45 -2.654 -14.611 -0.987
372 HG SER 45 HG SER 45 -4.310 -13.629 -2.777
373 H LEU 46 H LEU 46 -0.809 -10.509 -0.729
374 HA LEU 46 HA LEU 46 1.598 -11.924 -1.421
375 HB2 LEU 46 HB2 LEU 46 1.062 -9.752 -2.411
376 HB3 LEU 46 HB3 LEU 46 1.104 -9.006 -0.826
377 HG LEU 46 HG LEU 46 3.532 -9.662 -0.692
378 HD11 LEU 46 HD11 LEU 46 3.110 -10.250 -3.615
379 HD12 LEU 46 HD12 LEU 46 3.533 -11.419 -2.362
380 HD13 LEU 46 HD13 LEU 46 4.672 -10.146 -2.803
381 HD21 LEU 46 HD21 LEU 46 2.824 -7.392 -1.209
382 HD22 LEU 46 HD22 LEU 46 2.700 -7.809 -2.918
383 HD23 LEU 46 HD23 LEU 46 4.272 -7.818 -2.120
384 H LYS 47 H LYS 47 3.176 -12.566 -0.105
385 HA LYS 47 HA LYS 47 3.156 -12.139 2.692
386 HB2 LYS 47 HB2 LYS 47 4.209 -14.090 1.487
387 HB3 LYS 47 HB3 LYS 47 5.483 -12.995 0.957
388 HG2 LYS 47 HG2 LYS 47 6.194 -14.257 2.890
389 HG3 LYS 47 HG3 LYS 47 6.048 -12.544 3.295
390 HD2 LYS 47 HD2 LYS 47 5.026 -13.633 5.083
391 HD3 LYS 47 HD3 LYS 47 3.679 -13.134 4.068
392 HE2 LYS 47 HE2 LYS 47 3.278 -15.384 4.745
393 HE3 LYS 47 HE3 LYS 47 3.715 -15.405 3.040
394 HZ1 LYS 47 HZ1 LYS 47 4.819 -17.141 4.442
395 HZ2 LYS 47 HZ2 LYS 47 5.674 -15.893 5.211
396 HZ3 LYS 47 HZ3 LYS 47 5.877 -16.161 3.549
397 H VAL 48 H VAL 48 4.796 -10.954 3.905
398 HA VAL 48 HA VAL 48 4.998 -8.293 2.926
399 HB VAL 48 HB VAL 48 6.400 -9.418 5.355
400 HG11 VAL 48 HG11 VAL 48 5.427 -6.647 4.681
401 HG12 VAL 48 HG12 VAL 48 7.106 -7.188 4.726
402 HG13 VAL 48 HG13 VAL 48 6.157 -7.137 6.212
403 HG21 VAL 48 HG21 VAL 48 4.409 -8.788 6.634
404 HG22 VAL 48 HG22 VAL 48 4.051 -10.042 5.449
405 HG23 VAL 48 HG23 VAL 48 3.581 -8.371 5.137
406 H GLU 49 H GLU 49 7.340 -10.920 3.392
407 HA GLU 49 HA GLU 49 9.528 -9.261 2.461
408 HB2 GLU 49 HB2 GLU 49 9.725 -12.238 2.739
409 HB3 GLU 49 HB3 GLU 49 10.959 -11.018 3.001
410 HG2 GLU 49 HG2 GLU 49 10.541 -11.607 5.143
411 HG3 GLU 49 HG3 GLU 49 9.357 -10.314 4.969
412 H ASP 50 H ASP 50 7.057 -10.703 0.898
413 HA ASP 50 HA ASP 50 8.653 -11.795 -1.305
414 HB2 ASP 50 HB2 ASP 50 6.807 -13.160 -0.340
415 HB3 ASP 50 HB3 ASP 50 5.661 -11.936 -0.875
416 H VAL 51 H VAL 51 7.668 -8.868 -0.494
417 HA VAL 51 HA VAL 51 6.543 -8.099 -3.058
418 HB VAL 51 HB VAL 51 5.617 -7.069 -1.035
419 HG11 VAL 51 HG11 VAL 51 8.347 -5.841 -0.691
420 HG12 VAL 51 HG12 VAL 51 7.600 -7.042 0.361
421 HG13 VAL 51 HG13 VAL 51 6.909 -5.424 0.241
422 HG21 VAL 51 HG21 VAL 51 5.716 -4.717 -1.762
423 HG22 VAL 51 HG22 VAL 51 5.466 -5.829 -3.109
424 HG23 VAL 51 HG23 VAL 51 7.057 -5.121 -2.833
425 H LYS 52 H LYS 52 7.622 -7.201 -4.667
426 HA LYS 52 HA LYS 52 10.355 -6.223 -4.214
427 HB2 LYS 52 HB2 LYS 52 10.815 -6.950 -6.600
428 HB3 LYS 52 HB3 LYS 52 10.616 -8.255 -5.442
429 HG2 LYS 52 HG2 LYS 52 8.124 -7.501 -6.748
430 HG3 LYS 52 HG3 LYS 52 9.369 -8.053 -7.872
431 HD2 LYS 52 HD2 LYS 52 8.534 -9.555 -5.391
432 HD3 LYS 52 HD3 LYS 52 7.894 -9.873 -7.006
433 HE2 LYS 52 HE2 LYS 52 10.145 -10.400 -7.797
434 HE3 LYS 52 HE3 LYS 52 10.799 -10.054 -6.196
435 HZ1 LYS 52 HZ1 LYS 52 10.400 -12.465 -6.739
436 HZ2 LYS 52 HZ2 LYS 52 8.736 -12.132 -6.662
437 HZ3 LYS 52 HZ3 LYS 52 9.708 -11.915 -5.291
438 HA PRO 53 HA PRO 53 9.356 -2.320 -6.042
439 HB2 PRO 53 HB2 PRO 53 11.298 -2.904 -8.230
440 HB3 PRO 53 HB3 PRO 53 11.172 -1.482 -7.187
441 HG2 PRO 53 HG2 PRO 53 13.064 -3.289 -6.757
442 HG3 PRO 53 HG3 PRO 53 12.205 -2.546 -5.395
443 HD2 PRO 53 HD2 PRO 53 11.893 -5.269 -6.577
444 HD3 PRO 53 HD3 PRO 53 11.791 -4.757 -4.881
445 H ARG 54 H ARG 54 9.532 -5.044 -8.260
446 HA ARG 54 HA ARG 54 8.128 -4.051 -10.435
447 HB2 ARG 54 HB2 ARG 54 9.179 -6.461 -9.741
448 HB3 ARG 54 HB3 ARG 54 7.464 -6.810 -9.620
449 HG2 ARG 54 HG2 ARG 54 8.892 -5.754 -12.048
450 HG3 ARG 54 HG3 ARG 54 8.334 -7.407 -11.805
451 HD2 ARG 54 HD2 ARG 54 6.007 -6.415 -11.544
452 HD3 ARG 54 HD3 ARG 54 6.693 -4.918 -12.175
453 HE ARG 54 HE ARG 54 7.133 -7.312 -13.766
454 HH11 ARG 54 HH11 ARG 54 5.251 -4.379 -13.299
455 HH12 ARG 54 HH12 ARG 54 4.536 -4.449 -14.881
456 HH21 ARG 54 HH21 ARG 54 6.222 -7.382 -15.824
457 HH22 ARG 54 HH22 ARG 54 5.106 -6.153 -16.335
458 H HIS 55 H HIS 55 6.931 -5.273 -7.343
459 HA HIS 55 HA HIS 55 4.177 -5.247 -8.093
460 HB2 HIS 55 HB2 HIS 55 5.490 -5.277 -5.371
461 HB3 HIS 55 HB3 HIS 55 3.750 -5.341 -5.607
462 HD1 HIS 55 HD1 HIS 55 3.753 -7.389 -7.999
463 HD2 HIS 55 HD2 HIS 55 5.864 -7.818 -4.439
464 HE1 HIS 55 HE1 HIS 55 4.170 -9.854 -7.742
465 HE2 HIS 55 HE2 HIS 55 5.263 -10.108 -5.492
466 H ILE 56 H ILE 56 6.374 -2.939 -6.621
467 HA ILE 56 HA ILE 56 4.498 -0.977 -5.881
468 HB ILE 56 HB ILE 56 7.340 -0.534 -6.827
469 HG12 ILE 56 HG12 ILE 56 7.272 -2.123 -4.969
470 HG13 ILE 56 HG13 ILE 56 7.943 -0.585 -4.438
471 HG21 ILE 56 HG21 ILE 56 5.544 1.195 -5.129
472 HG22 ILE 56 HG22 ILE 56 6.030 1.517 -6.794
473 HG23 ILE 56 HG23 ILE 56 7.235 1.528 -5.505
474 HD11 ILE 56 HD11 ILE 56 6.451 -1.494 -2.768
475 HD12 ILE 56 HD12 ILE 56 5.140 -1.570 -3.946
476 HD13 ILE 56 HD13 ILE 56 5.780 -0.007 -3.437
477 H ASP 57 H ASP 57 6.184 -1.635 -8.905
478 HA ASP 57 HA ASP 57 5.144 0.550 -10.373
479 HB2 ASP 57 HB2 ASP 57 7.017 -0.587 -11.306
480 HB3 ASP 57 HB3 ASP 57 6.220 -2.151 -11.183
481 H ASP 58 H ASP 58 4.096 -2.803 -9.995
482 HA ASP 58 HA ASP 58 1.956 -2.713 -11.802
483 HB2 ASP 58 HB2 ASP 58 2.950 -4.806 -10.982
484 HB3 ASP 58 HB3 ASP 58 2.288 -4.492 -9.381
485 H VAL 59 H VAL 59 2.060 -1.933 -8.340
486 HA VAL 59 HA VAL 59 -0.779 -1.628 -8.162
487 HB VAL 59 HB VAL 59 0.414 -2.131 -6.127
488 HG11 VAL 59 HG11 VAL 59 1.827 0.506 -6.490
489 HG12 VAL 59 HG12 VAL 59 2.552 -1.099 -6.593
490 HG13 VAL 59 HG13 VAL 59 1.919 -0.514 -5.055
491 HG21 VAL 59 HG21 VAL 59 -0.712 0.664 -6.034
492 HG22 VAL 59 HG22 VAL 59 -0.462 -0.393 -4.644
493 HG23 VAL 59 HG23 VAL 59 -1.626 -0.836 -5.891
494 H LEU 60 H LEU 60 1.927 0.623 -8.602
495 HA LEU 60 HA LEU 60 0.327 2.968 -8.480
496 HB2 LEU 60 HB2 LEU 60 3.050 2.476 -9.693
497 HB3 LEU 60 HB3 LEU 60 2.307 4.058 -9.588
498 HG LEU 60 HG LEU 60 3.093 2.307 -7.257
499 HD11 LEU 60 HD11 LEU 60 4.717 4.094 -6.811
500 HD12 LEU 60 HD12 LEU 60 4.236 4.888 -8.309
501 HD13 LEU 60 HD13 LEU 60 5.003 3.301 -8.359
502 HD21 LEU 60 HD21 LEU 60 1.890 5.074 -7.280
503 HD22 LEU 60 HD22 LEU 60 2.469 4.206 -5.858
504 HD23 LEU 60 HD23 LEU 60 1.080 3.597 -6.757
505 H LYS 61 H LYS 61 1.427 0.941 -11.189
506 HA LYS 61 HA LYS 61 0.374 2.651 -13.184
507 HB2 LYS 61 HB2 LYS 61 0.675 0.821 -14.722
508 HB3 LYS 61 HB3 LYS 61 2.063 0.923 -13.652
509 HG2 LYS 61 HG2 LYS 61 1.112 -0.935 -12.317
510 HG3 LYS 61 HG3 LYS 61 -0.191 -1.067 -13.501
511 HD2 LYS 61 HD2 LYS 61 2.757 -1.434 -14.022
512 HD3 LYS 61 HD3 LYS 61 1.526 -2.699 -13.990
513 HE2 LYS 61 HE2 LYS 61 0.433 -1.743 -15.913
514 HE3 LYS 61 HE3 LYS 61 1.538 -0.370 -15.901
515 HZ1 LYS 61 HZ1 LYS 61 2.167 -1.986 -17.571
516 HZ2 LYS 61 HZ2 LYS 61 2.301 -3.198 -16.394
517 HZ3 LYS 61 HZ3 LYS 61 3.365 -1.880 -16.374
518 H ALA 62 H ALA 62 -1.007 0.113 -11.222
519 HA ALA 62 HA ALA 62 -3.454 -0.128 -12.640
520 HB1 ALA 62 HB1 ALA 62 -4.286 -1.241 -10.628
521 HB2 ALA 62 HB2 ALA 62 -2.865 -0.700 -9.735
522 HB3 ALA 62 HB3 ALA 62 -2.685 -1.838 -11.070
523 H VAL 63 H VAL 63 -2.553 1.687 -9.701
524 HA VAL 63 HA VAL 63 -5.100 2.830 -9.321
525 HB VAL 63 HB VAL 63 -3.994 4.419 -7.784
526 HG11 VAL 63 HG11 VAL 63 -3.163 2.747 -6.198
527 HG12 VAL 63 HG12 VAL 63 -3.112 1.556 -7.496
528 HG13 VAL 63 HG13 VAL 63 -4.656 2.232 -6.980
529 HG21 VAL 63 HG21 VAL 63 -1.921 4.783 -8.993
530 HG22 VAL 63 HG22 VAL 63 -1.440 3.113 -8.689
531 HG23 VAL 63 HG23 VAL 63 -1.604 4.243 -7.344
532 H MET 64 H MET 64 -2.352 3.879 -11.244
533 HA MET 64 HA MET 64 -3.463 6.479 -11.753
534 HB2 MET 64 HB2 MET 64 -1.229 4.956 -13.084
535 HB3 MET 64 HB3 MET 64 -1.707 6.581 -13.550
536 HG2 MET 64 HG2 MET 64 -1.234 7.319 -11.226
537 HG3 MET 64 HG3 MET 64 -0.603 5.707 -10.894
538 HE1 MET 64 HE1 MET 64 0.809 4.983 -13.657
539 HE2 MET 64 HE2 MET 64 1.567 4.688 -12.092
540 HE3 MET 64 HE3 MET 64 2.457 5.535 -13.357
541 H LYS 65 H LYS 65 -3.872 3.330 -13.099
542 HA LYS 65 HA LYS 65 -4.803 4.261 -15.647
543 HB2 LYS 65 HB2 LYS 65 -3.588 2.103 -15.283
544 HB3 LYS 65 HB3 LYS 65 -4.987 1.514 -14.399
545 HG2 LYS 65 HG2 LYS 65 -5.331 2.510 -17.180
546 HG3 LYS 65 HG3 LYS 65 -4.644 0.909 -16.901
547 HD2 LYS 65 HD2 LYS 65 -7.198 1.771 -15.595
548 HD3 LYS 65 HD3 LYS 65 -7.171 1.103 -17.213
549 HE2 LYS 65 HE2 LYS 65 -5.845 -0.836 -16.178
550 HE3 LYS 65 HE3 LYS 65 -6.415 -0.205 -14.635
551 HZ1 LYS 65 HZ1 LYS 65 -7.889 -1.924 -15.438
552 HZ2 LYS 65 HZ2 LYS 65 -8.126 -1.096 -16.895
553 HZ3 LYS 65 HZ3 LYS 65 -8.698 -0.435 -15.445
554 H ARG 66 H ARG 66 -6.255 2.713 -12.789
555 HA ARG 66 HA ARG 66 -8.937 3.180 -13.733
556 HB2 ARG 66 HB2 ARG 66 -9.639 2.278 -11.554
557 HB3 ARG 66 HB3 ARG 66 -8.480 1.226 -12.352
558 HG2 ARG 66 HG2 ARG 66 -6.713 2.003 -10.912
559 HG3 ARG 66 HG3 ARG 66 -7.790 3.188 -10.174
560 HD2 ARG 66 HD2 ARG 66 -8.306 0.227 -10.119
561 HD3 ARG 66 HD3 ARG 66 -7.410 1.071 -8.860
562 HE ARG 66 HE ARG 66 -9.396 2.218 -8.252
563 HH11 ARG 66 HH11 ARG 66 -9.899 -0.285 -10.658
564 HH12 ARG 66 HH12 ARG 66 -11.619 -0.349 -10.397
565 HH21 ARG 66 HH21 ARG 66 -11.642 2.105 -7.900
566 HH22 ARG 66 HH22 ARG 66 -12.603 0.988 -8.840
567 H GLY 67 H GLY 67 -6.611 5.066 -12.182
568 HA2 GLY 67 HA2 GLY 67 -8.687 7.012 -11.421
569 HA3 GLY 67 HA3 GLY 67 -7.355 6.659 -10.332
570 H ALA 68 H ALA 68 -5.722 8.027 -10.406
571 HA ALA 68 HA ALA 68 -4.900 9.246 -12.909
572 HB1 ALA 68 HB1 ALA 68 -6.649 10.758 -12.109
573 HB2 ALA 68 HB2 ALA 68 -5.064 11.529 -12.040
574 HB3 ALA 68 HB3 ALA 68 -5.815 10.915 -10.565
575 HA PRO 69 HA PRO 69 -0.850 8.938 -11.130
576 HB2 PRO 69 HB2 PRO 69 0.271 11.308 -11.995
577 HB3 PRO 69 HB3 PRO 69 0.130 9.845 -12.973
578 HG2 PRO 69 HG2 PRO 69 -1.611 12.274 -12.932
579 HG3 PRO 69 HG3 PRO 69 -1.063 11.312 -14.316
580 HD2 PRO 69 HD2 PRO 69 -3.545 11.069 -13.336
581 HD3 PRO 69 HD3 PRO 69 -2.653 9.664 -13.960
582 H SER 70 H SER 70 -2.782 11.771 -10.543
583 HA SER 70 HA SER 70 -1.269 13.045 -8.579
584 HB2 SER 70 HB2 SER 70 -4.282 12.889 -8.570
585 HB3 SER 70 HB3 SER 70 -3.258 14.233 -8.061
586 HG SER 70 HG SER 70 -4.086 14.694 -10.099
587 H ILE 71 H ILE 71 -3.412 10.265 -8.433
588 HA ILE 71 HA ILE 71 -3.549 10.137 -5.574
589 HB ILE 71 HB ILE 71 -4.113 7.956 -7.591
590 HG12 ILE 71 HG12 ILE 71 -6.017 9.949 -6.342
591 HG13 ILE 71 HG13 ILE 71 -5.450 9.998 -8.008
592 HG21 ILE 71 HG21 ILE 71 -5.517 6.998 -5.831
593 HG22 ILE 71 HG22 ILE 71 -5.015 8.283 -4.732
594 HG23 ILE 71 HG23 ILE 71 -3.832 7.118 -5.324
595 HD11 ILE 71 HD11 ILE 71 -7.094 7.797 -6.778
596 HD12 ILE 71 HD12 ILE 71 -6.545 7.872 -8.454
597 HD13 ILE 71 HD13 ILE 71 -7.692 9.067 -7.845
598 H ALA 72 H ALA 72 -1.497 8.785 -8.061
599 HA ALA 72 HA ALA 72 -0.422 6.590 -6.756
600 HB1 ALA 72 HB1 ALA 72 0.945 8.392 -8.744
601 HB2 ALA 72 HB2 ALA 72 -0.095 7.019 -9.126
602 HB3 ALA 72 HB3 ALA 72 1.447 6.757 -8.311
603 H ASN 73 H ASN 73 0.537 9.978 -6.539
604 HA ASN 73 HA ASN 73 2.943 9.648 -5.145
605 HB2 ASN 73 HB2 ASN 73 0.926 11.897 -5.015
606 HB3 ASN 73 HB3 ASN 73 2.521 11.965 -4.275
607 HD21 ASN 73 HD21 ASN 73 0.718 12.083 -7.214
608 HD22 ASN 73 HD22 ASN 73 2.024 12.554 -8.239
609 H ASP 74 H ASP 74 -0.372 10.022 -3.946
610 HA ASP 74 HA ASP 74 0.410 9.756 -1.204
611 HB2 ASP 74 HB2 ASP 74 -2.229 9.876 -2.622
612 HB3 ASP 74 HB3 ASP 74 -2.155 9.400 -0.928
613 H THR 75 H THR 75 -0.737 7.584 -3.713
614 HA THR 75 HA THR 75 -1.199 5.312 -2.143
615 HB THR 75 HB THR 75 -0.013 5.376 -4.932
616 HG1 THR 75 HG1 THR 75 -2.711 4.873 -4.594
617 HG21 THR 75 HG21 THR 75 0.143 3.178 -3.873
618 HG22 THR 75 HG22 THR 75 -1.053 3.164 -5.168
619 HG23 THR 75 HG23 THR 75 -1.576 3.232 -3.486
620 H LEU 76 H LEU 76 1.791 6.530 -3.623
621 HA LEU 76 HA LEU 76 3.490 4.474 -2.702
622 HB2 LEU 76 HB2 LEU 76 4.004 6.159 -4.493
623 HB3 LEU 76 HB3 LEU 76 4.219 7.359 -3.235
624 HG LEU 76 HG LEU 76 5.870 4.853 -3.187
625 HD11 LEU 76 HD11 LEU 76 6.113 5.688 -5.449
626 HD12 LEU 76 HD12 LEU 76 7.575 6.017 -4.518
627 HD13 LEU 76 HD13 LEU 76 6.423 7.314 -4.838
628 HD21 LEU 76 HD21 LEU 76 5.962 6.343 -1.261
629 HD22 LEU 76 HD22 LEU 76 6.369 7.696 -2.312
630 HD23 LEU 76 HD23 LEU 76 7.496 6.352 -2.131
631 H ARG 77 H ARG 77 2.484 7.554 -1.297
632 HA ARG 77 HA ARG 77 4.086 7.503 1.004
633 HB2 ARG 77 HB2 ARG 77 1.330 8.677 0.575
634 HB3 ARG 77 HB3 ARG 77 2.317 8.970 2.002
635 HG2 ARG 77 HG2 ARG 77 3.992 10.073 0.697
636 HG3 ARG 77 HG3 ARG 77 3.175 9.633 -0.803
637 HD2 ARG 77 HD2 ARG 77 1.258 11.006 -0.170
638 HD3 ARG 77 HD3 ARG 77 2.058 11.434 1.342
639 HE ARG 77 HE ARG 77 3.872 12.244 -0.424
640 HH11 ARG 77 HH11 ARG 77 0.388 12.681 -0.426
641 HH12 ARG 77 HH12 ARG 77 0.466 14.218 -1.241
642 HH21 ARG 77 HH21 ARG 77 3.969 14.236 -1.512
643 HH22 ARG 77 HH22 ARG 77 2.501 15.120 -1.846
644 H TRP 78 H TRP 78 0.855 6.179 0.405
645 HA TRP 78 HA TRP 78 0.459 5.099 2.978
646 HB2 TRP 78 HB2 TRP 78 -0.847 4.969 0.378
647 HB3 TRP 78 HB3 TRP 78 -0.954 3.447 1.258
648 HD1 TRP 78 HD1 TRP 78 -3.108 3.308 2.601
649 HE1 TRP 78 HE1 TRP 78 -4.618 4.956 3.874
650 HE3 TRP 78 HE3 TRP 78 -0.493 7.626 1.755
651 HZ2 TRP 78 HZ2 TRP 78 -4.687 7.717 4.451
652 HZ3 TRP 78 HZ3 TRP 78 -1.351 9.725 2.709
653 HH2 TRP 78 HH2 TRP 78 -3.406 9.766 4.029
654 H LEU 79 H LEU 79 1.770 3.675 -0.003
655 HA LEU 79 HA LEU 79 2.241 1.093 0.945
656 HB2 LEU 79 HB2 LEU 79 3.839 2.734 -1.025
657 HB3 LEU 79 HB3 LEU 79 4.070 1.018 -0.760
658 HG LEU 79 HG LEU 79 1.505 2.255 -1.756
659 HD11 LEU 79 HD11 LEU 79 3.289 2.546 -3.385
660 HD12 LEU 79 HD12 LEU 79 2.133 1.331 -3.933
661 HD13 LEU 79 HD13 LEU 79 3.690 0.831 -3.271
662 HD21 LEU 79 HD21 LEU 79 2.416 -0.616 -1.591
663 HD22 LEU 79 HD22 LEU 79 0.905 -0.050 -2.304
664 HD23 LEU 79 HD23 LEU 79 1.190 0.143 -0.575
665 H LYS 80 H LYS 80 4.304 3.974 1.070
666 HA LYS 80 HA LYS 80 6.568 2.836 2.170
667 HB2 LYS 80 HB2 LYS 80 6.110 5.181 1.164
668 HB3 LYS 80 HB3 LYS 80 5.624 5.622 2.793
669 HG2 LYS 80 HG2 LYS 80 8.306 4.445 2.140
670 HG3 LYS 80 HG3 LYS 80 7.978 6.178 2.154
671 HD2 LYS 80 HD2 LYS 80 7.558 4.325 4.491
672 HD3 LYS 80 HD3 LYS 80 8.968 5.339 4.243
673 HE2 LYS 80 HE2 LYS 80 7.435 7.319 4.187
674 HE3 LYS 80 HE3 LYS 80 6.135 6.233 4.669
675 HZ1 LYS 80 HZ1 LYS 80 7.033 7.343 6.588
676 HZ2 LYS 80 HZ2 LYS 80 8.602 6.814 6.219
677 HZ3 LYS 80 HZ3 LYS 80 7.419 5.694 6.677
678 H ARG 81 H ARG 81 3.830 4.448 3.801
679 HA ARG 81 HA ARG 81 4.931 3.983 6.397
680 HB2 ARG 81 HB2 ARG 81 2.795 4.871 7.244
681 HB3 ARG 81 HB3 ARG 81 3.530 5.914 6.039
682 HG2 ARG 81 HG2 ARG 81 1.976 4.793 4.360
683 HG3 ARG 81 HG3 ARG 81 1.120 4.154 5.766
684 HD2 ARG 81 HD2 ARG 81 0.086 6.215 4.985
685 HD3 ARG 81 HD3 ARG 81 0.781 6.432 6.590
686 HE ARG 81 HE ARG 81 2.612 7.187 4.541
687 HH11 ARG 81 HH11 ARG 81 -0.224 8.304 6.260
688 HH12 ARG 81 HH12 ARG 81 0.162 9.988 6.062
689 HH21 ARG 81 HH21 ARG 81 3.130 9.398 4.302
690 HH22 ARG 81 HH22 ARG 81 2.068 10.602 4.980
691 H MET 82 H MET 82 2.716 2.241 4.335
692 HA MET 82 HA MET 82 1.652 0.509 6.303
693 HB2 MET 82 HB2 MET 82 0.678 0.772 4.043
694 HB3 MET 82 HB3 MET 82 2.088 -0.020 3.354
695 HG2 MET 82 HG2 MET 82 1.535 -2.066 4.584
696 HG3 MET 82 HG3 MET 82 0.117 -1.267 5.257
697 HE1 MET 82 HE1 MET 82 1.821 -2.665 2.009
698 HE2 MET 82 HE2 MET 82 1.574 -0.962 1.626
699 HE3 MET 82 HE3 MET 82 0.656 -2.201 0.769
700 H PHE 83 H PHE 83 4.357 0.086 4.010
701 HA PHE 83 HA PHE 83 5.177 -2.391 5.153
702 HB2 PHE 83 HB2 PHE 83 6.594 -0.461 3.314
703 HB3 PHE 83 HB3 PHE 83 7.304 -1.982 3.842
704 HD1 PHE 83 HD1 PHE 83 5.613 -4.059 3.528
705 HD2 PHE 83 HD2 PHE 83 5.591 -0.461 1.255
706 HE1 PHE 83 HE1 PHE 83 4.482 -5.235 1.685
707 HE2 PHE 83 HE2 PHE 83 4.456 -1.629 -0.591
708 HZ PHE 83 HZ PHE 83 3.902 -4.019 -0.376
709 H ASN 84 H ASN 84 5.847 0.938 5.830
710 HA ASN 84 HA ASN 84 8.240 0.728 7.266
711 HB2 ASN 84 HB2 ASN 84 6.876 2.821 6.516
712 HB3 ASN 84 HB3 ASN 84 6.056 2.637 8.060
713 HD21 ASN 84 HD21 ASN 84 8.426 1.709 9.476
714 HD22 ASN 84 HD22 ASN 84 9.437 3.097 9.668
715 H TYR 85 H TYR 85 4.883 0.329 8.277
716 HA TYR 85 HA TYR 85 5.405 0.009 11.050
717 HB2 TYR 85 HB2 TYR 85 3.193 0.589 9.949
718 HB3 TYR 85 HB3 TYR 85 3.062 -1.102 9.502
719 HD1 TYR 85 HD1 TYR 85 4.538 -0.277 12.735
720 HD2 TYR 85 HD2 TYR 85 0.929 -1.219 10.686
721 HE1 TYR 85 HE1 TYR 85 3.443 -0.748 14.886
722 HE2 TYR 85 HE2 TYR 85 -0.171 -1.696 12.829
723 HH TYR 85 HH TYR 85 0.496 -2.392 15.113
724 H ALA 86 H ALA 86 5.318 -2.193 8.316
725 HA ALA 86 HA ALA 86 5.536 -4.593 9.848
726 HB1 ALA 86 HB1 ALA 86 6.259 -4.094 6.963
727 HB2 ALA 86 HB2 ALA 86 4.681 -4.609 7.557
728 HB3 ALA 86 HB3 ALA 86 6.078 -5.671 7.728
729 H ILE 87 H ILE 87 7.860 -2.447 8.255
730 HA ILE 87 HA ILE 87 10.217 -3.865 8.898
731 HB ILE 87 HB ILE 87 9.843 -0.865 8.658
732 HG12 ILE 87 HG12 ILE 87 10.754 -2.842 6.560
733 HG13 ILE 87 HG13 ILE 87 9.132 -2.173 6.658
734 HG21 ILE 87 HG21 ILE 87 12.251 -0.824 8.134
735 HG22 ILE 87 HG22 ILE 87 12.342 -2.548 8.497
736 HG23 ILE 87 HG23 ILE 87 11.925 -1.399 9.769
737 HD11 ILE 87 HD11 ILE 87 10.063 0.075 6.339
738 HD12 ILE 87 HD12 ILE 87 10.415 -1.006 4.990
739 HD13 ILE 87 HD13 ILE 87 11.669 -0.634 6.174
740 H LYS 88 H LYS 88 8.386 -1.392 10.566
741 HA LYS 88 HA LYS 88 10.020 -0.974 12.776
742 HB2 LYS 88 HB2 LYS 88 8.253 0.537 12.209
743 HB3 LYS 88 HB3 LYS 88 7.042 -0.720 12.371
744 HG2 LYS 88 HG2 LYS 88 8.658 0.030 14.752
745 HG3 LYS 88 HG3 LYS 88 7.362 1.101 14.214
746 HD2 LYS 88 HD2 LYS 88 5.892 -0.994 14.198
747 HD3 LYS 88 HD3 LYS 88 7.180 -1.748 15.140
748 HE2 LYS 88 HE2 LYS 88 5.707 0.766 15.868
749 HE3 LYS 88 HE3 LYS 88 5.407 -0.828 16.551
750 HZ1 LYS 88 HZ1 LYS 88 7.728 -0.822 17.369
751 HZ2 LYS 88 HZ2 LYS 88 6.795 0.428 18.037
752 HZ3 LYS 88 HZ3 LYS 88 7.903 0.768 16.804
753 H ARG 89 H ARG 89 7.307 -3.271 12.394
754 HA ARG 89 HA ARG 89 7.787 -4.398 15.003
755 HB2 ARG 89 HB2 ARG 89 5.958 -5.843 14.599
756 HB3 ARG 89 HB3 ARG 89 5.521 -4.307 13.871
757 HG2 ARG 89 HG2 ARG 89 6.018 -5.153 11.677
758 HG3 ARG 89 HG3 ARG 89 6.631 -6.662 12.362
759 HD2 ARG 89 HD2 ARG 89 4.448 -7.154 11.645
760 HD3 ARG 89 HD3 ARG 89 4.327 -6.951 13.390
761 HE ARG 89 HE ARG 89 3.580 -4.837 11.480
762 HH11 ARG 89 HH11 ARG 89 2.975 -6.663 14.429
763 HH12 ARG 89 HH12 ARG 89 1.473 -5.840 14.749
764 HH21 ARG 89 HH21 ARG 89 1.600 -3.795 11.932
765 HH22 ARG 89 HH22 ARG 89 0.709 -4.218 13.367
766 H HIS 90 H HIS 90 9.568 -4.532 12.359
767 HA HIS 90 HA HIS 90 11.410 -5.720 11.827
768 HB2 HIS 90 HB2 HIS 90 11.292 -5.972 14.488
769 HB3 HIS 90 HB3 HIS 90 11.095 -7.664 14.050
770 HD1 HIS 90 HD1 HIS 90 13.618 -6.164 15.444
771 HD2 HIS 90 HD2 HIS 90 13.334 -7.598 11.545
772 HE1 HIS 90 HE1 HIS 90 15.989 -6.537 14.674
773 HE2 HIS 90 HE2 HIS 90 15.786 -7.551 12.377
774 H ILE 91 H ILE 91 9.331 -6.396 10.318
775 HA ILE 91 HA ILE 91 9.577 -9.323 10.076
776 HB ILE 91 HB ILE 91 7.640 -7.444 8.707
777 HG12 ILE 91 HG12 ILE 91 7.238 -9.604 10.790
778 HG13 ILE 91 HG13 ILE 91 7.079 -7.871 11.045
779 HG21 ILE 91 HG21 ILE 91 8.270 -9.229 7.194
780 HG22 ILE 91 HG22 ILE 91 6.621 -9.478 7.767
781 HG23 ILE 91 HG23 ILE 91 7.942 -10.433 8.441
782 HD11 ILE 91 HD11 ILE 91 5.336 -9.554 9.258
783 HD12 ILE 91 HD12 ILE 91 5.170 -7.820 9.530
784 HD13 ILE 91 HD13 ILE 91 4.909 -8.948 10.859
785 H ILE 92 H ILE 92 9.657 -6.364 8.129
786 HA ILE 92 HA ILE 92 11.718 -7.624 6.450
787 HB ILE 92 HB ILE 92 11.131 -5.825 4.762
788 HG12 ILE 92 HG12 ILE 92 8.633 -5.618 6.463
789 HG13 ILE 92 HG13 ILE 92 9.871 -4.374 6.328
790 HG21 ILE 92 HG21 ILE 92 10.509 -8.139 4.451
791 HG22 ILE 92 HG22 ILE 92 9.218 -7.085 3.877
792 HG23 ILE 92 HG23 ILE 92 9.060 -7.907 5.429
793 HD11 ILE 92 HD11 ILE 92 8.146 -5.387 4.080
794 HD12 ILE 92 HD12 ILE 92 9.365 -4.119 3.963
795 HD13 ILE 92 HD13 ILE 92 7.927 -3.871 4.954
796 H GLU 93 H GLU 93 13.396 -6.123 5.655
797 HA GLU 93 HA GLU 93 14.112 -4.290 7.828
798 HB2 GLU 93 HB2 GLU 93 15.839 -5.595 5.718
799 HB3 GLU 93 HB3 GLU 93 16.423 -4.513 6.975
800 HG2 GLU 93 HG2 GLU 93 15.699 -6.096 8.682
801 HG3 GLU 93 HG3 GLU 93 15.102 -7.179 7.424
802 H TYR 94 H TYR 94 12.862 -4.161 4.752
803 HA TYR 94 HA TYR 94 13.329 -1.352 4.515
804 HB2 TYR 94 HB2 TYR 94 14.532 -1.367 2.396
805 HB3 TYR 94 HB3 TYR 94 15.469 -2.231 3.609
806 HD1 TYR 94 HD1 TYR 94 15.473 -4.756 3.568
807 HD2 TYR 94 HD2 TYR 94 13.859 -2.423 0.401
808 HE1 TYR 94 HE1 TYR 94 15.610 -6.704 2.074
809 HE2 TYR 94 HE2 TYR 94 13.985 -4.364 -1.101
810 HH TYR 94 HH TYR 94 15.283 -6.483 -1.277
811 H ASN 95 H ASN 95 12.262 -0.468 2.545
812 HA ASN 95 HA ASN 95 10.083 -2.231 1.649
813 HB2 ASN 95 HB2 ASN 95 8.740 -0.214 1.280
814 HB3 ASN 95 HB3 ASN 95 9.289 -0.292 2.950
815 HD21 ASN 95 HD21 ASN 95 8.432 1.984 1.275
816 HD22 ASN 95 HD22 ASN 95 9.738 3.124 1.329
817 HA PRO 96 HA PRO 96 11.761 -2.051 -2.414
818 HB2 PRO 96 HB2 PRO 96 9.007 -2.177 -3.446
819 HB3 PRO 96 HB3 PRO 96 10.332 -3.331 -3.630
820 HG2 PRO 96 HG2 PRO 96 8.222 -3.855 -2.061
821 HG3 PRO 96 HG3 PRO 96 9.856 -4.397 -1.638
822 HD2 PRO 96 HD2 PRO 96 8.295 -2.068 -0.581
823 HD3 PRO 96 HD3 PRO 96 9.327 -3.221 0.292
824 H ALA 97 H ALA 97 9.389 0.197 -1.342
825 HA ALA 97 HA ALA 97 9.249 1.780 -3.712
826 HB1 ALA 97 HB1 ALA 97 7.437 1.779 -2.082
827 HB2 ALA 97 HB2 ALA 97 8.079 3.406 -2.306
828 HB3 ALA 97 HB3 ALA 97 8.511 2.477 -0.871
829 H ALA 98 H ALA 98 11.618 1.403 -1.334
830 HA ALA 98 HA ALA 98 12.600 4.086 -1.248
831 HB1 ALA 98 HB1 ALA 98 14.518 3.142 -0.086
832 HB2 ALA 98 HB2 ALA 98 13.997 1.513 -0.517
833 HB3 ALA 98 HB3 ALA 98 13.012 2.496 0.567
834 H ALA 99 H ALA 99 12.635 1.792 -3.659
835 HA ALA 99 HA ALA 99 15.231 2.488 -4.758
836 HB1 ALA 99 HB1 ALA 99 14.632 0.958 -6.575
837 HB2 ALA 99 HB2 ALA 99 13.020 0.773 -5.885
838 HB3 ALA 99 HB3 ALA 99 14.431 0.202 -4.994
839 H PHE 100 H PHE 100 12.407 4.061 -4.562
840 HA PHE 100 HA PHE 100 12.743 5.328 -7.193
841 HB2 PHE 100 HB2 PHE 100 10.163 4.937 -5.660
842 HB3 PHE 100 HB3 PHE 100 10.324 5.808 -7.182
843 HD1 PHE 100 HD1 PHE 100 11.091 4.533 -9.221
844 HD2 PHE 100 HD2 PHE 100 9.871 2.623 -5.622
845 HE1 PHE 100 HE1 PHE 100 10.743 2.436 -10.458
846 HE2 PHE 100 HE2 PHE 100 9.518 0.523 -6.851
847 HZ PHE 100 HZ PHE 100 9.955 0.426 -9.276
848 H ASP 101 H ASP 101 13.481 7.295 -7.024
849 HA ASP 101 HA ASP 101 13.185 8.819 -4.563
850 HB2 ASP 101 HB2 ASP 101 15.378 8.788 -5.603
851 HB3 ASP 101 HB3 ASP 101 14.704 9.360 -7.124
852 HA PRO 102 HA PRO 102 9.698 10.786 -6.588
853 HB2 PRO 102 HB2 PRO 102 8.393 11.513 -4.387
854 HB3 PRO 102 HB3 PRO 102 8.521 9.809 -4.843
855 HG2 PRO 102 HG2 PRO 102 10.021 11.332 -2.760
856 HG3 PRO 102 HG3 PRO 102 9.418 9.666 -2.714
857 HD2 PRO 102 HD2 PRO 102 12.043 10.446 -3.316
858 HD3 PRO 102 HD3 PRO 102 11.327 8.856 -3.642
859 H GLY 103 H GLY 103 8.512 12.977 -6.050
860 HA2 GLY 103 HA2 GLY 103 10.546 15.021 -5.413
861 HA3 GLY 103 HA3 GLY 103 9.525 15.165 -6.836
862 H ASP 104 H ASP 104 7.960 16.574 -6.577
863 HA ASP 104 HA ASP 104 6.409 16.590 -4.109
864 HB2 ASP 104 HB2 ASP 104 8.035 18.241 -3.538
865 HB3 ASP 104 HB3 ASP 104 7.963 18.966 -5.139
866 H ALA 105 H ALA 105 4.296 17.173 -4.429
867 HA ALA 105 HA ALA 105 3.376 17.130 -7.140
868 HB1 ALA 105 HB1 ALA 105 1.139 17.201 -6.181
869 HB2 ALA 105 HB2 ALA 105 1.817 17.566 -4.594
870 HB3 ALA 105 HB3 ALA 105 2.139 16.006 -5.354
871 H GLY 106 H GLY 106 3.595 18.883 -8.369
872 HA2 GLY 106 HA2 GLY 106 3.093 21.514 -7.156
873 HA3 GLY 106 HA3 GLY 106 4.030 21.235 -8.617
874 H GLY 107 H GLY 107 2.386 23.090 -9.099
875 HA2 GLY 107 HA2 GLY 107 0.824 23.584 -10.764
876 HA3 GLY 107 HA3 GLY 107 0.390 21.880 -10.832
877 H LYS 108 H LYS 108 0.453 24.088 -8.080
878 HA LYS 108 HA LYS 108 -2.186 23.235 -7.287
879 HB2 LYS 108 HB2 LYS 108 -1.849 24.760 -5.369
880 HB3 LYS 108 HB3 LYS 108 -0.523 23.624 -5.561
881 HG2 LYS 108 HG2 LYS 108 0.866 25.331 -6.533
882 HG3 LYS 108 HG3 LYS 108 -0.476 26.477 -6.525
883 HD2 LYS 108 HD2 LYS 108 -0.533 26.415 -4.090
884 HD3 LYS 108 HD3 LYS 108 0.765 25.222 -4.079
885 HE2 LYS 108 HE2 LYS 108 2.285 26.826 -5.085
886 HE3 LYS 108 HE3 LYS 108 0.989 28.017 -5.186
887 HZ1 LYS 108 HZ1 LYS 108 0.899 28.187 -2.837
888 HZ2 LYS 108 HZ2 LYS 108 2.540 28.283 -3.257
889 HZ3 LYS 108 HZ3 LYS 108 1.911 26.843 -2.624
890 H LEU 109 H LEU 109 -0.689 25.990 -8.795
891 HA LEU 109 HA LEU 109 -1.438 27.963 -9.611
892 HB2 LEU 109 HB2 LEU 109 -2.813 26.488 -11.028
893 HB3 LEU 109 HB3 LEU 109 -4.085 26.521 -9.820
894 HG LEU 109 HG LEU 109 -4.279 28.985 -10.161
895 HD11 LEU 109 HD11 LEU 109 -2.061 29.450 -11.006
896 HD12 LEU 109 HD12 LEU 109 -3.273 29.954 -12.186
897 HD13 LEU 109 HD13 LEU 109 -2.369 28.459 -12.432
898 HD21 LEU 109 HD21 LEU 109 -5.434 28.831 -12.311
899 HD22 LEU 109 HD22 LEU 109 -5.801 27.454 -11.275
900 HD23 LEU 109 HD23 LEU 109 -4.665 27.273 -12.611
901 H GLU 110 H GLU 110 -1.084 29.023 -7.667
902 HA GLU 110 HA GLU 110 -3.267 29.205 -5.746
903 HB2 GLU 110 HB2 GLU 110 -0.821 28.867 -5.142
904 HB3 GLU 110 HB3 GLU 110 -0.562 30.533 -5.627
905 HG2 GLU 110 HG2 GLU 110 -2.064 31.308 -3.907
906 HG3 GLU 110 HG3 GLU 110 -2.448 29.646 -3.459
907 H HIS 111 H HIS 111 -2.563 30.662 -8.547
908 HA HIS 111 HA HIS 111 -2.968 33.419 -7.859
909 HB2 HIS 111 HB2 HIS 111 -2.989 31.988 -10.523
910 HB3 HIS 111 HB3 HIS 111 -3.183 33.727 -10.345
911 HD1 HIS 111 HD1 HIS 111 -1.088 35.041 -10.487
912 HD2 HIS 111 HD2 HIS 111 -0.369 31.080 -9.437
913 HE1 HIS 111 HE1 HIS 111 1.415 34.793 -10.427
914 HE2 HIS 111 HE2 HIS 111 1.823 32.431 -9.644
915 H HIS 112 H HIS 112 -4.896 33.638 -6.822
916 HA HIS 112 HA HIS 112 -7.221 33.600 -8.564
917 HB2 HIS 112 HB2 HIS 112 -7.087 31.361 -7.308
918 HB3 HIS 112 HB3 HIS 112 -7.466 32.288 -5.861
919 HD1 HIS 112 HD1 HIS 112 -9.881 32.209 -5.322
920 HD2 HIS 112 HD2 HIS 112 -9.208 32.007 -9.421
921 HE1 HIS 112 HE1 HIS 112 -12.154 31.995 -6.379
922 HE2 HIS 112 HE2 HIS 112 -11.697 31.644 -8.828
923 H HIS 113 H HIS 113 -5.323 35.194 -6.502
924 HA HIS 113 HA HIS 113 -7.505 37.014 -5.742
925 HB2 HIS 113 HB2 HIS 113 -5.198 36.150 -3.986
926 HB3 HIS 113 HB3 HIS 113 -6.195 37.558 -3.653
927 HD1 HIS 113 HD1 HIS 113 -5.824 34.464 -2.305
928 HD2 HIS 113 HD2 HIS 113 -9.158 36.370 -3.905
929 HE1 HIS 113 HE1 HIS 113 -7.816 33.332 -1.267
930 HE2 HIS 113 HE2 HIS 113 -9.818 34.599 -2.132
931 H HIS 114 H HIS 114 -6.742 39.229 -5.365
932 HA HIS 114 HA HIS 114 -4.177 39.849 -6.687
933 HB2 HIS 114 HB2 HIS 114 -6.772 41.396 -6.968
934 HB3 HIS 114 HB3 HIS 114 -5.220 41.886 -7.632
935 HD1 HIS 114 HD1 HIS 114 -8.195 39.857 -8.355
936 HD2 HIS 114 HD2 HIS 114 -4.300 40.179 -9.784
937 HE1 HIS 114 HE1 HIS 114 -8.189 38.699 -10.591
938 HE2 HIS 114 HE2 HIS 114 -5.877 39.086 -11.520
939 H HIS 115 H HIS 115 -3.072 41.693 -5.810
940 HA HIS 115 HA HIS 115 -3.979 42.338 -3.121
941 HB2 HIS 115 HB2 HIS 115 -1.783 43.618 -2.966
942 HB3 HIS 115 HB3 HIS 115 -1.687 41.871 -3.086
943 HD1 HIS 115 HD1 HIS 115 -0.204 40.952 -4.854
944 HD2 HIS 115 HD2 HIS 115 -1.087 44.971 -5.478
945 HE1 HIS 115 HE1 HIS 115 1.308 41.698 -6.721
946 HE2 HIS 115 HE2 HIS 115 0.653 44.091 -7.183
947 H HIS 116 H HIS 116 -5.794 43.503 -3.637
948 HA HIS 116 HA HIS 116 -5.372 46.080 -4.982
949 HB2 HIS 116 HB2 HIS 116 -7.167 44.549 -5.826
950 HB3 HIS 116 HB3 HIS 116 -7.981 44.719 -4.276
951 HD1 HIS 116 HD1 HIS 116 -9.494 46.710 -3.988
952 HD2 HIS 116 HD2 HIS 116 -7.071 46.990 -7.360
953 HE1 HIS 116 HE1 HIS 116 -10.329 48.710 -5.264
954 HE2 HIS 116 HE2 HIS 116 -9.010 48.702 -7.411
Start of MODEL 14
1 H1 MET 1 H1 MET 1 -3.627 -7.734 12.134
2 H2 MET 1 H2 MET 1 -2.895 -6.982 13.466
3 H3 MET 1 H3 MET 1 -4.574 -7.239 13.445
4 HA MET 1 HA MET 1 -3.420 -8.810 14.879
5 HB2 MET 1 HB2 MET 1 -5.533 -9.479 13.876
6 HB3 MET 1 HB3 MET 1 -4.710 -9.987 12.407
7 HG2 MET 1 HG2 MET 1 -3.513 -11.706 13.708
8 HG3 MET 1 HG3 MET 1 -4.419 -11.221 15.138
9 HE1 MET 1 HE1 MET 1 -5.928 -14.729 14.186
10 HE2 MET 1 HE2 MET 1 -5.134 -13.784 15.446
11 HE3 MET 1 HE3 MET 1 -4.253 -14.215 13.980
12 H ALA 2 H ALA 2 -1.568 -9.795 15.259
13 HA ALA 2 HA ALA 2 0.251 -10.438 13.093
14 HB1 ALA 2 HB1 ALA 2 1.831 -11.021 14.852
15 HB2 ALA 2 HB2 ALA 2 0.564 -10.857 16.067
16 HB3 ALA 2 HB3 ALA 2 1.112 -9.441 15.170
17 H GLU 3 H GLU 3 0.903 -12.497 12.530
18 HA GLU 3 HA GLU 3 -1.062 -14.571 12.950
19 HB2 GLU 3 HB2 GLU 3 0.401 -13.883 10.819
20 HB3 GLU 3 HB3 GLU 3 1.509 -15.056 11.507
21 HG2 GLU 3 HG2 GLU 3 -1.365 -15.686 10.923
22 HG3 GLU 3 HG3 GLU 3 -0.080 -15.888 9.735
23 H LYS 4 H LYS 4 2.421 -15.013 12.869
24 HA LYS 4 HA LYS 4 2.951 -15.337 15.586
25 HB2 LYS 4 HB2 LYS 4 3.325 -17.789 15.716
26 HB3 LYS 4 HB3 LYS 4 1.625 -17.389 15.529
27 HG2 LYS 4 HG2 LYS 4 1.736 -17.958 13.168
28 HG3 LYS 4 HG3 LYS 4 3.455 -18.324 13.330
29 HD2 LYS 4 HD2 LYS 4 2.970 -20.132 14.850
30 HD3 LYS 4 HD3 LYS 4 1.252 -19.723 14.843
31 HE2 LYS 4 HE2 LYS 4 2.841 -20.607 12.433
32 HE3 LYS 4 HE3 LYS 4 1.791 -21.650 13.392
33 HZ1 LYS 4 HZ1 LYS 4 0.725 -20.787 11.361
34 HZ2 LYS 4 HZ2 LYS 4 0.880 -19.206 11.962
35 HZ3 LYS 4 HZ3 LYS 4 -0.096 -20.332 12.773
36 H ASN 5 H ASN 5 3.630 -16.571 12.375
37 HA ASN 5 HA ASN 5 6.416 -15.711 12.592
38 HB2 ASN 5 HB2 ASN 5 5.896 -17.880 11.453
39 HB3 ASN 5 HB3 ASN 5 4.906 -17.015 10.289
40 HD21 ASN 5 HD21 ASN 5 5.869 -15.948 8.617
41 HD22 ASN 5 HD22 ASN 5 7.565 -16.032 8.283
42 H ALA 6 H ALA 6 7.092 -14.309 10.566
43 HA ALA 6 HA ALA 6 5.852 -11.873 10.515
44 HB1 ALA 6 HB1 ALA 6 8.026 -12.305 9.474
45 HB2 ALA 6 HB2 ALA 6 6.940 -11.452 8.377
46 HB3 ALA 6 HB3 ALA 6 7.223 -13.180 8.168
47 H TYR 7 H TYR 7 3.944 -11.166 9.880
48 HA TYR 7 HA TYR 7 2.123 -12.991 8.606
49 HB2 TYR 7 HB2 TYR 7 0.505 -11.003 8.985
50 HB3 TYR 7 HB3 TYR 7 1.113 -11.883 10.382
51 HD1 TYR 7 HD2 TYR 7 1.413 -8.740 8.455
52 HD2 TYR 7 HD1 TYR 7 2.484 -10.820 12.007
53 HE1 TYR 7 HE2 TYR 7 2.236 -6.637 9.432
54 HE2 TYR 7 HE1 TYR 7 3.307 -8.726 12.997
55 HH TYR 7 HH TYR 7 2.638 -5.683 11.675
56 H THR 8 H THR 8 0.518 -11.978 6.997
57 HA THR 8 HA THR 8 2.116 -11.208 4.714
58 HB THR 8 HB THR 8 -0.076 -11.478 3.484
59 HG1 THR 8 HG1 THR 8 -1.712 -12.607 4.727
60 HG21 THR 8 HG21 THR 8 0.874 -13.821 5.136
61 HG22 THR 8 HG22 THR 8 1.581 -13.279 3.614
62 HG23 THR 8 HG23 THR 8 -0.062 -13.918 3.644
63 H VAL 9 H VAL 9 0.886 -9.674 3.116
64 HA VAL 9 HA VAL 9 1.009 -7.103 4.278
65 HB VAL 9 HB VAL 9 1.588 -7.569 1.924
66 HG11 VAL 9 HG11 VAL 9 -0.187 -7.769 0.239
67 HG12 VAL 9 HG12 VAL 9 -1.384 -7.874 1.530
68 HG13 VAL 9 HG13 VAL 9 -0.162 -9.134 1.354
69 HG21 VAL 9 HG21 VAL 9 -0.569 -5.492 2.308
70 HG22 VAL 9 HG22 VAL 9 0.556 -5.552 0.951
71 HG23 VAL 9 HG23 VAL 9 1.160 -5.280 2.585
72 H ALA 10 H ALA 10 -1.627 -9.325 3.792
73 HA ALA 10 HA ALA 10 -3.764 -7.473 4.018
74 HB1 ALA 10 HB1 ALA 10 -3.712 -10.379 4.836
75 HB2 ALA 10 HB2 ALA 10 -4.080 -9.777 3.220
76 HB3 ALA 10 HB3 ALA 10 -5.150 -9.395 4.568
77 H GLN 11 H GLN 11 -2.159 -9.548 6.414
78 HA GLN 11 HA GLN 11 -3.549 -8.530 8.651
79 HB2 GLN 11 HB2 GLN 11 -1.077 -10.156 8.248
80 HB3 GLN 11 HB3 GLN 11 -1.384 -9.471 9.836
81 HG2 GLN 11 HG2 GLN 11 -2.166 -11.818 9.517
82 HG3 GLN 11 HG3 GLN 11 -3.397 -10.690 10.076
83 HE21 GLN 11 HE21 GLN 11 -5.117 -10.205 8.775
84 HE22 GLN 11 HE22 GLN 11 -5.474 -11.084 7.324
85 H LEU 12 H LEU 12 -0.565 -7.598 7.045
86 HA LEU 12 HA LEU 12 0.342 -5.719 8.927
87 HB2 LEU 12 HB2 LEU 12 1.720 -6.541 7.074
88 HB3 LEU 12 HB3 LEU 12 0.669 -5.737 5.923
89 HG LEU 12 HG LEU 12 1.335 -3.550 6.889
90 HD11 LEU 12 HD11 LEU 12 1.921 -4.305 9.129
91 HD12 LEU 12 HD12 LEU 12 3.264 -3.442 8.378
92 HD13 LEU 12 HD13 LEU 12 3.291 -5.203 8.476
93 HD21 LEU 12 HD21 LEU 12 3.609 -5.289 5.941
94 HD22 LEU 12 HD22 LEU 12 3.586 -3.526 5.931
95 HD23 LEU 12 HD23 LEU 12 2.461 -4.428 4.916
96 H ALA 13 H ALA 13 -1.765 -5.352 6.091
97 HA ALA 13 HA ALA 13 -2.195 -2.572 6.414
98 HB1 ALA 13 HB1 ALA 13 -3.957 -4.590 5.026
99 HB2 ALA 13 HB2 ALA 13 -2.585 -3.757 4.297
100 HB3 ALA 13 HB3 ALA 13 -4.000 -2.840 4.814
101 H ASP 14 H ASP 14 -3.907 -5.435 7.556
102 HA ASP 14 HA ASP 14 -6.133 -4.156 8.702
103 HB2 ASP 14 HB2 ASP 14 -6.146 -6.543 8.411
104 HB3 ASP 14 HB3 ASP 14 -4.716 -6.728 9.420
105 H GLU 15 H GLU 15 -3.005 -5.069 10.103
106 HA GLU 15 HA GLU 15 -3.408 -4.038 12.682
107 HB2 GLU 15 HB2 GLU 15 -1.513 -5.522 11.865
108 HB3 GLU 15 HB3 GLU 15 -0.785 -4.079 11.176
109 HG2 GLU 15 HG2 GLU 15 0.276 -4.481 13.251
110 HG3 GLU 15 HG3 GLU 15 -0.779 -3.086 13.469
111 H TYR 16 H TYR 16 -2.062 -2.578 9.757
112 HA TYR 16 HA TYR 16 -1.415 -0.070 10.830
113 HB2 TYR 16 HB2 TYR 16 -0.593 -0.910 8.667
114 HB3 TYR 16 HB3 TYR 16 -2.216 -0.795 8.003
115 HD1 TYR 16 HD1 TYR 16 0.528 1.238 9.455
116 HD2 TYR 16 HD2 TYR 16 -2.944 1.193 7.003
117 HE1 TYR 16 HE1 TYR 16 1.008 3.539 8.744
118 HE2 TYR 16 HE2 TYR 16 -2.475 3.495 6.287
119 HH TYR 16 HH TYR 16 -1.256 5.458 7.096
120 H PHE 17 H PHE 17 -4.379 -1.250 9.302
121 HA PHE 17 HA PHE 17 -5.715 1.202 9.112
122 HB2 PHE 17 HB2 PHE 17 -6.423 -0.789 7.896
123 HB3 PHE 17 HB3 PHE 17 -6.846 -1.587 9.406
124 HD1 PHE 17 HD2 PHE 17 -7.701 1.324 7.265
125 HD2 PHE 17 HD1 PHE 17 -8.984 -1.363 10.306
126 HE1 PHE 17 HE2 PHE 17 -9.982 2.224 7.092
127 HE2 PHE 17 HE1 PHE 17 -11.268 -0.467 10.136
128 HZ PHE 17 HZ PHE 17 -11.770 1.328 8.530
129 H GLU 18 H GLU 18 -5.949 -1.295 11.649
130 HA GLU 18 HA GLU 18 -7.879 0.193 13.133
131 HB2 GLU 18 HB2 GLU 18 -6.178 -2.204 13.808
132 HB3 GLU 18 HB3 GLU 18 -7.346 -1.516 14.930
133 HG2 GLU 18 HG2 GLU 18 -8.056 -2.480 12.173
134 HG3 GLU 18 HG3 GLU 18 -8.152 -3.483 13.619
135 H ARG 19 H ARG 19 -4.438 0.325 13.012
136 HA ARG 19 HA ARG 19 -4.267 1.416 15.700
137 HB2 ARG 19 HB2 ARG 19 -2.251 0.551 13.672
138 HB3 ARG 19 HB3 ARG 19 -1.758 1.646 14.955
139 HG2 ARG 19 HG2 ARG 19 -1.328 -0.745 15.453
140 HG3 ARG 19 HG3 ARG 19 -2.363 0.047 16.641
141 HD2 ARG 19 HD2 ARG 19 -4.333 -0.903 15.490
142 HD3 ARG 19 HD3 ARG 19 -3.251 -1.748 14.390
143 HE ARG 19 HE ARG 19 -2.466 -3.046 16.294
144 HH11 ARG 19 HH11 ARG 19 -5.419 -1.213 16.685
145 HH12 ARG 19 HH12 ARG 19 -6.084 -2.258 17.902
146 HH21 ARG 19 HH21 ARG 19 -3.316 -4.433 17.921
147 HH22 ARG 19 HH22 ARG 19 -4.873 -4.086 18.609
148 H MET 20 H MET 20 -4.541 2.630 12.481
149 HA MET 20 HA MET 20 -3.954 5.317 13.554
150 HB2 MET 20 HB2 MET 20 -3.598 4.265 10.755
151 HB3 MET 20 HB3 MET 20 -3.605 5.983 11.129
152 HG2 MET 20 HG2 MET 20 -1.727 5.542 12.730
153 HG3 MET 20 HG3 MET 20 -1.654 3.905 12.079
154 HE1 MET 20 HE1 MET 20 0.820 5.937 12.136
155 HE2 MET 20 HE2 MET 20 1.509 5.645 10.539
156 HE3 MET 20 HE3 MET 20 0.919 4.293 11.506
157 H ILE 21 H ILE 21 -6.245 3.350 11.801
158 HA ILE 21 HA ILE 21 -8.017 5.665 11.508
159 HB ILE 21 HB ILE 21 -8.308 2.859 10.392
160 HG12 ILE 21 HG12 ILE 21 -8.140 4.193 8.191
161 HG13 ILE 21 HG13 ILE 21 -7.493 5.496 9.176
162 HG21 ILE 21 HG21 ILE 21 -10.206 3.735 9.120
163 HG22 ILE 21 HG22 ILE 21 -10.061 5.275 9.968
164 HG23 ILE 21 HG23 ILE 21 -10.494 3.816 10.858
165 HD11 ILE 21 HD11 ILE 21 -5.656 4.040 9.875
166 HD12 ILE 21 HD12 ILE 21 -5.718 4.240 8.123
167 HD13 ILE 21 HD13 ILE 21 -6.304 2.749 8.863
168 H ALA 22 H ALA 22 -7.706 5.311 14.004
169 HA ALA 22 HA ALA 22 -10.270 4.191 14.877
170 HB1 ALA 22 HB1 ALA 22 -9.277 3.427 16.956
171 HB2 ALA 22 HB2 ALA 22 -7.698 4.025 16.447
172 HB3 ALA 22 HB3 ALA 22 -8.453 2.683 15.585
173 H GLY 23 H GLY 23 -8.519 6.886 14.417
174 HA2 GLY 23 HA2 GLY 23 -9.439 8.226 16.876
175 HA3 GLY 23 HA3 GLY 23 -8.120 8.788 15.861
176 H ARG 24 H ARG 24 -8.553 10.320 14.383
177 HA ARG 24 HA ARG 24 -11.385 10.796 13.726
178 HB2 ARG 24 HB2 ARG 24 -10.116 12.600 15.025
179 HB3 ARG 24 HB3 ARG 24 -9.188 12.859 13.557
180 HG2 ARG 24 HG2 ARG 24 -12.184 13.016 13.556
181 HG3 ARG 24 HG3 ARG 24 -11.190 14.392 14.029
182 HD2 ARG 24 HD2 ARG 24 -10.164 14.482 11.872
183 HD3 ARG 24 HD3 ARG 24 -10.894 12.948 11.400
184 HE ARG 24 HE ARG 24 -12.861 14.903 12.082
185 HH11 ARG 24 HH11 ARG 24 -10.641 14.008 9.516
186 HH12 ARG 24 HH12 ARG 24 -11.688 14.577 8.247
187 HH21 ARG 24 HH21 ARG 24 -14.233 15.633 10.424
188 HH22 ARG 24 HH22 ARG 24 -13.739 15.481 8.764
189 H TRP 25 H TRP 25 -11.323 9.326 12.008
190 HA TRP 25 HA TRP 25 -9.716 10.198 9.717
191 HB2 TRP 25 HB2 TRP 25 -10.098 8.030 8.727
192 HB3 TRP 25 HB3 TRP 25 -9.532 7.792 10.371
193 HD1 TRP 25 HD1 TRP 25 -12.246 6.847 8.047
194 HE1 TRP 25 HE1 TRP 25 -14.049 5.470 9.259
195 HE3 TRP 25 HE3 TRP 25 -10.772 7.649 12.875
196 HZ2 TRP 25 HZ2 TRP 25 -14.749 4.800 11.909
197 HZ3 TRP 25 HZ3 TRP 25 -12.058 6.595 14.688
198 HH2 TRP 25 HH2 TRP 25 -14.004 5.202 14.215
199 H LYS 26 H LYS 26 -12.982 9.268 10.657
200 HA LYS 26 HA LYS 26 -15.038 9.933 10.032
201 HB2 LYS 26 HB2 LYS 26 -13.642 12.221 10.084
202 HB3 LYS 26 HB3 LYS 26 -14.095 12.203 8.386
203 HG2 LYS 26 HG2 LYS 26 -15.805 13.404 9.362
204 HG3 LYS 26 HG3 LYS 26 -16.485 11.781 9.253
205 HD2 LYS 26 HD2 LYS 26 -15.175 12.930 11.721
206 HD3 LYS 26 HD3 LYS 26 -16.912 12.910 11.432
207 HE2 LYS 26 HE2 LYS 26 -16.864 10.462 11.337
208 HE3 LYS 26 HE3 LYS 26 -15.126 10.487 11.624
209 HZ1 LYS 26 HZ1 LYS 26 -16.310 10.030 13.657
210 HZ2 LYS 26 HZ2 LYS 26 -17.228 11.448 13.491
211 HZ3 LYS 26 HZ3 LYS 26 -15.557 11.548 13.774
212 H HIS 27 H HIS 27 -16.295 8.989 8.623
213 HA HIS 27 HA HIS 27 -17.056 7.945 6.767
214 HB2 HIS 27 HB2 HIS 27 -16.842 10.298 5.844
215 HB3 HIS 27 HB3 HIS 27 -15.309 9.794 5.142
216 HD1 HIS 27 HD1 HIS 27 -16.577 10.435 2.852
217 HD2 HIS 27 HD2 HIS 27 -17.969 7.059 4.853
218 HE1 HIS 27 HE1 HIS 27 -17.926 9.146 1.163
219 HE2 HIS 27 HE2 HIS 27 -18.844 7.164 2.417
220 HA PRO 28 HA PRO 28 -13.344 5.315 7.177
221 HB2 PRO 28 HB2 PRO 28 -15.424 3.252 6.668
222 HB3 PRO 28 HB3 PRO 28 -14.195 3.329 7.935
223 HG2 PRO 28 HG2 PRO 28 -16.752 3.848 8.481
224 HG3 PRO 28 HG3 PRO 28 -15.445 4.773 9.242
225 HD2 PRO 28 HD2 PRO 28 -17.263 5.554 7.006
226 HD3 PRO 28 HD3 PRO 28 -16.626 6.536 8.342
227 H ASN 29 H ASN 29 -15.853 4.989 4.671
228 HA ASN 29 HA ASN 29 -14.569 3.191 3.004
229 HB2 ASN 29 HB2 ASN 29 -16.901 3.821 2.738
230 HB3 ASN 29 HB3 ASN 29 -16.433 5.464 2.315
231 HD21 ASN 29 HD21 ASN 29 -17.399 5.430 0.361
232 HD22 ASN 29 HD22 ASN 29 -16.797 4.503 -0.962
233 H ILE 30 H ILE 30 -14.081 6.639 3.354
234 HA ILE 30 HA ILE 30 -12.676 7.215 1.027
235 HB ILE 30 HB ILE 30 -12.352 8.342 3.811
236 HG12 ILE 30 HG12 ILE 30 -14.539 8.721 2.798
237 HG13 ILE 30 HG13 ILE 30 -13.639 10.231 2.898
238 HG21 ILE 30 HG21 ILE 30 -11.203 9.396 1.226
239 HG22 ILE 30 HG22 ILE 30 -10.288 8.709 2.569
240 HG23 ILE 30 HG23 ILE 30 -11.166 10.224 2.783
241 HD11 ILE 30 HD11 ILE 30 -13.975 8.540 0.429
242 HD12 ILE 30 HD12 ILE 30 -13.083 10.059 0.529
243 HD13 ILE 30 HD13 ILE 30 -14.828 10.042 0.788
244 H VAL 31 H VAL 31 -11.328 6.177 4.183
245 HA VAL 31 HA VAL 31 -8.743 5.731 2.975
246 HB VAL 31 HB VAL 31 -8.935 6.552 5.303
247 HG11 VAL 31 HG11 VAL 31 -10.855 5.295 6.045
248 HG12 VAL 31 HG12 VAL 31 -9.476 4.993 7.101
249 HG13 VAL 31 HG13 VAL 31 -9.952 3.787 5.906
250 HG21 VAL 31 HG21 VAL 31 -7.197 5.105 6.256
251 HG22 VAL 31 HG22 VAL 31 -6.877 5.503 4.568
252 HG23 VAL 31 HG23 VAL 31 -7.509 3.912 4.995
253 H ARG 32 H ARG 32 -11.566 3.847 3.750
254 HA ARG 32 HA ARG 32 -10.451 1.271 3.748
255 HB2 ARG 32 HB2 ARG 32 -13.195 2.280 3.032
256 HB3 ARG 32 HB3 ARG 32 -12.786 0.574 2.925
257 HG2 ARG 32 HG2 ARG 32 -12.579 2.245 5.422
258 HG3 ARG 32 HG3 ARG 32 -13.919 1.167 5.023
259 HD2 ARG 32 HD2 ARG 32 -11.049 0.291 5.281
260 HD3 ARG 32 HD3 ARG 32 -12.234 0.184 6.576
261 HE ARG 32 HE ARG 32 -12.741 -1.174 4.018
262 HH11 ARG 32 HH11 ARG 32 -12.207 -1.275 7.471
263 HH12 ARG 32 HH12 ARG 32 -12.578 -2.964 7.628
264 HH21 ARG 32 HH21 ARG 32 -13.238 -3.407 4.192
265 HH22 ARG 32 HH22 ARG 32 -13.192 -4.177 5.757
266 H SER 33 H SER 33 -11.806 3.180 1.071
267 HA SER 33 HA SER 33 -11.606 1.333 -0.965
268 HB2 SER 33 HB2 SER 33 -12.684 3.494 -1.289
269 HB3 SER 33 HB3 SER 33 -11.149 4.331 -1.072
270 HG SER 33 HG SER 33 -10.593 3.865 -3.059
271 H ARG 34 H ARG 34 -9.108 3.503 0.271
272 HA ARG 34 HA ARG 34 -7.069 2.906 -1.519
273 HB2 ARG 34 HB2 ARG 34 -6.978 3.633 1.406
274 HB3 ARG 34 HB3 ARG 34 -5.548 3.538 0.389
275 HG2 ARG 34 HG2 ARG 34 -6.268 5.335 -0.956
276 HG3 ARG 34 HG3 ARG 34 -7.886 5.303 -0.252
277 HD2 ARG 34 HD2 ARG 34 -7.109 6.136 1.812
278 HD3 ARG 34 HD3 ARG 34 -5.426 5.839 1.381
279 HE ARG 34 HE ARG 34 -5.748 7.619 -0.354
280 HH11 ARG 34 HH11 ARG 34 -7.745 7.553 2.529
281 HH12 ARG 34 HH12 ARG 34 -7.978 9.276 2.562
282 HH21 ARG 34 HH21 ARG 34 -6.057 9.852 -0.323
283 HH22 ARG 34 HH22 ARG 34 -7.027 10.584 0.925
284 H ILE 35 H ILE 35 -7.812 1.356 1.599
285 HA ILE 35 HA ILE 35 -5.623 -0.460 1.360
286 HB ILE 35 HB ILE 35 -7.967 -0.475 3.260
287 HG12 ILE 35 HG12 ILE 35 -5.117 0.502 3.555
288 HG13 ILE 35 HG13 ILE 35 -6.553 1.513 3.451
289 HG21 ILE 35 HG21 ILE 35 -6.601 -1.987 4.632
290 HG22 ILE 35 HG22 ILE 35 -5.397 -2.052 3.345
291 HG23 ILE 35 HG23 ILE 35 -7.015 -2.702 3.074
292 HD11 ILE 35 HD11 ILE 35 -7.349 0.633 5.566
293 HD12 ILE 35 HD12 ILE 35 -5.732 1.319 5.739
294 HD13 ILE 35 HD13 ILE 35 -5.947 -0.431 5.665
295 H GLU 36 H GLU 36 -9.093 -0.690 0.741
296 HA GLU 36 HA GLU 36 -8.973 -3.560 0.429
297 HB2 GLU 36 HB2 GLU 36 -11.266 -1.712 -0.236
298 HB3 GLU 36 HB3 GLU 36 -11.346 -3.448 0.022
299 HG2 GLU 36 HG2 GLU 36 -10.551 -3.014 2.372
300 HG3 GLU 36 HG3 GLU 36 -10.802 -1.306 2.053
301 H LYS 37 H LYS 37 -8.746 -0.797 -1.655
302 HA LYS 37 HA LYS 37 -9.060 -2.551 -3.993
303 HB2 LYS 37 HB2 LYS 37 -10.692 -0.861 -4.101
304 HB3 LYS 37 HB3 LYS 37 -9.556 0.389 -3.622
305 HG2 LYS 37 HG2 LYS 37 -8.920 -1.007 -6.133
306 HG3 LYS 37 HG3 LYS 37 -10.381 -0.014 -6.147
307 HD2 LYS 37 HD2 LYS 37 -9.101 1.892 -5.324
308 HD3 LYS 37 HD3 LYS 37 -7.643 0.904 -5.281
309 HE2 LYS 37 HE2 LYS 37 -7.727 0.630 -7.685
310 HE3 LYS 37 HE3 LYS 37 -9.240 1.532 -7.754
311 HZ1 LYS 37 HZ1 LYS 37 -8.061 3.468 -6.865
312 HZ2 LYS 37 HZ2 LYS 37 -7.384 2.950 -8.325
313 HZ3 LYS 37 HZ3 LYS 37 -6.605 2.595 -6.859
314 H ASP 38 H ASP 38 -7.071 0.220 -2.871
315 HA ASP 38 HA ASP 38 -5.199 -0.183 -5.027
316 HB2 ASP 38 HB2 ASP 38 -5.175 1.685 -2.655
317 HB3 ASP 38 HB3 ASP 38 -3.878 1.622 -3.841
318 H ILE 39 H ILE 39 -5.068 -0.515 -1.491
319 HA ILE 39 HA ILE 39 -2.413 -1.559 -1.479
320 HB ILE 39 HB ILE 39 -4.499 -1.889 0.688
321 HG12 ILE 39 HG12 ILE 39 -4.258 0.485 0.083
322 HG13 ILE 39 HG13 ILE 39 -3.606 0.162 1.684
323 HG21 ILE 39 HG21 ILE 39 -1.483 -1.913 0.796
324 HG22 ILE 39 HG22 ILE 39 -2.547 -3.310 0.970
325 HG23 ILE 39 HG23 ILE 39 -2.562 -2.034 2.186
326 HD11 ILE 39 HD11 ILE 39 -1.347 0.158 0.752
327 HD12 ILE 39 HD12 ILE 39 -2.185 1.683 0.462
328 HD13 ILE 39 HD13 ILE 39 -2.014 0.509 -0.842
329 H LYS 40 H LYS 40 -5.602 -2.963 -1.716
330 HA LYS 40 HA LYS 40 -4.350 -5.609 -2.010
331 HB2 LYS 40 HB2 LYS 40 -6.461 -4.772 -0.268
332 HB3 LYS 40 HB3 LYS 40 -7.103 -5.926 -1.428
333 HG2 LYS 40 HG2 LYS 40 -6.302 -7.553 -0.168
334 HG3 LYS 40 HG3 LYS 40 -4.673 -7.003 -0.556
335 HD2 LYS 40 HD2 LYS 40 -6.339 -5.949 1.726
336 HD3 LYS 40 HD3 LYS 40 -5.106 -7.197 1.878
337 HE2 LYS 40 HE2 LYS 40 -4.656 -4.376 0.926
338 HE3 LYS 40 HE3 LYS 40 -4.242 -5.008 2.519
339 HZ1 LYS 40 HZ1 LYS 40 -2.317 -4.951 1.067
340 HZ2 LYS 40 HZ2 LYS 40 -3.097 -5.936 -0.064
341 HZ3 LYS 40 HZ3 LYS 40 -2.702 -6.549 1.462
342 HA PRO 41 HA PRO 41 -6.644 -4.910 -5.954
343 HB2 PRO 41 HB2 PRO 41 -4.212 -5.231 -7.428
344 HB3 PRO 41 HB3 PRO 41 -5.201 -3.779 -7.283
345 HG2 PRO 41 HG2 PRO 41 -2.650 -4.070 -6.253
346 HG3 PRO 41 HG3 PRO 41 -3.837 -2.873 -5.708
347 HD2 PRO 41 HD2 PRO 41 -3.080 -5.493 -4.485
348 HD3 PRO 41 HD3 PRO 41 -3.512 -3.959 -3.698
349 H ALA 42 H ALA 42 -3.659 -6.845 -5.793
350 HA ALA 42 HA ALA 42 -5.228 -9.295 -6.050
351 HB1 ALA 42 HB1 ALA 42 -2.899 -8.609 -7.842
352 HB2 ALA 42 HB2 ALA 42 -4.589 -8.716 -8.334
353 HB3 ALA 42 HB3 ALA 42 -3.735 -10.161 -7.793
354 H ILE 43 H ILE 43 -3.433 -7.717 -4.143
355 HA ILE 43 HA ILE 43 -1.693 -9.955 -3.377
356 HB ILE 43 HB ILE 43 -0.102 -8.173 -2.465
357 HG12 ILE 43 HG12 ILE 43 -1.421 -6.453 -4.566
358 HG13 ILE 43 HG13 ILE 43 -1.788 -6.299 -2.853
359 HG21 ILE 43 HG21 ILE 43 1.045 -7.965 -4.631
360 HG22 ILE 43 HG22 ILE 43 -0.419 -8.514 -5.446
361 HG23 ILE 43 HG23 ILE 43 0.442 -9.599 -4.355
362 HD11 ILE 43 HD11 ILE 43 0.914 -5.917 -4.125
363 HD12 ILE 43 HD12 ILE 43 0.546 -5.735 -2.410
364 HD13 ILE 43 HD13 ILE 43 -0.170 -4.634 -3.587
365 H GLY 44 H GLY 44 -3.286 -10.620 -1.935
366 HA2 GLY 44 HA2 GLY 44 -3.563 -8.881 0.440
367 HA3 GLY 44 HA3 GLY 44 -4.798 -10.024 -0.081
368 H SER 45 H SER 45 -3.536 -12.289 -0.571
369 HA SER 45 HA SER 45 -2.728 -13.160 2.055
370 HB2 SER 45 HB2 SER 45 -2.623 -15.412 0.899
371 HB3 SER 45 HB3 SER 45 -4.193 -14.609 0.843
372 HG SER 45 HG SER 45 -2.485 -15.284 -1.193
373 H LEU 46 H LEU 46 -1.085 -11.583 -0.175
374 HA LEU 46 HA LEU 46 1.268 -13.193 -0.461
375 HB2 LEU 46 HB2 LEU 46 0.481 -11.492 -2.123
376 HB3 LEU 46 HB3 LEU 46 0.923 -10.239 -0.979
377 HG LEU 46 HG LEU 46 3.269 -11.104 -1.057
378 HD11 LEU 46 HD11 LEU 46 2.208 -12.694 -3.385
379 HD12 LEU 46 HD12 LEU 46 2.779 -13.354 -1.852
380 HD13 LEU 46 HD13 LEU 46 3.905 -12.529 -2.931
381 HD21 LEU 46 HD21 LEU 46 2.574 -9.136 -2.320
382 HD22 LEU 46 HD22 LEU 46 2.103 -10.169 -3.671
383 HD23 LEU 46 HD23 LEU 46 3.797 -10.062 -3.190
384 H LYS 47 H LYS 47 2.986 -13.273 0.829
385 HA LYS 47 HA LYS 47 3.020 -12.096 3.382
386 HB2 LYS 47 HB2 LYS 47 4.123 -14.242 2.672
387 HB3 LYS 47 HB3 LYS 47 5.343 -13.278 1.853
388 HG2 LYS 47 HG2 LYS 47 6.181 -14.005 3.975
389 HG3 LYS 47 HG3 LYS 47 5.940 -12.255 4.009
390 HD2 LYS 47 HD2 LYS 47 5.121 -13.183 6.058
391 HD3 LYS 47 HD3 LYS 47 3.752 -12.628 5.106
392 HE2 LYS 47 HE2 LYS 47 3.278 -14.785 6.127
393 HE3 LYS 47 HE3 LYS 47 3.331 -14.920 4.372
394 HZ1 LYS 47 HZ1 LYS 47 5.830 -15.438 5.774
395 HZ2 LYS 47 HZ2 LYS 47 5.148 -16.230 4.437
396 HZ3 LYS 47 HZ3 LYS 47 4.598 -16.577 6.003
397 H VAL 48 H VAL 48 4.384 -10.482 4.249
398 HA VAL 48 HA VAL 48 4.874 -8.219 2.639
399 HB VAL 48 HB VAL 48 6.071 -8.858 5.343
400 HG11 VAL 48 HG11 VAL 48 7.211 -7.013 4.219
401 HG12 VAL 48 HG12 VAL 48 6.281 -6.433 5.602
402 HG13 VAL 48 HG13 VAL 48 5.666 -6.204 3.964
403 HG21 VAL 48 HG21 VAL 48 3.658 -9.010 5.431
404 HG22 VAL 48 HG22 VAL 48 3.506 -7.444 4.633
405 HG23 VAL 48 HG23 VAL 48 4.197 -7.544 6.252
406 H GLU 49 H GLU 49 6.780 -11.009 3.381
407 HA GLU 49 HA GLU 49 9.258 -9.818 2.468
408 HB2 GLU 49 HB2 GLU 49 8.621 -12.680 3.217
409 HB3 GLU 49 HB3 GLU 49 10.229 -12.042 2.894
410 HG2 GLU 49 HG2 GLU 49 10.032 -10.546 4.801
411 HG3 GLU 49 HG3 GLU 49 8.408 -11.153 5.118
412 H ASP 50 H ASP 50 6.586 -10.831 0.905
413 HA ASP 50 HA ASP 50 8.082 -11.967 -1.364
414 HB2 ASP 50 HB2 ASP 50 5.231 -12.271 -0.478
415 HB3 ASP 50 HB3 ASP 50 5.676 -12.563 -2.155
416 H VAL 51 H VAL 51 6.422 -9.204 -0.290
417 HA VAL 51 HA VAL 51 5.645 -8.371 -2.949
418 HB VAL 51 HB VAL 51 4.095 -7.812 -1.211
419 HG11 VAL 51 HG11 VAL 51 6.324 -6.276 0.110
420 HG12 VAL 51 HG12 VAL 51 5.564 -7.752 0.707
421 HG13 VAL 51 HG13 VAL 51 4.633 -6.257 0.608
422 HG21 VAL 51 HG21 VAL 51 4.296 -6.223 -3.053
423 HG22 VAL 51 HG22 VAL 51 5.503 -5.313 -2.144
424 HG23 VAL 51 HG23 VAL 51 3.844 -5.412 -1.554
425 H LYS 52 H LYS 52 7.524 -8.187 -4.042
426 HA LYS 52 HA LYS 52 9.636 -6.435 -3.151
427 HB2 LYS 52 HB2 LYS 52 9.193 -7.784 -5.822
428 HB3 LYS 52 HB3 LYS 52 10.674 -6.990 -5.308
429 HG2 LYS 52 HG2 LYS 52 11.011 -8.632 -3.577
430 HG3 LYS 52 HG3 LYS 52 9.462 -9.388 -3.953
431 HD2 LYS 52 HD2 LYS 52 11.267 -10.677 -4.925
432 HD3 LYS 52 HD3 LYS 52 10.303 -9.938 -6.203
433 HE2 LYS 52 HE2 LYS 52 11.964 -8.215 -6.515
434 HE3 LYS 52 HE3 LYS 52 12.894 -8.816 -5.143
435 HZ1 LYS 52 HZ1 LYS 52 12.372 -10.310 -7.662
436 HZ2 LYS 52 HZ2 LYS 52 13.285 -10.871 -6.346
437 HZ3 LYS 52 HZ3 LYS 52 13.833 -9.548 -7.254
438 HA PRO 53 HA PRO 53 8.582 -2.496 -4.731
439 HB2 PRO 53 HB2 PRO 53 10.761 -2.746 -6.758
440 HB3 PRO 53 HB3 PRO 53 10.409 -1.423 -5.637
441 HG2 PRO 53 HG2 PRO 53 12.386 -3.114 -5.121
442 HG3 PRO 53 HG3 PRO 53 11.323 -2.550 -3.818
443 HD2 PRO 53 HD2 PRO 53 11.390 -5.188 -5.201
444 HD3 PRO 53 HD3 PRO 53 11.013 -4.809 -3.509
445 H ARG 54 H ARG 54 9.283 -4.784 -7.381
446 HA ARG 54 HA ARG 54 8.011 -3.273 -9.391
447 HB2 ARG 54 HB2 ARG 54 9.617 -5.148 -9.787
448 HB3 ARG 54 HB3 ARG 54 8.337 -6.274 -9.346
449 HG2 ARG 54 HG2 ARG 54 6.968 -5.415 -11.189
450 HG3 ARG 54 HG3 ARG 54 8.286 -4.336 -11.645
451 HD2 ARG 54 HD2 ARG 54 9.718 -6.416 -11.835
452 HD3 ARG 54 HD3 ARG 54 8.215 -7.335 -11.731
453 HE ARG 54 HE ARG 54 8.482 -5.253 -13.780
454 HH11 ARG 54 HH11 ARG 54 8.171 -8.635 -12.932
455 HH12 ARG 54 HH12 ARG 54 7.847 -9.147 -14.560
456 HH21 ARG 54 HH21 ARG 54 8.067 -5.900 -15.919
457 HH22 ARG 54 HH22 ARG 54 7.798 -7.589 -16.276
458 H HIS 55 H HIS 55 6.815 -5.681 -7.157
459 HA HIS 55 HA HIS 55 4.277 -6.196 -8.117
460 HB2 HIS 55 HB2 HIS 55 5.409 -5.940 -5.354
461 HB3 HIS 55 HB3 HIS 55 3.676 -6.154 -5.557
462 HD1 HIS 55 HD1 HIS 55 6.925 -7.939 -6.438
463 HD2 HIS 55 HD2 HIS 55 2.881 -8.690 -5.907
464 HE1 HIS 55 HE1 HIS 55 6.701 -10.444 -6.458
465 HE2 HIS 55 HE2 HIS 55 4.268 -10.889 -5.993
466 H ILE 56 H ILE 56 5.337 -3.545 -6.078
467 HA ILE 56 HA ILE 56 2.805 -2.257 -5.952
468 HB ILE 56 HB ILE 56 5.528 -1.063 -5.393
469 HG12 ILE 56 HG12 ILE 56 5.198 -3.057 -4.035
470 HG13 ILE 56 HG13 ILE 56 5.061 -1.620 -3.028
471 HG21 ILE 56 HG21 ILE 56 2.777 -0.231 -4.490
472 HG22 ILE 56 HG22 ILE 56 3.794 0.616 -5.656
473 HG23 ILE 56 HG23 ILE 56 4.293 0.502 -3.967
474 HD11 ILE 56 HD11 ILE 56 3.378 -3.275 -2.449
475 HD12 ILE 56 HD12 ILE 56 2.765 -3.247 -4.102
476 HD13 ILE 56 HD13 ILE 56 2.628 -1.812 -3.087
477 H ASP 57 H ASP 57 5.647 -1.829 -8.077
478 HA ASP 57 HA ASP 57 4.683 0.615 -9.151
479 HB2 ASP 57 HB2 ASP 57 6.460 0.628 -10.596
480 HB3 ASP 57 HB3 ASP 57 7.090 -0.411 -9.335
481 H ASP 58 H ASP 58 4.257 -2.737 -10.033
482 HA ASP 58 HA ASP 58 2.975 -2.318 -12.501
483 HB2 ASP 58 HB2 ASP 58 3.873 -4.513 -11.608
484 HB3 ASP 58 HB3 ASP 58 2.415 -4.615 -10.625
485 H VAL 59 H VAL 59 1.726 -2.365 -9.196
486 HA VAL 59 HA VAL 59 -1.003 -2.234 -10.119
487 HB VAL 59 HB VAL 59 -1.642 -1.986 -7.767
488 HG11 VAL 59 HG11 VAL 59 -0.874 -4.165 -6.994
489 HG12 VAL 59 HG12 VAL 59 0.386 -4.160 -8.229
490 HG13 VAL 59 HG13 VAL 59 -1.311 -4.203 -8.702
491 HG21 VAL 59 HG21 VAL 59 -0.008 -2.076 -5.978
492 HG22 VAL 59 HG22 VAL 59 0.253 -0.650 -6.983
493 HG23 VAL 59 HG23 VAL 59 1.305 -2.053 -7.154
494 H LEU 60 H LEU 60 1.436 0.050 -9.011
495 HA LEU 60 HA LEU 60 -0.375 2.236 -8.735
496 HB2 LEU 60 HB2 LEU 60 2.624 2.175 -9.046
497 HB3 LEU 60 HB3 LEU 60 1.706 3.643 -8.773
498 HG LEU 60 HG LEU 60 1.991 1.307 -6.885
499 HD11 LEU 60 HD11 LEU 60 3.033 2.975 -5.429
500 HD12 LEU 60 HD12 LEU 60 2.863 4.186 -6.700
501 HD13 LEU 60 HD13 LEU 60 3.912 2.790 -6.947
502 HD21 LEU 60 HD21 LEU 60 -0.292 2.185 -6.799
503 HD22 LEU 60 HD22 LEU 60 0.344 3.812 -6.554
504 HD23 LEU 60 HD23 LEU 60 0.605 2.569 -5.330
505 H LYS 61 H LYS 61 1.722 1.127 -11.392
506 HA LYS 61 HA LYS 61 1.235 3.343 -13.058
507 HB2 LYS 61 HB2 LYS 61 1.933 1.886 -14.943
508 HB3 LYS 61 HB3 LYS 61 3.059 1.883 -13.600
509 HG2 LYS 61 HG2 LYS 61 3.034 -0.328 -14.054
510 HG3 LYS 61 HG3 LYS 61 1.677 -0.274 -12.932
511 HD2 LYS 61 HD2 LYS 61 0.109 -0.217 -14.779
512 HD3 LYS 61 HD3 LYS 61 1.440 -0.146 -15.938
513 HE2 LYS 61 HE2 LYS 61 2.211 -2.338 -15.193
514 HE3 LYS 61 HE3 LYS 61 0.895 -2.407 -14.022
515 HZ1 LYS 61 HZ1 LYS 61 0.671 -2.423 -16.981
516 HZ2 LYS 61 HZ2 LYS 61 -0.659 -2.246 -15.942
517 HZ3 LYS 61 HZ3 LYS 61 0.259 -3.670 -15.904
518 H ALA 62 H ALA 62 -0.632 0.494 -12.377
519 HA ALA 62 HA ALA 62 -2.520 0.861 -14.486
520 HB1 ALA 62 HB1 ALA 62 -2.814 -0.649 -11.887
521 HB2 ALA 62 HB2 ALA 62 -2.190 -1.309 -13.398
522 HB3 ALA 62 HB3 ALA 62 -3.870 -0.785 -13.294
523 H VAL 63 H VAL 63 -2.512 1.711 -11.008
524 HA VAL 63 HA VAL 63 -5.140 2.759 -11.037
525 HB VAL 63 HB VAL 63 -4.658 3.755 -8.869
526 HG11 VAL 63 HG11 VAL 63 -5.212 1.398 -8.970
527 HG12 VAL 63 HG12 VAL 63 -4.079 1.717 -7.657
528 HG13 VAL 63 HG13 VAL 63 -3.506 0.990 -9.158
529 HG21 VAL 63 HG21 VAL 63 -1.804 2.911 -9.334
530 HG22 VAL 63 HG22 VAL 63 -2.459 3.563 -7.831
531 HG23 VAL 63 HG23 VAL 63 -2.404 4.569 -9.279
532 H MET 64 H MET 64 -2.139 4.089 -12.064
533 HA MET 64 HA MET 64 -2.966 6.831 -11.929
534 HB2 MET 64 HB2 MET 64 -0.730 5.514 -13.477
535 HB3 MET 64 HB3 MET 64 -1.003 7.251 -13.421
536 HG2 MET 64 HG2 MET 64 -0.765 7.103 -10.930
537 HG3 MET 64 HG3 MET 64 -0.240 5.436 -11.154
538 HE1 MET 64 HE1 MET 64 3.024 5.937 -13.296
539 HE2 MET 64 HE2 MET 64 1.390 5.669 -13.898
540 HE3 MET 64 HE3 MET 64 1.979 4.755 -12.508
541 H LYS 65 H LYS 65 -2.960 4.324 -14.425
542 HA LYS 65 HA LYS 65 -3.875 6.154 -16.449
543 HB2 LYS 65 HB2 LYS 65 -3.992 4.179 -17.899
544 HB3 LYS 65 HB3 LYS 65 -2.453 4.313 -17.083
545 HG2 LYS 65 HG2 LYS 65 -2.872 2.064 -16.961
546 HG3 LYS 65 HG3 LYS 65 -3.469 2.635 -15.404
547 HD2 LYS 65 HD2 LYS 65 -5.001 1.028 -16.478
548 HD3 LYS 65 HD3 LYS 65 -5.746 2.605 -16.224
549 HE2 LYS 65 HE2 LYS 65 -5.338 3.177 -18.571
550 HE3 LYS 65 HE3 LYS 65 -4.582 1.602 -18.824
551 HZ1 LYS 65 HZ1 LYS 65 -7.388 1.960 -17.916
552 HZ2 LYS 65 HZ2 LYS 65 -6.641 0.516 -18.402
553 HZ3 LYS 65 HZ3 LYS 65 -6.947 1.737 -19.537
554 H ARG 66 H ARG 66 -5.292 3.830 -14.310
555 HA ARG 66 HA ARG 66 -7.893 3.954 -15.542
556 HB2 ARG 66 HB2 ARG 66 -8.635 2.503 -13.771
557 HB3 ARG 66 HB3 ARG 66 -7.065 1.942 -14.327
558 HG2 ARG 66 HG2 ARG 66 -6.444 1.925 -12.200
559 HG3 ARG 66 HG3 ARG 66 -6.464 3.688 -12.267
560 HD2 ARG 66 HD2 ARG 66 -7.796 3.142 -10.420
561 HD3 ARG 66 HD3 ARG 66 -8.939 3.520 -11.708
562 HE ARG 66 HE ARG 66 -8.233 0.712 -11.347
563 HH11 ARG 66 HH11 ARG 66 -10.556 3.293 -10.856
564 HH12 ARG 66 HH12 ARG 66 -11.853 2.217 -10.420
565 HH21 ARG 66 HH21 ARG 66 -9.935 -0.698 -10.774
566 HH22 ARG 66 HH22 ARG 66 -11.507 -0.055 -10.403
567 H GLY 67 H GLY 67 -6.225 6.115 -13.662
568 HA2 GLY 67 HA2 GLY 67 -8.637 7.584 -13.064
569 HA3 GLY 67 HA3 GLY 67 -7.792 7.001 -11.640
570 H ALA 68 H ALA 68 -5.570 7.696 -11.329
571 HA ALA 68 HA ALA 68 -4.548 9.943 -12.784
572 HB1 ALA 68 HB1 ALA 68 -6.350 11.079 -11.589
573 HB2 ALA 68 HB2 ALA 68 -4.778 11.598 -10.982
574 HB3 ALA 68 HB3 ALA 68 -5.746 10.451 -10.056
575 HA PRO 69 HA PRO 69 -0.830 8.574 -10.865
576 HB2 PRO 69 HB2 PRO 69 0.149 11.342 -11.015
577 HB3 PRO 69 HB3 PRO 69 0.732 9.895 -11.833
578 HG2 PRO 69 HG2 PRO 69 -0.556 11.859 -13.150
579 HG3 PRO 69 HG3 PRO 69 -0.683 10.153 -13.618
580 HD2 PRO 69 HD2 PRO 69 -2.606 11.853 -12.094
581 HD3 PRO 69 HD3 PRO 69 -2.924 10.617 -13.329
582 H SER 70 H SER 70 -2.666 11.254 -9.707
583 HA SER 70 HA SER 70 -1.451 11.813 -7.271
584 HB2 SER 70 HB2 SER 70 -4.424 11.692 -7.390
585 HB3 SER 70 HB3 SER 70 -3.371 12.997 -6.834
586 HG SER 70 HG SER 70 -3.602 13.859 -8.732
587 H ILE 71 H ILE 71 -3.629 9.215 -8.234
588 HA ILE 71 HA ILE 71 -4.217 8.213 -5.666
589 HB ILE 71 HB ILE 71 -4.130 6.687 -8.275
590 HG12 ILE 71 HG12 ILE 71 -6.437 8.124 -6.943
591 HG13 ILE 71 HG13 ILE 71 -5.577 8.688 -8.373
592 HG21 ILE 71 HG21 ILE 71 -5.735 5.183 -7.186
593 HG22 ILE 71 HG22 ILE 71 -5.561 6.094 -5.686
594 HG23 ILE 71 HG23 ILE 71 -4.184 5.212 -6.348
595 HD11 ILE 71 HD11 ILE 71 -6.330 6.710 -9.596
596 HD12 ILE 71 HD12 ILE 71 -7.683 7.655 -8.974
597 HD13 ILE 71 HD13 ILE 71 -7.203 6.162 -8.164
598 H ALA 72 H ALA 72 -1.607 7.525 -7.945
599 HA ALA 72 HA ALA 72 -0.488 5.324 -6.604
600 HB1 ALA 72 HB1 ALA 72 0.096 5.935 -8.905
601 HB2 ALA 72 HB2 ALA 72 1.530 5.781 -7.891
602 HB3 ALA 72 HB3 ALA 72 0.915 7.379 -8.312
603 H ASN 73 H ASN 73 0.340 8.777 -6.463
604 HA ASN 73 HA ASN 73 2.294 8.532 -4.439
605 HB2 ASN 73 HB2 ASN 73 0.612 10.904 -5.274
606 HB3 ASN 73 HB3 ASN 73 1.941 10.999 -4.126
607 HD21 ASN 73 HD21 ASN 73 1.050 10.591 -7.453
608 HD22 ASN 73 HD22 ASN 73 2.635 10.783 -8.106
609 H ASP 74 H ASP 74 -1.159 9.180 -4.366
610 HA ASP 74 HA ASP 74 -1.447 9.684 -1.621
611 HB2 ASP 74 HB2 ASP 74 -3.220 10.172 -3.213
612 HB3 ASP 74 HB3 ASP 74 -3.394 8.463 -3.591
613 H THR 75 H THR 75 -1.595 6.647 -3.439
614 HA THR 75 HA THR 75 -2.130 4.996 -1.206
615 HB THR 75 HB THR 75 -0.786 4.280 -3.820
616 HG1 THR 75 HG1 THR 75 -2.836 5.114 -4.211
617 HG21 THR 75 HG21 THR 75 -0.470 2.568 -2.095
618 HG22 THR 75 HG22 THR 75 -1.565 2.007 -3.358
619 HG23 THR 75 HG23 THR 75 -2.208 2.539 -1.804
620 H LEU 76 H LEU 76 0.856 5.989 -2.824
621 HA LEU 76 HA LEU 76 2.648 4.412 -1.334
622 HB2 LEU 76 HB2 LEU 76 3.085 5.663 -3.489
623 HB3 LEU 76 HB3 LEU 76 3.207 7.125 -2.534
624 HG LEU 76 HG LEU 76 4.988 4.804 -1.891
625 HD11 LEU 76 HD11 LEU 76 6.651 5.715 -3.464
626 HD12 LEU 76 HD12 LEU 76 5.424 6.813 -4.096
627 HD13 LEU 76 HD13 LEU 76 5.229 5.072 -4.285
628 HD21 LEU 76 HD21 LEU 76 6.512 6.589 -1.211
629 HD22 LEU 76 HD22 LEU 76 4.960 6.732 -0.385
630 HD23 LEU 76 HD23 LEU 76 5.341 7.798 -1.738
631 H ARG 77 H ARG 77 1.135 7.485 -0.714
632 HA ARG 77 HA ARG 77 2.587 8.489 1.410
633 HB2 ARG 77 HB2 ARG 77 0.612 9.523 0.234
634 HB3 ARG 77 HB3 ARG 77 -0.426 8.478 1.188
635 HG2 ARG 77 HG2 ARG 77 0.424 9.546 3.237
636 HG3 ARG 77 HG3 ARG 77 1.389 10.639 2.236
637 HD2 ARG 77 HD2 ARG 77 -0.796 11.234 1.072
638 HD3 ARG 77 HD3 ARG 77 -1.604 10.408 2.400
639 HE ARG 77 HE ARG 77 0.072 12.213 3.613
640 HH11 ARG 77 HH11 ARG 77 -2.554 12.353 1.302
641 HH12 ARG 77 HH12 ARG 77 -3.011 13.981 1.710
642 HH21 ARG 77 HH21 ARG 77 -0.542 14.364 4.176
643 HH22 ARG 77 HH22 ARG 77 -1.864 15.114 3.332
644 H TRP 78 H TRP 78 -0.114 6.176 1.511
645 HA TRP 78 HA TRP 78 0.142 5.728 4.330
646 HB2 TRP 78 HB2 TRP 78 -1.376 4.164 2.231
647 HB3 TRP 78 HB3 TRP 78 -1.533 3.946 3.970
648 HD1 TRP 78 HD1 TRP 78 -2.562 6.266 1.136
649 HE1 TRP 78 HE1 TRP 78 -4.345 7.910 1.996
650 HE3 TRP 78 HE3 TRP 78 -2.352 5.174 6.128
651 HZ2 TRP 78 HZ2 TRP 78 -5.513 8.640 4.450
652 HZ3 TRP 78 HZ3 TRP 78 -3.841 6.390 7.662
653 HH2 TRP 78 HH2 TRP 78 -5.388 8.089 6.838
654 H LEU 79 H LEU 79 1.183 4.059 1.400
655 HA LEU 79 HA LEU 79 2.093 1.661 2.481
656 HB2 LEU 79 HB2 LEU 79 3.219 3.279 0.197
657 HB3 LEU 79 HB3 LEU 79 3.708 1.638 0.569
658 HG LEU 79 HG LEU 79 0.922 2.481 -0.220
659 HD11 LEU 79 HD11 LEU 79 3.065 1.043 -1.783
660 HD12 LEU 79 HD12 LEU 79 2.500 2.690 -2.068
661 HD13 LEU 79 HD13 LEU 79 1.410 1.326 -2.324
662 HD21 LEU 79 HD21 LEU 79 0.957 0.532 1.253
663 HD22 LEU 79 HD22 LEU 79 2.125 -0.254 0.191
664 HD23 LEU 79 HD23 LEU 79 0.493 0.082 -0.388
665 H LYS 80 H LYS 80 3.716 4.776 2.237
666 HA LYS 80 HA LYS 80 6.269 4.006 3.017
667 HB2 LYS 80 HB2 LYS 80 5.925 6.135 2.028
668 HB3 LYS 80 HB3 LYS 80 4.739 6.591 3.237
669 HG2 LYS 80 HG2 LYS 80 7.488 6.023 4.177
670 HG3 LYS 80 HG3 LYS 80 7.222 7.504 3.255
671 HD2 LYS 80 HD2 LYS 80 5.711 6.672 5.731
672 HD3 LYS 80 HD3 LYS 80 6.990 7.876 5.661
673 HE2 LYS 80 HE2 LYS 80 4.337 8.026 4.243
674 HE3 LYS 80 HE3 LYS 80 4.790 8.931 5.685
675 HZ1 LYS 80 HZ1 LYS 80 6.053 9.169 3.002
676 HZ2 LYS 80 HZ2 LYS 80 6.542 10.016 4.392
677 HZ3 LYS 80 HZ3 LYS 80 5.009 10.296 3.721
678 H ARG 81 H ARG 81 3.475 4.971 4.964
679 HA ARG 81 HA ARG 81 4.858 4.784 7.464
680 HB2 ARG 81 HB2 ARG 81 1.948 4.936 6.717
681 HB3 ARG 81 HB3 ARG 81 2.470 4.734 8.382
682 HG2 ARG 81 HG2 ARG 81 3.641 6.847 8.306
683 HG3 ARG 81 HG3 ARG 81 3.228 7.039 6.599
684 HD2 ARG 81 HD2 ARG 81 0.917 7.233 7.087
685 HD3 ARG 81 HD3 ARG 81 1.155 6.713 8.753
686 HE ARG 81 HE ARG 81 2.543 8.906 8.863
687 HH11 ARG 81 HH11 ARG 81 -0.397 8.402 7.036
688 HH12 ARG 81 HH12 ARG 81 -0.960 10.035 7.221
689 HH21 ARG 81 HH21 ARG 81 1.825 11.069 9.101
690 HH22 ARG 81 HH22 ARG 81 0.319 11.564 8.382
691 H MET 82 H MET 82 2.610 2.697 5.693
692 HA MET 82 HA MET 82 2.256 0.770 7.689
693 HB2 MET 82 HB2 MET 82 0.823 1.027 5.677
694 HB3 MET 82 HB3 MET 82 2.122 0.355 4.702
695 HG2 MET 82 HG2 MET 82 1.981 -1.738 5.978
696 HG3 MET 82 HG3 MET 82 0.645 -1.067 6.911
697 HE1 MET 82 HE1 MET 82 1.875 -2.332 3.434
698 HE2 MET 82 HE2 MET 82 1.394 -0.681 3.042
699 HE3 MET 82 HE3 MET 82 0.475 -2.040 2.400
700 H PHE 83 H PHE 83 4.536 0.800 4.949
701 HA PHE 83 HA PHE 83 5.640 -1.740 5.645
702 HB2 PHE 83 HB2 PHE 83 6.486 0.414 3.729
703 HB3 PHE 83 HB3 PHE 83 7.495 -0.998 4.027
704 HD1 PHE 83 HD1 PHE 83 6.234 -3.302 3.832
705 HD2 PHE 83 HD2 PHE 83 4.967 0.324 2.004
706 HE1 PHE 83 HE1 PHE 83 4.954 -4.591 2.175
707 HE2 PHE 83 HE2 PHE 83 3.678 -0.960 0.349
708 HZ PHE 83 HZ PHE 83 3.672 -3.419 0.431
709 H ASN 84 H ASN 84 6.375 1.561 6.511
710 HA ASN 84 HA ASN 84 9.000 1.170 7.467
711 HB2 ASN 84 HB2 ASN 84 7.981 3.406 7.100
712 HB3 ASN 84 HB3 ASN 84 6.932 3.132 8.489
713 HD21 ASN 84 HD21 ASN 84 7.719 4.806 9.707
714 HD22 ASN 84 HD22 ASN 84 9.327 4.827 10.358
715 H TYR 85 H TYR 85 5.845 0.760 8.940
716 HA TYR 85 HA TYR 85 6.715 0.207 11.569
717 HB2 TYR 85 HB2 TYR 85 4.382 0.774 10.983
718 HB3 TYR 85 HB3 TYR 85 4.230 -0.750 10.119
719 HD1 TYR 85 HD1 TYR 85 5.226 0.454 13.524
720 HD2 TYR 85 HD2 TYR 85 3.137 -2.452 11.222
721 HE1 TYR 85 HE1 TYR 85 4.442 -0.615 15.594
722 HE2 TYR 85 HE2 TYR 85 2.353 -3.530 13.288
723 HH TYR 85 HH TYR 85 2.596 -2.061 16.339
724 H ALA 86 H ALA 86 6.293 -1.805 8.712
725 HA ALA 86 HA ALA 86 6.847 -4.277 10.002
726 HB1 ALA 86 HB1 ALA 86 7.145 -5.172 7.762
727 HB2 ALA 86 HB2 ALA 86 7.208 -3.538 7.099
728 HB3 ALA 86 HB3 ALA 86 5.717 -4.137 7.826
729 H ILE 87 H ILE 87 8.798 -1.762 8.575
730 HA ILE 87 HA ILE 87 11.259 -3.149 8.510
731 HB ILE 87 HB ILE 87 10.713 -0.179 8.687
732 HG12 ILE 87 HG12 ILE 87 11.453 -1.920 6.324
733 HG13 ILE 87 HG13 ILE 87 9.837 -1.315 6.668
734 HG21 ILE 87 HG21 ILE 87 13.016 0.136 7.937
735 HG22 ILE 87 HG22 ILE 87 13.281 -1.606 8.020
736 HG23 ILE 87 HG23 ILE 87 12.955 -0.695 9.493
737 HD11 ILE 87 HD11 ILE 87 10.620 0.970 6.382
738 HD12 ILE 87 HD12 ILE 87 10.938 -0.003 4.946
739 HD13 ILE 87 HD13 ILE 87 12.251 0.379 6.061
740 H LYS 88 H LYS 88 9.801 -0.978 10.927
741 HA LYS 88 HA LYS 88 12.055 -1.129 12.657
742 HB2 LYS 88 HB2 LYS 88 10.626 0.029 14.307
743 HB3 LYS 88 HB3 LYS 88 10.701 0.834 12.748
744 HG2 LYS 88 HG2 LYS 88 8.512 -0.232 12.185
745 HG3 LYS 88 HG3 LYS 88 8.437 -0.802 13.855
746 HD2 LYS 88 HD2 LYS 88 7.190 1.290 13.543
747 HD3 LYS 88 HD3 LYS 88 8.542 1.490 14.664
748 HE2 LYS 88 HE2 LYS 88 9.891 2.375 12.768
749 HE3 LYS 88 HE3 LYS 88 8.449 2.300 11.760
750 HZ1 LYS 88 HZ1 LYS 88 8.751 3.929 14.228
751 HZ2 LYS 88 HZ2 LYS 88 7.356 3.848 13.271
752 HZ3 LYS 88 HZ3 LYS 88 8.779 4.521 12.643
753 H ARG 89 H ARG 89 9.323 -3.137 12.185
754 HA ARG 89 HA ARG 89 9.747 -4.532 14.715
755 HB2 ARG 89 HB2 ARG 89 7.796 -4.982 12.458
756 HB3 ARG 89 HB3 ARG 89 7.934 -6.064 13.836
757 HG2 ARG 89 HG2 ARG 89 7.414 -4.147 15.323
758 HG3 ARG 89 HG3 ARG 89 7.140 -3.163 13.884
759 HD2 ARG 89 HD2 ARG 89 5.040 -4.020 14.766
760 HD3 ARG 89 HD3 ARG 89 5.373 -4.689 13.170
761 HE ARG 89 HE ARG 89 6.183 -6.714 14.416
762 HH11 ARG 89 HH11 ARG 89 3.803 -4.552 15.796
763 HH12 ARG 89 HH12 ARG 89 3.082 -5.777 16.790
764 HH21 ARG 89 HH21 ARG 89 5.247 -8.331 15.714
765 HH22 ARG 89 HH22 ARG 89 3.901 -7.926 16.747
766 H HIS 90 H HIS 90 11.372 -4.411 11.978
767 HA HIS 90 HA HIS 90 12.845 -5.694 10.862
768 HB2 HIS 90 HB2 HIS 90 13.750 -6.053 13.137
769 HB3 HIS 90 HB3 HIS 90 12.742 -7.489 13.294
770 HD1 HIS 90 HD1 HIS 90 14.055 -9.547 12.918
771 HD2 HIS 90 HD2 HIS 90 15.410 -6.396 10.564
772 HE1 HIS 90 HE1 HIS 90 15.956 -10.480 11.556
773 HE2 HIS 90 HE2 HIS 90 16.566 -8.627 9.963
774 H ILE 91 H ILE 91 10.507 -6.078 9.775
775 HA ILE 91 HA ILE 91 10.426 -8.971 9.242
776 HB ILE 91 HB ILE 91 8.671 -6.760 8.134
777 HG12 ILE 91 HG12 ILE 91 8.072 -8.855 10.238
778 HG13 ILE 91 HG13 ILE 91 8.330 -7.142 10.550
779 HG21 ILE 91 HG21 ILE 91 8.855 -8.616 6.590
780 HG22 ILE 91 HG22 ILE 91 7.250 -8.596 7.321
781 HG23 ILE 91 HG23 ILE 91 8.458 -9.756 7.876
782 HD11 ILE 91 HD11 ILE 91 5.967 -7.728 10.578
783 HD12 ILE 91 HD12 ILE 91 6.086 -8.308 8.916
784 HD13 ILE 91 HD13 ILE 91 6.332 -6.599 9.274
785 H ILE 92 H ILE 92 10.835 -5.840 7.727
786 HA ILE 92 HA ILE 92 12.923 -6.919 5.995
787 HB ILE 92 HB ILE 92 12.093 -5.405 4.140
788 HG12 ILE 92 HG12 ILE 92 9.571 -5.416 5.817
789 HG13 ILE 92 HG13 ILE 92 10.580 -4.016 5.475
790 HG21 ILE 92 HG21 ILE 92 11.828 -7.802 3.968
791 HG22 ILE 92 HG22 ILE 92 10.403 -6.995 3.313
792 HG23 ILE 92 HG23 ILE 92 10.340 -7.732 4.914
793 HD11 ILE 92 HD11 ILE 92 10.006 -4.179 3.110
794 HD12 ILE 92 HD12 ILE 92 8.565 -4.024 4.117
795 HD13 ILE 92 HD13 ILE 92 9.011 -5.594 3.451
796 H GLU 93 H GLU 93 14.445 -5.174 5.342
797 HA GLU 93 HA GLU 93 14.240 -2.878 7.169
798 HB2 GLU 93 HB2 GLU 93 16.653 -2.499 6.687
799 HB3 GLU 93 HB3 GLU 93 16.314 -4.032 7.472
800 HG2 GLU 93 HG2 GLU 93 16.598 -3.859 4.501
801 HG3 GLU 93 HG3 GLU 93 18.013 -3.962 5.551
802 H TYR 94 H TYR 94 13.846 -3.726 3.943
803 HA TYR 94 HA TYR 94 13.945 -0.893 3.161
804 HB2 TYR 94 HB2 TYR 94 14.572 -1.566 0.897
805 HB3 TYR 94 HB3 TYR 94 15.757 -2.155 2.054
806 HD1 TYR 94 HD2 TYR 94 15.587 -4.615 2.772
807 HD2 TYR 94 HD1 TYR 94 13.532 -3.033 -0.602
808 HE1 TYR 94 HE2 TYR 94 15.333 -6.887 1.870
809 HE2 TYR 94 HE1 TYR 94 13.271 -5.301 -1.511
810 HH TYR 94 HH TYR 94 14.333 -7.495 -1.327
811 H ASN 95 H ASN 95 12.130 -0.086 2.233
812 HA ASN 95 HA ASN 95 9.901 -1.970 1.943
813 HB2 ASN 95 HB2 ASN 95 8.417 -0.025 2.133
814 HB3 ASN 95 HB3 ASN 95 9.492 -0.146 3.516
815 HD21 ASN 95 HD21 ASN 95 8.023 2.129 2.444
816 HD22 ASN 95 HD22 ASN 95 9.202 3.359 2.133
817 HA PRO 96 HA PRO 96 9.998 -1.702 -2.417
818 HB2 PRO 96 HB2 PRO 96 7.065 -1.962 -2.423
819 HB3 PRO 96 HB3 PRO 96 8.292 -3.070 -3.044
820 HG2 PRO 96 HG2 PRO 96 6.873 -3.628 -0.833
821 HG3 PRO 96 HG3 PRO 96 8.569 -4.115 -1.005
822 HD2 PRO 96 HD2 PRO 96 7.400 -1.816 0.516
823 HD3 PRO 96 HD3 PRO 96 8.708 -2.925 0.981
824 H ALA 97 H ALA 97 8.037 0.457 -0.576
825 HA ALA 97 HA ALA 97 7.051 1.999 -2.778
826 HB1 ALA 97 HB1 ALA 97 7.208 2.712 0.151
827 HB2 ALA 97 HB2 ALA 97 5.856 1.908 -0.645
828 HB3 ALA 97 HB3 ALA 97 6.272 3.566 -1.076
829 H ALA 98 H ALA 98 10.057 1.792 -1.241
830 HA ALA 98 HA ALA 98 10.847 4.539 -1.526
831 HB1 ALA 98 HB1 ALA 98 12.558 2.098 -1.077
832 HB2 ALA 98 HB2 ALA 98 11.816 3.073 0.192
833 HB3 ALA 98 HB3 ALA 98 13.047 3.779 -0.855
834 H ALA 99 H ALA 99 10.447 2.012 -3.689
835 HA ALA 99 HA ALA 99 12.701 2.644 -5.400
836 HB1 ALA 99 HB1 ALA 99 10.419 0.725 -5.833
837 HB2 ALA 99 HB2 ALA 99 11.977 0.321 -5.116
838 HB3 ALA 99 HB3 ALA 99 11.888 0.831 -6.802
839 H PHE 100 H PHE 100 10.346 4.534 -4.862
840 HA PHE 100 HA PHE 100 9.878 5.167 -7.702
841 HB2 PHE 100 HB2 PHE 100 7.919 5.678 -5.448
842 HB3 PHE 100 HB3 PHE 100 7.668 6.028 -7.154
843 HD1 PHE 100 HD1 PHE 100 7.784 3.422 -4.595
844 HD2 PHE 100 HD2 PHE 100 7.148 4.265 -8.717
845 HE1 PHE 100 HE1 PHE 100 6.791 1.192 -4.892
846 HE2 PHE 100 HE2 PHE 100 6.156 2.036 -9.020
847 HZ PHE 100 HZ PHE 100 5.976 0.499 -7.106
848 H ASP 101 H ASP 101 8.781 6.971 -4.935
849 HA ASP 101 HA ASP 101 10.929 8.631 -4.401
850 HB2 ASP 101 HB2 ASP 101 10.519 9.359 -6.819
851 HB3 ASP 101 HB3 ASP 101 8.993 10.036 -6.255
852 HA PRO 102 HA PRO 102 7.557 9.150 -1.535
853 HB2 PRO 102 HB2 PRO 102 9.275 9.681 0.598
854 HB3 PRO 102 HB3 PRO 102 8.718 8.089 0.089
855 HG2 PRO 102 HG2 PRO 102 11.362 9.112 -0.041
856 HG3 PRO 102 HG3 PRO 102 10.776 7.567 -0.676
857 HD2 PRO 102 HD2 PRO 102 11.288 10.124 -2.086
858 HD3 PRO 102 HD3 PRO 102 11.322 8.459 -2.707
859 H GLY 103 H GLY 103 9.061 11.550 -3.016
860 HA2 GLY 103 HA2 GLY 103 7.787 13.576 -1.361
861 HA3 GLY 103 HA3 GLY 103 9.531 13.697 -1.494
862 H ASP 104 H ASP 104 7.101 12.847 -3.967
863 HA ASP 104 HA ASP 104 8.187 14.886 -5.705
864 HB2 ASP 104 HB2 ASP 104 7.408 12.695 -6.617
865 HB3 ASP 104 HB3 ASP 104 5.763 13.129 -6.163
866 H ALA 105 H ALA 105 7.569 16.896 -5.685
867 HA ALA 105 HA ALA 105 6.394 18.806 -5.392
868 HB1 ALA 105 HB1 ALA 105 4.639 17.725 -6.732
869 HB2 ALA 105 HB2 ALA 105 3.967 18.793 -5.500
870 HB3 ALA 105 HB3 ALA 105 3.946 17.045 -5.261
871 H GLY 106 H GLY 106 4.285 19.489 -3.739
872 HA2 GLY 106 HA2 GLY 106 3.595 19.590 -1.508
873 HA3 GLY 106 HA3 GLY 106 4.769 18.341 -1.109
874 H GLY 107 H GLY 107 7.107 19.067 -1.346
875 HA2 GLY 107 HA2 GLY 107 7.445 21.537 0.125
876 HA3 GLY 107 HA3 GLY 107 8.711 20.394 -0.304
877 H LYS 108 H LYS 108 7.529 20.541 -3.138
878 HA LYS 108 HA LYS 108 9.345 22.437 -4.153
879 HB2 LYS 108 HB2 LYS 108 7.254 20.671 -5.320
880 HB3 LYS 108 HB3 LYS 108 7.888 21.985 -6.308
881 HG2 LYS 108 HG2 LYS 108 9.524 19.837 -4.980
882 HG3 LYS 108 HG3 LYS 108 9.102 19.913 -6.695
883 HD2 LYS 108 HD2 LYS 108 10.365 21.904 -7.001
884 HD3 LYS 108 HD3 LYS 108 10.591 22.102 -5.261
885 HE2 LYS 108 HE2 LYS 108 11.954 20.115 -5.182
886 HE3 LYS 108 HE3 LYS 108 11.656 19.823 -6.889
887 HZ1 LYS 108 HZ1 LYS 108 13.033 22.219 -5.808
888 HZ2 LYS 108 HZ2 LYS 108 12.840 21.828 -7.445
889 HZ3 LYS 108 HZ3 LYS 108 13.824 20.865 -6.453
890 H LEU 109 H LEU 109 9.140 24.410 -4.908
891 HA LEU 109 HA LEU 109 6.702 25.670 -5.562
892 HB2 LEU 109 HB2 LEU 109 6.811 27.458 -3.793
893 HB3 LEU 109 HB3 LEU 109 6.251 25.891 -3.252
894 HG LEU 109 HG LEU 109 8.710 25.538 -2.484
895 HD11 LEU 109 HD11 LEU 109 9.854 27.588 -1.824
896 HD12 LEU 109 HD12 LEU 109 8.605 28.547 -2.615
897 HD13 LEU 109 HD13 LEU 109 9.655 27.505 -3.575
898 HD21 LEU 109 HD21 LEU 109 6.812 25.694 -0.985
899 HD22 LEU 109 HD22 LEU 109 6.854 27.453 -1.087
900 HD23 LEU 109 HD23 LEU 109 8.188 26.583 -0.331
901 H GLU 110 H GLU 110 7.020 27.753 -6.457
902 HA GLU 110 HA GLU 110 9.772 28.696 -6.673
903 HB2 GLU 110 HB2 GLU 110 9.498 28.858 -9.183
904 HB3 GLU 110 HB3 GLU 110 9.706 27.232 -8.545
905 HG2 GLU 110 HG2 GLU 110 7.274 26.895 -8.675
906 HG3 GLU 110 HG3 GLU 110 7.109 28.506 -9.374
907 H HIS 111 H HIS 111 9.732 30.790 -6.265
908 HA HIS 111 HA HIS 111 7.283 32.275 -6.978
909 HB2 HIS 111 HB2 HIS 111 9.140 32.817 -4.658
910 HB3 HIS 111 HB3 HIS 111 7.696 33.739 -5.062
911 HD1 HIS 111 HD1 HIS 111 5.548 31.725 -5.382
912 HD2 HIS 111 HD2 HIS 111 8.544 31.306 -2.519
913 HE1 HIS 111 HE1 HIS 111 4.625 30.147 -3.654
914 HE2 HIS 111 HE2 HIS 111 6.373 30.065 -1.839
915 H HIS 112 H HIS 112 7.914 33.055 -8.917
916 HA HIS 112 HA HIS 112 10.113 35.012 -8.817
917 HB2 HIS 112 HB2 HIS 112 9.136 33.413 -11.197
918 HB3 HIS 112 HB3 HIS 112 10.348 34.688 -11.273
919 HD1 HIS 112 HD1 HIS 112 10.204 31.194 -11.297
920 HD2 HIS 112 HD2 HIS 112 12.519 33.930 -9.179
921 HE1 HIS 112 HE1 HIS 112 12.218 29.917 -10.505
922 HE2 HIS 112 HE2 HIS 112 13.506 31.538 -9.076
923 H HIS 113 H HIS 113 9.720 37.014 -9.926
924 HA HIS 113 HA HIS 113 7.008 37.808 -9.348
925 HB2 HIS 113 HB2 HIS 113 9.345 39.470 -10.308
926 HB3 HIS 113 HB3 HIS 113 7.812 40.098 -9.714
927 HD1 HIS 113 HD1 HIS 113 7.415 40.044 -7.163
928 HD2 HIS 113 HD2 HIS 113 11.099 38.514 -8.335
929 HE1 HIS 113 HE1 HIS 113 8.751 39.800 -5.047
930 HE2 HIS 113 HE2 HIS 113 10.912 38.716 -5.762
931 H HIS 114 H HIS 114 5.647 37.089 -10.863
932 HA HIS 114 HA HIS 114 6.084 38.063 -13.606
933 HB2 HIS 114 HB2 HIS 114 4.766 36.119 -14.409
934 HB3 HIS 114 HB3 HIS 114 6.252 35.639 -13.605
935 HD1 HIS 114 HD1 HIS 114 5.940 34.694 -11.093
936 HD2 HIS 114 HD2 HIS 114 2.486 35.008 -13.385
937 HE1 HIS 114 HE1 HIS 114 4.238 33.245 -9.951
938 HE2 HIS 114 HE2 HIS 114 2.098 33.648 -11.218
939 H HIS 115 H HIS 115 4.713 39.561 -14.174
940 HA HIS 115 HA HIS 115 1.947 39.503 -13.358
941 HB2 HIS 115 HB2 HIS 115 2.113 41.842 -12.351
942 HB3 HIS 115 HB3 HIS 115 2.726 40.516 -11.371
943 HD1 HIS 115 HD1 HIS 115 4.995 40.852 -10.422
944 HD2 HIS 115 HD2 HIS 115 4.318 43.265 -13.747
945 HE1 HIS 115 HE1 HIS 115 7.048 42.282 -10.656
946 HE2 HIS 115 HE2 HIS 115 6.672 43.647 -12.737
947 H HIS 116 H HIS 116 4.557 40.783 -15.216
948 HA HIS 116 HA HIS 116 2.871 41.556 -17.350
949 HB2 HIS 116 HB2 HIS 116 2.447 43.477 -15.804
950 HB3 HIS 116 HB3 HIS 116 4.166 43.848 -15.850
951 HD1 HIS 116 HD1 HIS 116 1.117 43.809 -18.077
952 HD2 HIS 116 HD2 HIS 116 4.978 45.353 -17.990
953 HE1 HIS 116 HE1 HIS 116 1.265 45.378 -20.037
954 HE2 HIS 116 HE2 HIS 116 3.537 46.459 -19.835
Start of MODEL 15
1 H1 MET 1 H1 MET 1 -5.331 -6.869 12.329
2 H2 MET 1 H2 MET 1 -5.711 -8.513 12.477
3 H3 MET 1 H3 MET 1 -4.320 -8.032 11.635
4 HA MET 1 HA MET 1 -3.320 -7.192 13.606
5 HB2 MET 1 HB2 MET 1 -4.429 -7.617 15.807
6 HB3 MET 1 HB3 MET 1 -5.247 -6.427 14.808
7 HG2 MET 1 HG2 MET 1 -6.868 -8.158 14.126
8 HG3 MET 1 HG3 MET 1 -6.071 -9.294 15.214
9 HE1 MET 1 HE1 MET 1 -6.697 -5.453 15.763
10 HE2 MET 1 HE2 MET 1 -8.228 -5.468 16.637
11 HE3 MET 1 HE3 MET 1 -8.171 -5.977 14.949
12 H ALA 2 H ALA 2 -1.714 -8.601 13.518
13 HA ALA 2 HA ALA 2 -2.176 -11.275 14.650
14 HB1 ALA 2 HB1 ALA 2 -0.724 -12.297 12.981
15 HB2 ALA 2 HB2 ALA 2 -0.530 -10.739 12.178
16 HB3 ALA 2 HB3 ALA 2 -2.109 -11.524 12.212
17 H GLU 3 H GLU 3 0.288 -12.278 14.867
18 HA GLU 3 HA GLU 3 1.993 -10.203 15.994
19 HB2 GLU 3 HB2 GLU 3 0.477 -10.599 17.815
20 HB3 GLU 3 HB3 GLU 3 0.667 -12.339 17.663
21 HG2 GLU 3 HG2 GLU 3 3.020 -12.120 18.321
22 HG3 GLU 3 HG3 GLU 3 2.781 -10.384 18.528
23 H LYS 4 H LYS 4 1.580 -13.759 16.120
24 HA LYS 4 HA LYS 4 4.446 -14.024 16.422
25 HB2 LYS 4 HB2 LYS 4 3.835 -16.500 16.625
26 HB3 LYS 4 HB3 LYS 4 3.250 -15.411 17.876
27 HG2 LYS 4 HG2 LYS 4 1.060 -15.336 16.774
28 HG3 LYS 4 HG3 LYS 4 1.652 -16.456 15.544
29 HD2 LYS 4 HD2 LYS 4 1.907 -18.198 17.137
30 HD3 LYS 4 HD3 LYS 4 1.658 -17.089 18.487
31 HE2 LYS 4 HE2 LYS 4 -0.649 -16.763 17.840
32 HE3 LYS 4 HE3 LYS 4 -0.417 -17.756 16.400
33 HZ1 LYS 4 HZ1 LYS 4 0.064 -18.844 19.107
34 HZ2 LYS 4 HZ2 LYS 4 -0.249 -19.683 17.665
35 HZ3 LYS 4 HZ3 LYS 4 -1.491 -18.824 18.433
36 H ASN 5 H ASN 5 2.107 -14.483 13.894
37 HA ASN 5 HA ASN 5 4.055 -15.999 12.314
38 HB2 ASN 5 HB2 ASN 5 1.139 -15.381 11.780
39 HB3 ASN 5 HB3 ASN 5 2.174 -16.349 10.738
40 HD21 ASN 5 HD21 ASN 5 -0.301 -16.978 12.191
41 HD22 ASN 5 HD22 ASN 5 0.062 -18.383 13.136
42 H ALA 6 H ALA 6 4.978 -15.209 10.484
43 HA ALA 6 HA ALA 6 4.855 -12.397 9.953
44 HB1 ALA 6 HB1 ALA 6 6.912 -13.660 9.593
45 HB2 ALA 6 HB2 ALA 6 6.379 -12.868 8.110
46 HB3 ALA 6 HB3 ALA 6 6.120 -14.599 8.330
47 H TYR 7 H TYR 7 3.012 -11.619 9.188
48 HA TYR 7 HA TYR 7 1.351 -13.269 7.499
49 HB2 TYR 7 HB2 TYR 7 -0.245 -11.259 7.781
50 HB3 TYR 7 HB3 TYR 7 0.083 -12.296 9.161
51 HD1 TYR 7 HD2 TYR 7 0.689 -8.979 7.687
52 HD2 TYR 7 HD1 TYR 7 1.258 -11.473 11.081
53 HE1 TYR 7 HE2 TYR 7 1.321 -7.018 9.021
54 HE2 TYR 7 HE1 TYR 7 1.879 -9.514 12.427
55 HH TYR 7 HH TYR 7 1.240 -6.410 11.508
56 H THR 8 H THR 8 -0.076 -11.554 6.030
57 HA THR 8 HA THR 8 1.743 -11.156 3.813
58 HB THR 8 HB THR 8 -0.378 -10.761 2.535
59 HG1 THR 8 HG1 THR 8 -1.777 -11.702 4.809
60 HG21 THR 8 HG21 THR 8 0.618 -12.983 2.652
61 HG22 THR 8 HG22 THR 8 -1.142 -13.096 2.656
62 HG23 THR 8 HG23 THR 8 -0.239 -13.306 4.158
63 H VAL 9 H VAL 9 1.191 -9.257 2.312
64 HA VAL 9 HA VAL 9 1.600 -6.781 3.638
65 HB VAL 9 HB VAL 9 2.406 -7.145 1.355
66 HG11 VAL 9 HG11 VAL 9 -0.502 -7.211 0.557
67 HG12 VAL 9 HG12 VAL 9 0.622 -8.570 0.520
68 HG13 VAL 9 HG13 VAL 9 0.870 -7.191 -0.552
69 HG21 VAL 9 HG21 VAL 9 0.330 -4.963 1.478
70 HG22 VAL 9 HG22 VAL 9 1.672 -5.044 0.337
71 HG23 VAL 9 HG23 VAL 9 1.990 -4.852 2.061
72 H ALA 10 H ALA 10 -1.184 -8.556 2.640
73 HA ALA 10 HA ALA 10 -3.089 -6.468 2.641
74 HB1 ALA 10 HB1 ALA 10 -4.746 -8.252 2.750
75 HB2 ALA 10 HB2 ALA 10 -3.484 -9.412 3.166
76 HB3 ALA 10 HB3 ALA 10 -3.483 -8.640 1.580
77 H GLN 11 H GLN 11 -1.744 -8.524 5.131
78 HA GLN 11 HA GLN 11 -3.719 -7.828 7.096
79 HB2 GLN 11 HB2 GLN 11 -2.493 -10.012 7.034
80 HB3 GLN 11 HB3 GLN 11 -1.036 -9.155 7.507
81 HG2 GLN 11 HG2 GLN 11 -2.115 -10.287 9.392
82 HG3 GLN 11 HG3 GLN 11 -2.038 -8.540 9.619
83 HE21 GLN 11 HE21 GLN 11 -3.890 -7.365 9.710
84 HE22 GLN 11 HE22 GLN 11 -5.472 -8.081 9.736
85 H LEU 12 H LEU 12 -0.519 -6.704 6.194
86 HA LEU 12 HA LEU 12 0.170 -5.147 8.387
87 HB2 LEU 12 HB2 LEU 12 0.600 -4.703 5.439
88 HB3 LEU 12 HB3 LEU 12 1.246 -3.613 6.645
89 HG LEU 12 HG LEU 12 1.931 -6.548 6.433
90 HD11 LEU 12 HD11 LEU 12 4.115 -5.717 5.647
91 HD12 LEU 12 HD12 LEU 12 3.459 -4.080 5.606
92 HD13 LEU 12 HD13 LEU 12 2.803 -5.321 4.538
93 HD21 LEU 12 HD21 LEU 12 3.711 -5.973 8.024
94 HD22 LEU 12 HD22 LEU 12 2.107 -5.706 8.707
95 HD23 LEU 12 HD23 LEU 12 3.066 -4.336 8.144
96 H ALA 13 H ALA 13 -1.918 -4.361 5.656
97 HA ALA 13 HA ALA 13 -2.323 -1.652 6.315
98 HB1 ALA 13 HB1 ALA 13 -4.157 -1.734 4.711
99 HB2 ALA 13 HB2 ALA 13 -4.077 -3.495 4.698
100 HB3 ALA 13 HB3 ALA 13 -2.725 -2.546 4.080
101 H ASP 14 H ASP 14 -3.777 -4.577 7.501
102 HA ASP 14 HA ASP 14 -6.184 -3.376 8.467
103 HB2 ASP 14 HB2 ASP 14 -6.035 -5.791 8.002
104 HB3 ASP 14 HB3 ASP 14 -4.861 -5.967 9.301
105 H GLU 15 H GLU 15 -3.147 -4.394 10.043
106 HA GLU 15 HA GLU 15 -3.770 -3.277 12.563
107 HB2 GLU 15 HB2 GLU 15 -1.184 -3.995 11.213
108 HB3 GLU 15 HB3 GLU 15 -1.176 -3.163 12.760
109 HG2 GLU 15 HG2 GLU 15 -1.028 -5.327 13.441
110 HG3 GLU 15 HG3 GLU 15 -2.776 -5.110 13.467
111 H TYR 16 H TYR 16 -2.269 -1.955 9.676
112 HA TYR 16 HA TYR 16 -1.379 0.462 10.823
113 HB2 TYR 16 HB2 TYR 16 -0.598 -0.469 8.645
114 HB3 TYR 16 HB3 TYR 16 -2.148 -0.031 7.939
115 HD1 TYR 16 HD1 TYR 16 1.051 1.227 9.203
116 HD2 TYR 16 HD2 TYR 16 -2.690 2.306 7.486
117 HE1 TYR 16 HE1 TYR 16 1.936 3.464 8.692
118 HE2 TYR 16 HE2 TYR 16 -1.812 4.543 6.970
119 HH TYR 16 HH TYR 16 -0.029 6.055 7.830
120 H PHE 17 H PHE 17 -4.384 -0.307 9.020
121 HA PHE 17 HA PHE 17 -5.280 2.405 9.196
122 HB2 PHE 17 HB2 PHE 17 -6.980 1.816 7.808
123 HB3 PHE 17 HB3 PHE 17 -5.934 0.439 7.509
124 HD1 PHE 17 HD2 PHE 17 -6.503 -1.762 8.367
125 HD2 PHE 17 HD1 PHE 17 -9.047 1.583 9.014
126 HE1 PHE 17 HE2 PHE 17 -8.333 -3.278 8.997
127 HE2 PHE 17 HE1 PHE 17 -10.884 0.074 9.641
128 HZ PHE 17 HZ PHE 17 -10.528 -2.362 9.634
129 H GLU 18 H GLU 18 -5.713 -0.452 11.145
130 HA GLU 18 HA GLU 18 -7.974 0.363 12.613
131 HB2 GLU 18 HB2 GLU 18 -6.799 -1.936 12.507
132 HB3 GLU 18 HB3 GLU 18 -5.721 -1.300 13.735
133 HG2 GLU 18 HG2 GLU 18 -8.677 -1.269 14.156
134 HG3 GLU 18 HG3 GLU 18 -7.749 -2.737 14.426
135 H ARG 19 H ARG 19 -4.608 1.195 12.820
136 HA ARG 19 HA ARG 19 -5.050 2.540 15.381
137 HB2 ARG 19 HB2 ARG 19 -2.489 1.812 13.960
138 HB3 ARG 19 HB3 ARG 19 -2.586 2.604 15.532
139 HG2 ARG 19 HG2 ARG 19 -3.788 0.693 16.436
140 HG3 ARG 19 HG3 ARG 19 -3.719 -0.101 14.865
141 HD2 ARG 19 HD2 ARG 19 -1.374 -0.356 14.997
142 HD3 ARG 19 HD3 ARG 19 -1.267 0.739 16.378
143 HE ARG 19 HE ARG 19 -2.913 -1.242 17.249
144 HH11 ARG 19 HH11 ARG 19 0.294 -1.249 15.835
145 HH12 ARG 19 HH12 ARG 19 0.801 -2.662 16.712
146 HH21 ARG 19 HH21 ARG 19 -2.266 -3.087 18.369
147 HH22 ARG 19 HH22 ARG 19 -0.661 -3.727 18.151
148 H MET 20 H MET 20 -3.892 3.191 12.096
149 HA MET 20 HA MET 20 -3.353 5.966 12.711
150 HB2 MET 20 HB2 MET 20 -3.330 4.421 10.122
151 HB3 MET 20 HB3 MET 20 -2.982 6.139 10.213
152 HG2 MET 20 HG2 MET 20 -1.424 4.041 11.702
153 HG3 MET 20 HG3 MET 20 -0.994 4.635 10.106
154 HE1 MET 20 HE1 MET 20 -0.668 6.986 14.063
155 HE2 MET 20 HE2 MET 20 -0.929 5.247 13.920
156 HE3 MET 20 HE3 MET 20 -2.223 6.370 13.502
157 H ILE 21 H ILE 21 -6.027 4.147 11.462
158 HA ILE 21 HA ILE 21 -7.371 6.631 10.614
159 HB ILE 21 HB ILE 21 -8.098 3.796 9.837
160 HG12 ILE 21 HG12 ILE 21 -6.453 5.860 8.356
161 HG13 ILE 21 HG13 ILE 21 -5.852 4.352 9.032
162 HG21 ILE 21 HG21 ILE 21 -9.382 4.870 8.058
163 HG22 ILE 21 HG22 ILE 21 -8.890 6.456 8.651
164 HG23 ILE 21 HG23 ILE 21 -9.922 5.426 9.643
165 HD11 ILE 21 HD11 ILE 21 -7.829 4.623 6.781
166 HD12 ILE 21 HD12 ILE 21 -7.249 3.105 7.466
167 HD13 ILE 21 HD13 ILE 21 -6.127 4.183 6.638
168 H ALA 22 H ALA 22 -7.040 5.333 13.335
169 HA ALA 22 HA ALA 22 -9.866 5.068 14.059
170 HB1 ALA 22 HB1 ALA 22 -7.402 4.696 15.758
171 HB2 ALA 22 HB2 ALA 22 -8.312 3.407 14.969
172 HB3 ALA 22 HB3 ALA 22 -9.063 4.365 16.246
173 H GLY 23 H GLY 23 -7.841 7.513 13.501
174 HA2 GLY 23 HA2 GLY 23 -8.984 9.160 15.661
175 HA3 GLY 23 HA3 GLY 23 -7.307 9.330 15.168
176 H ARG 24 H ARG 24 -10.577 10.105 14.496
177 HA ARG 24 HA ARG 24 -11.602 11.506 13.054
178 HB2 ARG 24 HB2 ARG 24 -8.837 12.665 13.027
179 HB3 ARG 24 HB3 ARG 24 -10.147 13.372 12.091
180 HG2 ARG 24 HG2 ARG 24 -10.093 13.001 15.077
181 HG3 ARG 24 HG3 ARG 24 -9.892 14.511 14.194
182 HD2 ARG 24 HD2 ARG 24 -12.352 12.784 14.242
183 HD3 ARG 24 HD3 ARG 24 -12.149 14.346 15.036
184 HE ARG 24 HE ARG 24 -11.667 14.998 12.494
185 HH11 ARG 24 HH11 ARG 24 -14.248 13.130 13.954
186 HH12 ARG 24 HH12 ARG 24 -15.389 13.498 12.698
187 HH21 ARG 24 HH21 ARG 24 -13.165 15.462 10.828
188 HH22 ARG 24 HH22 ARG 24 -14.780 14.817 10.923
189 H TRP 25 H TRP 25 -12.256 10.161 11.480
190 HA TRP 25 HA TRP 25 -10.796 10.341 8.972
191 HB2 TRP 25 HB2 TRP 25 -10.802 7.967 8.545
192 HB3 TRP 25 HB3 TRP 25 -10.009 8.247 10.081
193 HD1 TRP 25 HD1 TRP 25 -12.572 6.155 8.525
194 HE1 TRP 25 HE1 TRP 25 -13.926 4.865 10.291
195 HE3 TRP 25 HE3 TRP 25 -11.088 8.688 12.708
196 HZ2 TRP 25 HZ2 TRP 25 -14.323 4.919 13.079
197 HZ3 TRP 25 HZ3 TRP 25 -12.006 8.008 14.882
198 HH2 TRP 25 HH2 TRP 25 -13.593 6.162 15.063
199 H LYS 26 H LYS 26 -13.663 9.032 10.584
200 HA LYS 26 HA LYS 26 -15.826 8.793 10.012
201 HB2 LYS 26 HB2 LYS 26 -15.539 11.320 9.770
202 HB3 LYS 26 HB3 LYS 26 -15.475 11.038 8.035
203 HG2 LYS 26 HG2 LYS 26 -17.713 11.668 8.691
204 HG3 LYS 26 HG3 LYS 26 -17.701 9.989 8.141
205 HD2 LYS 26 HD2 LYS 26 -17.571 9.265 10.509
206 HD3 LYS 26 HD3 LYS 26 -17.709 10.953 11.002
207 HE2 LYS 26 HE2 LYS 26 -19.896 11.083 9.890
208 HE3 LYS 26 HE3 LYS 26 -19.754 9.391 9.423
209 HZ1 LYS 26 HZ1 LYS 26 -19.961 10.475 12.180
210 HZ2 LYS 26 HZ2 LYS 26 -19.624 8.851 11.826
211 HZ3 LYS 26 HZ3 LYS 26 -21.106 9.528 11.364
212 H HIS 27 H HIS 27 -16.762 7.260 8.870
213 HA HIS 27 HA HIS 27 -17.249 5.780 7.217
214 HB2 HIS 27 HB2 HIS 27 -16.126 8.002 5.560
215 HB3 HIS 27 HB3 HIS 27 -16.382 6.431 4.816
216 HD1 HIS 27 HD1 HIS 27 -18.078 9.538 5.576
217 HD2 HIS 27 HD2 HIS 27 -19.176 5.567 5.009
218 HE1 HIS 27 HE1 HIS 27 -20.534 9.577 5.055
219 HE2 HIS 27 HE2 HIS 27 -21.114 7.190 4.505
220 HA PRO 28 HA PRO 28 -13.007 4.075 7.676
221 HB2 PRO 28 HB2 PRO 28 -14.388 1.648 8.525
222 HB3 PRO 28 HB3 PRO 28 -13.245 2.643 9.425
223 HG2 PRO 28 HG2 PRO 28 -15.893 2.466 10.036
224 HG3 PRO 28 HG3 PRO 28 -14.892 3.884 10.400
225 HD2 PRO 28 HD2 PRO 28 -16.867 3.466 8.197
226 HD3 PRO 28 HD3 PRO 28 -16.509 4.933 9.131
227 H ASN 29 H ASN 29 -15.922 3.128 6.120
228 HA ASN 29 HA ASN 29 -14.882 0.861 4.710
229 HB2 ASN 29 HB2 ASN 29 -17.041 0.864 3.532
230 HB3 ASN 29 HB3 ASN 29 -17.251 0.957 5.275
231 HD21 ASN 29 HD21 ASN 29 -19.021 1.731 3.061
232 HD22 ASN 29 HD22 ASN 29 -19.406 3.401 3.330
233 H ILE 30 H ILE 30 -15.037 4.283 4.125
234 HA ILE 30 HA ILE 30 -14.736 4.161 1.302
235 HB ILE 30 HB ILE 30 -14.090 6.351 3.273
236 HG12 ILE 30 HG12 ILE 30 -16.305 5.966 1.250
237 HG13 ILE 30 HG13 ILE 30 -16.460 5.898 3.001
238 HG21 ILE 30 HG21 ILE 30 -12.590 6.550 1.348
239 HG22 ILE 30 HG22 ILE 30 -13.780 7.851 1.376
240 HG23 ILE 30 HG23 ILE 30 -13.981 6.499 0.262
241 HD11 ILE 30 HD11 ILE 30 -15.769 8.330 1.367
242 HD12 ILE 30 HD12 ILE 30 -15.872 8.278 3.127
243 HD13 ILE 30 HD13 ILE 30 -17.312 7.991 2.150
244 H VAL 31 H VAL 31 -12.418 4.554 3.967
245 HA VAL 31 HA VAL 31 -10.172 4.575 2.211
246 HB VAL 31 HB VAL 31 -10.138 5.673 4.437
247 HG11 VAL 31 HG11 VAL 31 -9.960 2.864 5.512
248 HG12 VAL 31 HG12 VAL 31 -11.319 3.968 5.718
249 HG13 VAL 31 HG13 VAL 31 -9.757 4.348 6.445
250 HG21 VAL 31 HG21 VAL 31 -7.845 4.968 5.025
251 HG22 VAL 31 HG22 VAL 31 -8.062 5.236 3.297
252 HG23 VAL 31 HG23 VAL 31 -8.015 3.591 3.936
253 H ARG 32 H ARG 32 -11.901 2.089 3.994
254 HA ARG 32 HA ARG 32 -10.062 -0.010 3.630
255 HB2 ARG 32 HB2 ARG 32 -12.771 0.274 4.527
256 HB3 ARG 32 HB3 ARG 32 -12.674 -1.083 3.413
257 HG2 ARG 32 HG2 ARG 32 -10.850 -0.741 5.780
258 HG3 ARG 32 HG3 ARG 32 -12.358 -1.652 5.826
259 HD2 ARG 32 HD2 ARG 32 -11.532 -3.160 4.113
260 HD3 ARG 32 HD3 ARG 32 -10.043 -2.227 3.973
261 HE ARG 32 HE ARG 32 -10.165 -2.932 6.612
262 HH11 ARG 32 HH11 ARG 32 -10.112 -4.668 3.567
263 HH12 ARG 32 HH12 ARG 32 -9.518 -6.144 4.281
264 HH21 ARG 32 HH21 ARG 32 -9.305 -4.850 7.531
265 HH22 ARG 32 HH22 ARG 32 -9.023 -6.228 6.519
266 H SER 33 H SER 33 -12.578 1.316 1.552
267 HA SER 33 HA SER 33 -12.347 -0.589 -0.519
268 HB2 SER 33 HB2 SER 33 -13.216 2.311 -0.649
269 HB3 SER 33 HB3 SER 33 -13.468 1.116 -1.922
270 HG SER 33 HG SER 33 -14.626 1.243 0.658
271 H ARG 34 H ARG 34 -10.484 2.239 0.343
272 HA ARG 34 HA ARG 34 -8.982 2.361 -2.090
273 HB2 ARG 34 HB2 ARG 34 -9.156 4.284 -0.555
274 HB3 ARG 34 HB3 ARG 34 -8.265 3.385 0.662
275 HG2 ARG 34 HG2 ARG 34 -6.320 3.315 -0.786
276 HG3 ARG 34 HG3 ARG 34 -7.212 4.174 -2.045
277 HD2 ARG 34 HD2 ARG 34 -7.472 6.086 -0.545
278 HD3 ARG 34 HD3 ARG 34 -6.572 5.228 0.705
279 HE ARG 34 HE ARG 34 -5.062 5.379 -1.690
280 HH11 ARG 34 HH11 ARG 34 -6.165 7.336 0.991
281 HH12 ARG 34 HH12 ARG 34 -4.781 8.391 0.966
282 HH21 ARG 34 HH21 ARG 34 -3.240 6.760 -1.755
283 HH22 ARG 34 HH22 ARG 34 -3.127 8.084 -0.617
284 H ILE 35 H ILE 35 -8.477 0.902 1.094
285 HA ILE 35 HA ILE 35 -5.926 -0.128 0.682
286 HB ILE 35 HB ILE 35 -8.165 -1.445 2.237
287 HG12 ILE 35 HG12 ILE 35 -6.082 0.541 3.174
288 HG13 ILE 35 HG13 ILE 35 -7.777 0.919 2.892
289 HG21 ILE 35 HG21 ILE 35 -6.271 -2.926 1.869
290 HG22 ILE 35 HG22 ILE 35 -6.355 -2.437 3.562
291 HG23 ILE 35 HG23 ILE 35 -5.170 -1.696 2.487
292 HD11 ILE 35 HD11 ILE 35 -8.418 -0.637 4.659
293 HD12 ILE 35 HD12 ILE 35 -7.329 0.616 5.257
294 HD13 ILE 35 HD13 ILE 35 -6.718 -1.010 4.946
295 H GLU 36 H GLU 36 -9.075 -1.562 0.060
296 HA GLU 36 HA GLU 36 -8.265 -4.030 -0.997
297 HB2 GLU 36 HB2 GLU 36 -10.727 -2.349 -1.027
298 HB3 GLU 36 HB3 GLU 36 -10.638 -3.660 -2.187
299 HG2 GLU 36 HG2 GLU 36 -11.578 -3.817 0.380
300 HG3 GLU 36 HG3 GLU 36 -11.138 -5.166 -0.645
301 H LYS 37 H LYS 37 -8.198 -0.886 -2.453
302 HA LYS 37 HA LYS 37 -8.221 -2.068 -5.139
303 HB2 LYS 37 HB2 LYS 37 -10.023 -0.554 -4.910
304 HB3 LYS 37 HB3 LYS 37 -9.017 0.645 -4.118
305 HG2 LYS 37 HG2 LYS 37 -8.159 -0.038 -6.829
306 HG3 LYS 37 HG3 LYS 37 -9.759 0.698 -6.723
307 HD2 LYS 37 HD2 LYS 37 -7.241 1.821 -5.503
308 HD3 LYS 37 HD3 LYS 37 -7.971 2.365 -7.009
309 HE2 LYS 37 HE2 LYS 37 -9.984 3.036 -5.821
310 HE3 LYS 37 HE3 LYS 37 -9.313 2.428 -4.309
311 HZ1 LYS 37 HZ1 LYS 37 -8.347 4.731 -5.911
312 HZ2 LYS 37 HZ2 LYS 37 -7.470 4.055 -4.622
313 HZ3 LYS 37 HZ3 LYS 37 -8.991 4.760 -4.342
314 H ASP 38 H ASP 38 -6.542 0.292 -3.108
315 HA ASP 38 HA ASP 38 -4.539 0.866 -5.107
316 HB2 ASP 38 HB2 ASP 38 -5.077 1.757 -2.298
317 HB3 ASP 38 HB3 ASP 38 -3.478 2.009 -2.971
318 H ILE 39 H ILE 39 -4.387 -0.452 -1.810
319 HA ILE 39 HA ILE 39 -1.623 -1.141 -2.121
320 HB ILE 39 HB ILE 39 -3.512 -1.804 0.141
321 HG12 ILE 39 HG12 ILE 39 -1.565 0.495 -0.147
322 HG13 ILE 39 HG13 ILE 39 -3.315 0.621 -0.285
323 HG21 ILE 39 HG21 ILE 39 -1.547 -3.225 0.145
324 HG22 ILE 39 HG22 ILE 39 -1.468 -2.069 1.474
325 HG23 ILE 39 HG23 ILE 39 -0.498 -1.812 0.022
326 HD11 ILE 39 HD11 ILE 39 -1.772 -0.169 2.175
327 HD12 ILE 39 HD12 ILE 39 -3.531 -0.112 2.046
328 HD13 ILE 39 HD13 ILE 39 -2.586 1.369 1.887
329 H LYS 40 H LYS 40 -4.608 -3.025 -1.635
330 HA LYS 40 HA LYS 40 -3.141 -5.380 -2.589
331 HB2 LYS 40 HB2 LYS 40 -4.797 -6.518 -0.770
332 HB3 LYS 40 HB3 LYS 40 -3.132 -6.076 -0.449
333 HG2 LYS 40 HG2 LYS 40 -3.908 -4.889 1.257
334 HG3 LYS 40 HG3 LYS 40 -4.505 -3.747 0.056
335 HD2 LYS 40 HD2 LYS 40 -6.341 -4.221 1.444
336 HD3 LYS 40 HD3 LYS 40 -6.610 -5.158 -0.027
337 HE2 LYS 40 HE2 LYS 40 -5.976 -7.168 1.022
338 HE3 LYS 40 HE3 LYS 40 -5.271 -6.320 2.396
339 HZ1 LYS 40 HZ1 LYS 40 -7.474 -5.617 3.054
340 HZ2 LYS 40 HZ2 LYS 40 -7.414 -7.300 2.942
341 HZ3 LYS 40 HZ3 LYS 40 -8.161 -6.391 1.716
342 HA PRO 41 HA PRO 41 -7.164 -5.128 -4.858
343 HB2 PRO 41 HB2 PRO 41 -6.074 -5.422 -7.335
344 HB3 PRO 41 HB3 PRO 41 -6.333 -3.852 -6.566
345 HG2 PRO 41 HG2 PRO 41 -3.824 -5.441 -6.836
346 HG3 PRO 41 HG3 PRO 41 -4.060 -3.686 -6.921
347 HD2 PRO 41 HD2 PRO 41 -3.083 -4.997 -4.721
348 HD3 PRO 41 HD3 PRO 41 -3.929 -3.439 -4.654
349 H ALA 42 H ALA 42 -4.343 -7.103 -5.837
350 HA ALA 42 HA ALA 42 -5.935 -9.496 -5.332
351 HB1 ALA 42 HB1 ALA 42 -5.334 -10.493 -7.478
352 HB2 ALA 42 HB2 ALA 42 -4.514 -9.003 -7.946
353 HB3 ALA 42 HB3 ALA 42 -6.261 -9.010 -7.703
354 H ILE 43 H ILE 43 -3.363 -7.950 -4.462
355 HA ILE 43 HA ILE 43 -1.521 -10.238 -4.616
356 HB ILE 43 HB ILE 43 0.233 -8.547 -3.938
357 HG12 ILE 43 HG12 ILE 43 -1.822 -6.529 -4.835
358 HG13 ILE 43 HG13 ILE 43 -1.512 -6.879 -3.138
359 HG21 ILE 43 HG21 ILE 43 0.480 -7.659 -6.210
360 HG22 ILE 43 HG22 ILE 43 -1.178 -8.142 -6.571
361 HG23 ILE 43 HG23 ILE 43 0.040 -9.366 -6.215
362 HD11 ILE 43 HD11 ILE 43 -0.323 -4.888 -3.886
363 HD12 ILE 43 HD12 ILE 43 0.500 -5.837 -5.125
364 HD13 ILE 43 HD13 ILE 43 0.804 -6.162 -3.417
365 H GLY 44 H GLY 44 -3.823 -9.442 -2.685
366 HA2 GLY 44 HA2 GLY 44 -2.621 -8.910 -0.168
367 HA3 GLY 44 HA3 GLY 44 -4.251 -9.506 -0.433
368 H SER 45 H SER 45 -2.833 -11.770 -2.017
369 HA SER 45 HA SER 45 -2.643 -13.585 0.205
370 HB2 SER 45 HB2 SER 45 -2.026 -14.101 -2.714
371 HB3 SER 45 HB3 SER 45 -2.379 -15.306 -1.476
372 HG SER 45 HG SER 45 -4.475 -14.146 -1.276
373 H LEU 46 H LEU 46 -0.530 -11.485 -1.326
374 HA LEU 46 HA LEU 46 1.832 -13.146 -1.025
375 HB2 LEU 46 HB2 LEU 46 1.365 -10.387 -2.135
376 HB3 LEU 46 HB3 LEU 46 2.981 -10.993 -1.837
377 HG LEU 46 HG LEU 46 2.522 -12.874 -3.400
378 HD11 LEU 46 HD11 LEU 46 -0.015 -11.349 -3.968
379 HD12 LEU 46 HD12 LEU 46 0.109 -12.972 -3.285
380 HD13 LEU 46 HD13 LEU 46 0.621 -12.670 -4.946
381 HD21 LEU 46 HD21 LEU 46 3.707 -10.878 -4.129
382 HD22 LEU 46 HD22 LEU 46 2.174 -10.113 -4.549
383 HD23 LEU 46 HD23 LEU 46 2.718 -11.543 -5.429
384 H LYS 47 H LYS 47 3.340 -12.939 0.526
385 HA LYS 47 HA LYS 47 2.584 -11.477 2.892
386 HB2 LYS 47 HB2 LYS 47 4.972 -13.225 2.299
387 HB3 LYS 47 HB3 LYS 47 4.646 -12.495 3.865
388 HG2 LYS 47 HG2 LYS 47 2.560 -13.732 4.022
389 HG3 LYS 47 HG3 LYS 47 2.855 -14.444 2.436
390 HD2 LYS 47 HD2 LYS 47 4.566 -14.793 4.894
391 HD3 LYS 47 HD3 LYS 47 3.473 -15.990 4.202
392 HE2 LYS 47 HE2 LYS 47 4.869 -15.686 2.053
393 HE3 LYS 47 HE3 LYS 47 6.061 -14.946 3.118
394 HZ1 LYS 47 HZ1 LYS 47 6.054 -16.993 4.447
395 HZ2 LYS 47 HZ2 LYS 47 6.538 -17.276 2.847
396 HZ3 LYS 47 HZ3 LYS 47 4.976 -17.699 3.343
397 H VAL 48 H VAL 48 4.678 -10.533 4.093
398 HA VAL 48 HA VAL 48 5.126 -8.077 2.725
399 HB VAL 48 HB VAL 48 6.679 -8.987 5.138
400 HG11 VAL 48 HG11 VAL 48 7.377 -6.891 4.105
401 HG12 VAL 48 HG12 VAL 48 6.667 -6.612 5.696
402 HG13 VAL 48 HG13 VAL 48 5.732 -6.272 4.240
403 HG21 VAL 48 HG21 VAL 48 3.894 -7.832 5.098
404 HG22 VAL 48 HG22 VAL 48 4.876 -8.097 6.538
405 HG23 VAL 48 HG23 VAL 48 4.333 -9.471 5.575
406 H GLU 49 H GLU 49 6.924 -11.021 3.025
407 HA GLU 49 HA GLU 49 9.398 -9.936 2.021
408 HB2 GLU 49 HB2 GLU 49 8.437 -12.763 2.488
409 HB3 GLU 49 HB3 GLU 49 10.032 -12.379 1.860
410 HG2 GLU 49 HG2 GLU 49 9.011 -11.359 4.497
411 HG3 GLU 49 HG3 GLU 49 9.911 -12.865 4.314
412 H ASP 50 H ASP 50 6.453 -10.885 0.665
413 HA ASP 50 HA ASP 50 7.709 -11.764 -1.846
414 HB2 ASP 50 HB2 ASP 50 6.202 -13.374 -0.628
415 HB3 ASP 50 HB3 ASP 50 4.868 -12.279 -0.968
416 H VAL 51 H VAL 51 6.003 -9.191 -0.461
417 HA VAL 51 HA VAL 51 4.905 -8.254 -2.963
418 HB VAL 51 HB VAL 51 3.689 -7.634 -0.988
419 HG11 VAL 51 HG11 VAL 51 5.497 -7.701 0.640
420 HG12 VAL 51 HG12 VAL 51 4.588 -6.195 0.754
421 HG13 VAL 51 HG13 VAL 51 6.166 -6.213 -0.032
422 HG21 VAL 51 HG21 VAL 51 3.555 -5.202 -1.260
423 HG22 VAL 51 HG22 VAL 51 3.653 -6.033 -2.813
424 HG23 VAL 51 HG23 VAL 51 5.075 -5.223 -2.155
425 H LYS 52 H LYS 52 6.623 -8.222 -4.309
426 HA LYS 52 HA LYS 52 9.039 -6.788 -3.559
427 HB2 LYS 52 HB2 LYS 52 8.608 -8.334 -6.111
428 HB3 LYS 52 HB3 LYS 52 10.114 -8.035 -5.244
429 HG2 LYS 52 HG2 LYS 52 9.170 -9.414 -3.366
430 HG3 LYS 52 HG3 LYS 52 7.866 -9.863 -4.450
431 HD2 LYS 52 HD2 LYS 52 9.490 -10.842 -5.991
432 HD3 LYS 52 HD3 LYS 52 10.801 -10.396 -4.893
433 HE2 LYS 52 HE2 LYS 52 9.784 -11.774 -3.134
434 HE3 LYS 52 HE3 LYS 52 8.495 -12.231 -4.242
435 HZ1 LYS 52 HZ1 LYS 52 10.096 -13.970 -4.164
436 HZ2 LYS 52 HZ2 LYS 52 11.376 -12.902 -4.478
437 HZ3 LYS 52 HZ3 LYS 52 10.224 -13.226 -5.683
438 HA PRO 53 HA PRO 53 8.897 -2.986 -5.619
439 HB2 PRO 53 HB2 PRO 53 10.678 -4.138 -7.737
440 HB3 PRO 53 HB3 PRO 53 10.775 -2.572 -6.921
441 HG2 PRO 53 HG2 PRO 53 12.324 -4.601 -6.163
442 HG3 PRO 53 HG3 PRO 53 11.624 -3.491 -4.970
443 HD2 PRO 53 HD2 PRO 53 10.938 -6.304 -5.553
444 HD3 PRO 53 HD3 PRO 53 10.697 -5.367 -4.067
445 H ARG 54 H ARG 54 8.827 -5.525 -8.177
446 HA ARG 54 HA ARG 54 7.625 -3.838 -10.082
447 HB2 ARG 54 HB2 ARG 54 7.265 -5.782 -11.435
448 HB3 ARG 54 HB3 ARG 54 8.824 -5.932 -10.641
449 HG2 ARG 54 HG2 ARG 54 7.959 -7.520 -9.088
450 HG3 ARG 54 HG3 ARG 54 6.311 -7.253 -9.661
451 HD2 ARG 54 HD2 ARG 54 7.108 -9.289 -10.620
452 HD3 ARG 54 HD3 ARG 54 7.027 -8.077 -11.897
453 HE ARG 54 HE ARG 54 9.566 -8.708 -10.546
454 HH11 ARG 54 HH11 ARG 54 7.687 -8.238 -13.453
455 HH12 ARG 54 HH12 ARG 54 9.001 -8.636 -14.526
456 HH21 ARG 54 HH21 ARG 54 11.303 -9.191 -11.920
457 HH22 ARG 54 HH22 ARG 54 11.068 -9.196 -13.645
458 H HIS 55 H HIS 55 6.220 -5.644 -7.468
459 HA HIS 55 HA HIS 55 3.551 -5.705 -8.498
460 HB2 HIS 55 HB2 HIS 55 4.310 -5.651 -5.574
461 HB3 HIS 55 HB3 HIS 55 2.824 -6.266 -6.275
462 HD1 HIS 55 HD1 HIS 55 4.932 -7.794 -8.506
463 HD2 HIS 55 HD2 HIS 55 4.420 -8.269 -4.405
464 HE1 HIS 55 HE1 HIS 55 5.967 -10.024 -7.935
465 HE2 HIS 55 HE2 HIS 55 5.591 -10.313 -5.462
466 H ILE 56 H ILE 56 5.469 -3.468 -6.623
467 HA ILE 56 HA ILE 56 3.389 -1.683 -5.892
468 HB ILE 56 HB ILE 56 6.341 -1.103 -6.215
469 HG12 ILE 56 HG12 ILE 56 5.995 -2.970 -4.685
470 HG13 ILE 56 HG13 ILE 56 6.491 -1.539 -3.789
471 HG21 ILE 56 HG21 ILE 56 4.211 0.344 -4.646
472 HG22 ILE 56 HG22 ILE 56 5.024 0.924 -6.099
473 HG23 ILE 56 HG23 ILE 56 5.936 0.708 -4.605
474 HD11 ILE 56 HD11 ILE 56 3.669 -2.564 -4.028
475 HD12 ILE 56 HD12 ILE 56 4.194 -1.161 -3.095
476 HD13 ILE 56 HD13 ILE 56 4.735 -2.775 -2.639
477 H ASP 57 H ASP 57 5.615 -1.883 -8.616
478 HA ASP 57 HA ASP 57 4.875 0.535 -9.867
479 HB2 ASP 57 HB2 ASP 57 6.873 -0.594 -10.596
480 HB3 ASP 57 HB3 ASP 57 5.972 -2.054 -10.988
481 H ASP 58 H ASP 58 3.671 -2.773 -10.151
482 HA ASP 58 HA ASP 58 1.794 -2.300 -12.170
483 HB2 ASP 58 HB2 ASP 58 2.012 -4.397 -10.043
484 HB3 ASP 58 HB3 ASP 58 0.587 -4.325 -11.076
485 H VAL 59 H VAL 59 1.365 -2.244 -8.622
486 HA VAL 59 HA VAL 59 -1.409 -1.726 -8.781
487 HB VAL 59 HB VAL 59 -1.294 -1.054 -6.407
488 HG11 VAL 59 HG11 VAL 59 -1.541 -3.388 -6.998
489 HG12 VAL 59 HG12 VAL 59 -0.556 -3.227 -5.544
490 HG13 VAL 59 HG13 VAL 59 0.209 -3.574 -7.096
491 HG21 VAL 59 HG21 VAL 59 0.794 -1.201 -5.173
492 HG22 VAL 59 HG22 VAL 59 0.895 0.042 -6.420
493 HG23 VAL 59 HG23 VAL 59 1.674 -1.521 -6.668
494 H LEU 60 H LEU 60 1.381 0.456 -8.469
495 HA LEU 60 HA LEU 60 -0.159 2.833 -8.232
496 HB2 LEU 60 HB2 LEU 60 2.674 2.387 -9.193
497 HB3 LEU 60 HB3 LEU 60 1.974 3.969 -8.923
498 HG LEU 60 HG LEU 60 2.455 1.845 -6.833
499 HD11 LEU 60 HD11 LEU 60 4.483 2.969 -7.587
500 HD12 LEU 60 HD12 LEU 60 4.075 3.435 -5.937
501 HD13 LEU 60 HD13 LEU 60 3.740 4.538 -7.273
502 HD21 LEU 60 HD21 LEU 60 1.309 4.621 -6.517
503 HD22 LEU 60 HD22 LEU 60 1.695 3.500 -5.211
504 HD23 LEU 60 HD23 LEU 60 0.413 3.111 -6.357
505 H LYS 61 H LYS 61 1.175 1.084 -10.978
506 HA LYS 61 HA LYS 61 0.442 2.977 -12.948
507 HB2 LYS 61 HB2 LYS 61 2.104 1.448 -13.555
508 HB3 LYS 61 HB3 LYS 61 1.202 0.074 -12.946
509 HG2 LYS 61 HG2 LYS 61 0.031 1.534 -15.234
510 HG3 LYS 61 HG3 LYS 61 1.496 0.596 -15.536
511 HD2 LYS 61 HD2 LYS 61 -1.121 -0.398 -14.413
512 HD3 LYS 61 HD3 LYS 61 -0.398 -0.808 -15.965
513 HE2 LYS 61 HE2 LYS 61 0.754 -1.483 -13.259
514 HE3 LYS 61 HE3 LYS 61 -0.120 -2.601 -14.303
515 HZ1 LYS 61 HZ1 LYS 61 2.333 -2.799 -14.413
516 HZ2 LYS 61 HZ2 LYS 61 2.405 -1.242 -15.089
517 HZ3 LYS 61 HZ3 LYS 61 1.609 -2.489 -15.913
518 H ALA 62 H ALA 62 -1.271 0.361 -11.370
519 HA ALA 62 HA ALA 62 -3.497 0.428 -13.186
520 HB1 ALA 62 HB1 ALA 62 -4.550 -1.128 -11.658
521 HB2 ALA 62 HB2 ALA 62 -3.328 -0.794 -10.432
522 HB3 ALA 62 HB3 ALA 62 -2.873 -1.604 -11.932
523 H VAL 63 H VAL 63 -2.778 1.812 -9.988
524 HA VAL 63 HA VAL 63 -5.431 2.796 -9.611
525 HB VAL 63 HB VAL 63 -4.522 4.120 -7.745
526 HG11 VAL 63 HG11 VAL 63 -5.202 1.824 -7.382
527 HG12 VAL 63 HG12 VAL 63 -3.822 2.230 -6.361
528 HG13 VAL 63 HG13 VAL 63 -3.589 1.260 -7.816
529 HG21 VAL 63 HG21 VAL 63 -2.354 4.700 -8.674
530 HG22 VAL 63 HG22 VAL 63 -1.850 3.013 -8.583
531 HG23 VAL 63 HG23 VAL 63 -2.175 3.918 -7.103
532 H MET 64 H MET 64 -2.619 4.042 -11.238
533 HA MET 64 HA MET 64 -3.540 6.759 -11.234
534 HB2 MET 64 HB2 MET 64 -1.688 7.233 -12.731
535 HB3 MET 64 HB3 MET 64 -1.143 6.231 -11.398
536 HG2 MET 64 HG2 MET 64 -0.068 5.325 -13.224
537 HG3 MET 64 HG3 MET 64 -1.461 4.268 -13.021
538 HE1 MET 64 HE1 MET 64 0.063 7.251 -15.082
539 HE2 MET 64 HE2 MET 64 -1.480 7.906 -14.533
540 HE3 MET 64 HE3 MET 64 -1.224 7.567 -16.245
541 H LYS 65 H LYS 65 -4.096 3.980 -13.218
542 HA LYS 65 HA LYS 65 -5.108 5.585 -15.415
543 HB2 LYS 65 HB2 LYS 65 -5.443 3.488 -16.587
544 HB3 LYS 65 HB3 LYS 65 -3.827 3.567 -15.918
545 HG2 LYS 65 HG2 LYS 65 -4.412 2.054 -14.161
546 HG3 LYS 65 HG3 LYS 65 -6.106 2.069 -14.659
547 HD2 LYS 65 HD2 LYS 65 -4.935 0.055 -15.434
548 HD3 LYS 65 HD3 LYS 65 -5.522 1.038 -16.774
549 HE2 LYS 65 HE2 LYS 65 -3.276 1.984 -17.053
550 HE3 LYS 65 HE3 LYS 65 -2.695 0.986 -15.721
551 HZ1 LYS 65 HZ1 LYS 65 -3.857 -0.062 -18.246
552 HZ2 LYS 65 HZ2 LYS 65 -3.192 -0.985 -16.988
553 HZ3 LYS 65 HZ3 LYS 65 -2.197 0.034 -17.909
554 H ARG 66 H ARG 66 -6.328 3.462 -12.892
555 HA ARG 66 HA ARG 66 -9.051 3.677 -13.807
556 HB2 ARG 66 HB2 ARG 66 -9.656 2.437 -11.806
557 HB3 ARG 66 HB3 ARG 66 -8.290 1.672 -12.601
558 HG2 ARG 66 HG2 ARG 66 -6.843 2.171 -10.915
559 HG3 ARG 66 HG3 ARG 66 -7.724 3.625 -10.443
560 HD2 ARG 66 HD2 ARG 66 -7.914 1.877 -8.749
561 HD3 ARG 66 HD3 ARG 66 -9.478 2.267 -9.457
562 HE ARG 66 HE ARG 66 -7.920 -0.119 -10.224
563 HH11 ARG 66 HH11 ARG 66 -10.930 1.461 -9.377
564 HH12 ARG 66 HH12 ARG 66 -11.891 0.024 -9.580
565 HH21 ARG 66 HH21 ARG 66 -9.174 -2.031 -10.424
566 HH22 ARG 66 HH22 ARG 66 -10.893 -1.960 -10.133
567 H GLY 67 H GLY 67 -6.989 5.542 -11.799
568 HA2 GLY 67 HA2 GLY 67 -9.320 7.121 -10.922
569 HA3 GLY 67 HA3 GLY 67 -8.020 6.730 -9.809
570 H ALA 68 H ALA 68 -5.966 7.681 -10.116
571 HA ALA 68 HA ALA 68 -5.494 9.686 -12.089
572 HB1 ALA 68 HB1 ALA 68 -5.517 11.640 -10.626
573 HB2 ALA 68 HB2 ALA 68 -6.114 10.651 -9.293
574 HB3 ALA 68 HB3 ALA 68 -7.119 10.913 -10.719
575 HA PRO 69 HA PRO 69 -1.403 8.715 -10.928
576 HB2 PRO 69 HB2 PRO 69 -0.595 11.414 -11.770
577 HB3 PRO 69 HB3 PRO 69 -0.175 9.845 -12.454
578 HG2 PRO 69 HG2 PRO 69 -1.821 11.554 -13.720
579 HG3 PRO 69 HG3 PRO 69 -2.001 9.795 -13.841
580 HD2 PRO 69 HD2 PRO 69 -3.545 11.755 -12.198
581 HD3 PRO 69 HD3 PRO 69 -4.115 10.325 -13.084
582 H SER 70 H SER 70 -2.811 11.730 -9.845
583 HA SER 70 HA SER 70 -0.868 12.448 -7.936
584 HB2 SER 70 HB2 SER 70 -3.835 13.048 -7.865
585 HB3 SER 70 HB3 SER 70 -2.551 13.961 -7.071
586 HG SER 70 HG SER 70 -2.840 15.081 -8.889
587 H ILE 71 H ILE 71 -3.489 10.151 -7.900
588 HA ILE 71 HA ILE 71 -3.623 9.818 -5.073
589 HB ILE 71 HB ILE 71 -4.435 7.869 -7.246
590 HG12 ILE 71 HG12 ILE 71 -6.093 9.902 -5.731
591 HG13 ILE 71 HG13 ILE 71 -5.565 10.073 -7.401
592 HG21 ILE 71 HG21 ILE 71 -5.855 6.859 -5.532
593 HG22 ILE 71 HG22 ILE 71 -5.239 8.001 -4.336
594 HG23 ILE 71 HG23 ILE 71 -4.158 6.807 -5.056
595 HD11 ILE 71 HD11 ILE 71 -7.416 7.956 -6.332
596 HD12 ILE 71 HD12 ILE 71 -6.869 8.091 -8.002
597 HD13 ILE 71 HD13 ILE 71 -7.871 9.362 -7.298
598 H ALA 72 H ALA 72 -1.926 8.175 -7.693
599 HA ALA 72 HA ALA 72 -0.741 6.121 -6.210
600 HB1 ALA 72 HB1 ALA 72 0.839 5.924 -8.046
601 HB2 ALA 72 HB2 ALA 72 0.361 7.512 -8.648
602 HB3 ALA 72 HB3 ALA 72 -0.792 6.178 -8.661
603 H ASN 73 H ASN 73 0.195 9.468 -6.697
604 HA ASN 73 HA ASN 73 2.796 9.361 -5.658
605 HB2 ASN 73 HB2 ASN 73 2.033 11.260 -6.923
606 HB3 ASN 73 HB3 ASN 73 0.738 11.569 -5.776
607 HD21 ASN 73 HD21 ASN 73 1.324 13.604 -5.323
608 HD22 ASN 73 HD22 ASN 73 2.767 14.012 -4.467
609 H ASP 74 H ASP 74 -0.313 10.111 -4.120
610 HA ASP 74 HA ASP 74 0.779 10.487 -1.523
611 HB2 ASP 74 HB2 ASP 74 -1.348 11.497 -2.128
612 HB3 ASP 74 HB3 ASP 74 -2.054 9.906 -2.407
613 H THR 75 H THR 75 -0.824 7.760 -3.131
614 HA THR 75 HA THR 75 -0.864 6.022 -0.934
615 HB THR 75 HB THR 75 -0.681 5.337 -3.877
616 HG1 THR 75 HG1 THR 75 -2.998 5.096 -3.605
617 HG21 THR 75 HG21 THR 75 -1.554 3.638 -1.532
618 HG22 THR 75 HG22 THR 75 -0.096 3.405 -2.496
619 HG23 THR 75 HG23 THR 75 -1.683 3.183 -3.233
620 H LEU 76 H LEU 76 1.696 6.771 -3.242
621 HA LEU 76 HA LEU 76 3.471 4.700 -2.593
622 HB2 LEU 76 HB2 LEU 76 3.667 6.345 -4.491
623 HB3 LEU 76 HB3 LEU 76 4.212 7.536 -3.329
624 HG LEU 76 HG LEU 76 5.692 4.940 -3.602
625 HD11 LEU 76 HD11 LEU 76 7.115 5.947 -5.301
626 HD12 LEU 76 HD12 LEU 76 6.080 7.375 -5.337
627 HD13 LEU 76 HD13 LEU 76 5.451 5.816 -5.874
628 HD21 LEU 76 HD21 LEU 76 6.536 7.747 -2.886
629 HD22 LEU 76 HD22 LEU 76 7.589 6.333 -2.931
630 HD23 LEU 76 HD23 LEU 76 6.280 6.420 -1.752
631 H ARG 77 H ARG 77 2.992 7.893 -1.131
632 HA ARG 77 HA ARG 77 5.016 7.675 0.837
633 HB2 ARG 77 HB2 ARG 77 2.417 9.220 0.972
634 HB3 ARG 77 HB3 ARG 77 3.823 9.480 1.993
635 HG2 ARG 77 HG2 ARG 77 5.116 10.201 0.076
636 HG3 ARG 77 HG3 ARG 77 3.746 9.875 -0.991
637 HD2 ARG 77 HD2 ARG 77 2.415 11.523 0.284
638 HD3 ARG 77 HD3 ARG 77 3.843 11.892 1.248
639 HE ARG 77 HE ARG 77 4.768 12.376 -1.185
640 HH11 ARG 77 HH11 ARG 77 1.715 13.250 0.272
641 HH12 ARG 77 HH12 ARG 77 1.522 14.695 -0.677
642 HH21 ARG 77 HH21 ARG 77 4.546 14.260 -2.437
643 HH22 ARG 77 HH22 ARG 77 3.155 15.277 -2.217
644 H TRP 78 H TRP 78 1.584 6.890 0.795
645 HA TRP 78 HA TRP 78 1.238 6.086 3.445
646 HB2 TRP 78 HB2 TRP 78 -0.530 6.454 1.665
647 HB3 TRP 78 HB3 TRP 78 -0.113 4.871 1.025
648 HD1 TRP 78 HD1 TRP 78 -0.831 2.723 2.514
649 HE1 TRP 78 HE1 TRP 78 -2.670 2.454 4.294
650 HE3 TRP 78 HE3 TRP 78 -1.705 7.662 3.538
651 HZ2 TRP 78 HZ2 TRP 78 -4.271 4.117 5.924
652 HZ3 TRP 78 HZ3 TRP 78 -3.403 8.234 5.224
653 HH2 TRP 78 HH2 TRP 78 -4.660 6.496 6.393
654 H LEU 79 H LEU 79 2.181 4.202 0.584
655 HA LEU 79 HA LEU 79 2.397 1.700 1.826
656 HB2 LEU 79 HB2 LEU 79 3.932 2.797 -0.530
657 HB3 LEU 79 HB3 LEU 79 3.876 1.107 -0.070
658 HG LEU 79 HG LEU 79 1.510 2.753 -0.965
659 HD11 LEU 79 HD11 LEU 79 1.586 1.365 -2.982
660 HD12 LEU 79 HD12 LEU 79 3.072 0.610 -2.401
661 HD13 LEU 79 HD13 LEU 79 3.050 2.329 -2.793
662 HD21 LEU 79 HD21 LEU 79 1.750 -0.180 -0.308
663 HD22 LEU 79 HD22 LEU 79 0.334 0.592 -1.022
664 HD23 LEU 79 HD23 LEU 79 0.852 1.031 0.606
665 H LYS 80 H LYS 80 4.749 4.326 1.468
666 HA LYS 80 HA LYS 80 6.971 2.874 2.398
667 HB2 LYS 80 HB2 LYS 80 7.288 4.899 1.131
668 HB3 LYS 80 HB3 LYS 80 6.385 5.837 2.309
669 HG2 LYS 80 HG2 LYS 80 8.818 4.408 3.228
670 HG3 LYS 80 HG3 LYS 80 9.014 5.860 2.243
671 HD2 LYS 80 HD2 LYS 80 7.289 5.747 4.709
672 HD3 LYS 80 HD3 LYS 80 8.979 6.229 4.729
673 HE2 LYS 80 HE2 LYS 80 6.892 7.558 3.018
674 HE3 LYS 80 HE3 LYS 80 7.327 8.116 4.632
675 HZ1 LYS 80 HZ1 LYS 80 9.131 7.943 2.275
676 HZ2 LYS 80 HZ2 LYS 80 9.631 8.360 3.840
677 HZ3 LYS 80 HZ3 LYS 80 8.547 9.361 3.005
678 H ARG 81 H ARG 81 4.564 4.907 4.018
679 HA ARG 81 HA ARG 81 5.704 4.793 6.600
680 HB2 ARG 81 HB2 ARG 81 2.799 5.105 5.806
681 HB3 ARG 81 HB3 ARG 81 3.438 5.364 7.420
682 HG2 ARG 81 HG2 ARG 81 4.771 7.222 6.645
683 HG3 ARG 81 HG3 ARG 81 4.247 6.935 4.981
684 HD2 ARG 81 HD2 ARG 81 1.984 7.482 5.531
685 HD3 ARG 81 HD3 ARG 81 2.359 7.530 7.252
686 HE ARG 81 HE ARG 81 3.965 9.426 5.948
687 HH11 ARG 81 HH11 ARG 81 0.579 8.852 6.630
688 HH12 ARG 81 HH12 ARG 81 0.167 10.538 6.726
689 HH21 ARG 81 HH21 ARG 81 3.446 11.651 6.127
690 HH22 ARG 81 HH22 ARG 81 1.809 12.130 6.470
691 H MET 82 H MET 82 3.501 2.684 4.867
692 HA MET 82 HA MET 82 2.893 0.972 7.044
693 HB2 MET 82 HB2 MET 82 1.505 1.126 5.015
694 HB3 MET 82 HB3 MET 82 2.804 0.402 4.076
695 HG2 MET 82 HG2 MET 82 2.619 -1.637 5.421
696 HG3 MET 82 HG3 MET 82 1.294 -0.910 6.329
697 HE1 MET 82 HE1 MET 82 2.051 -0.611 2.470
698 HE2 MET 82 HE2 MET 82 1.095 -1.949 1.835
699 HE3 MET 82 HE3 MET 82 2.492 -2.274 2.859
700 H PHE 83 H PHE 83 5.263 0.730 4.387
701 HA PHE 83 HA PHE 83 6.346 -1.745 5.230
702 HB2 PHE 83 HB2 PHE 83 7.498 0.471 3.533
703 HB3 PHE 83 HB3 PHE 83 8.360 -1.028 3.857
704 HD1 PHE 83 HD1 PHE 83 6.369 -3.082 3.642
705 HD2 PHE 83 HD2 PHE 83 6.817 0.468 1.333
706 HE1 PHE 83 HE1 PHE 83 5.221 -4.166 1.751
707 HE2 PHE 83 HE2 PHE 83 5.673 -0.611 -0.556
708 HZ PHE 83 HZ PHE 83 4.872 -2.931 -0.349
709 H ASN 84 H ASN 84 7.210 1.603 5.931
710 HA ASN 84 HA ASN 84 9.453 1.118 7.545
711 HB2 ASN 84 HB2 ASN 84 8.965 3.363 6.834
712 HB3 ASN 84 HB3 ASN 84 7.386 3.324 7.611
713 HD21 ASN 84 HD21 ASN 84 10.803 3.615 8.077
714 HD22 ASN 84 HD22 ASN 84 10.734 4.159 9.715
715 H TYR 85 H TYR 85 6.041 1.382 8.332
716 HA TYR 85 HA TYR 85 6.082 0.961 11.065
717 HB2 TYR 85 HB2 TYR 85 4.099 1.509 9.576
718 HB3 TYR 85 HB3 TYR 85 4.023 -0.203 9.186
719 HD1 TYR 85 HD2 TYR 85 3.872 2.189 12.011
720 HD2 TYR 85 HD1 TYR 85 2.846 -1.686 10.595
721 HE1 TYR 85 HE2 TYR 85 2.479 1.843 14.000
722 HE2 TYR 85 HE1 TYR 85 1.449 -2.049 12.591
723 HH TYR 85 HH TYR 85 0.716 0.539 14.798
724 H ALA 86 H ALA 86 6.184 -1.394 8.439
725 HA ALA 86 HA ALA 86 6.033 -3.706 10.078
726 HB1 ALA 86 HB1 ALA 86 6.736 -4.927 8.084
727 HB2 ALA 86 HB2 ALA 86 7.157 -3.408 7.294
728 HB3 ALA 86 HB3 ALA 86 5.476 -3.756 7.699
729 H ILE 87 H ILE 87 8.681 -1.667 9.019
730 HA ILE 87 HA ILE 87 10.789 -3.423 9.758
731 HB ILE 87 HB ILE 87 10.809 -0.399 9.593
732 HG12 ILE 87 HG12 ILE 87 11.640 -2.485 7.561
733 HG13 ILE 87 HG13 ILE 87 10.171 -1.521 7.479
734 HG21 ILE 87 HG21 ILE 87 13.082 -2.382 9.663
735 HG22 ILE 87 HG22 ILE 87 12.673 -1.205 10.912
736 HG23 ILE 87 HG23 ILE 87 13.250 -0.657 9.339
737 HD11 ILE 87 HD11 ILE 87 12.979 -0.441 7.386
738 HD12 ILE 87 HD12 ILE 87 11.493 0.502 7.258
739 HD13 ILE 87 HD13 ILE 87 11.908 -0.666 6.003
740 H LYS 88 H LYS 88 9.068 -0.837 11.429
741 HA LYS 88 HA LYS 88 10.537 -0.693 13.796
742 HB2 LYS 88 HB2 LYS 88 7.541 -0.442 13.500
743 HB3 LYS 88 HB3 LYS 88 8.524 0.236 14.789
744 HG2 LYS 88 HG2 LYS 88 9.420 1.872 13.421
745 HG3 LYS 88 HG3 LYS 88 9.010 0.994 11.944
746 HD2 LYS 88 HD2 LYS 88 7.560 2.959 12.367
747 HD3 LYS 88 HD3 LYS 88 6.674 1.444 12.254
748 HE2 LYS 88 HE2 LYS 88 6.402 1.333 14.610
749 HE3 LYS 88 HE3 LYS 88 7.534 2.655 14.868
750 HZ1 LYS 88 HZ1 LYS 88 5.277 3.429 15.118
751 HZ2 LYS 88 HZ2 LYS 88 4.867 2.860 13.577
752 HZ3 LYS 88 HZ3 LYS 88 5.958 4.144 13.739
753 H ARG 89 H ARG 89 7.697 -2.646 13.039
754 HA ARG 89 HA ARG 89 7.811 -4.051 15.553
755 HB2 ARG 89 HB2 ARG 89 5.913 -5.375 14.601
756 HB3 ARG 89 HB3 ARG 89 5.651 -3.639 14.651
757 HG2 ARG 89 HG2 ARG 89 6.480 -3.680 12.207
758 HG3 ARG 89 HG3 ARG 89 6.130 -5.408 12.291
759 HD2 ARG 89 HD2 ARG 89 4.153 -3.219 12.940
760 HD3 ARG 89 HD3 ARG 89 4.258 -4.043 11.386
761 HE ARG 89 HE ARG 89 3.450 -6.022 12.407
762 HH11 ARG 89 HH11 ARG 89 3.550 -3.307 14.594
763 HH12 ARG 89 HH12 ARG 89 2.398 -3.982 15.703
764 HH21 ARG 89 HH21 ARG 89 1.892 -6.902 13.810
765 HH22 ARG 89 HH22 ARG 89 1.410 -6.022 15.228
766 H HIS 90 H HIS 90 9.896 -4.295 13.210
767 HA HIS 90 HA HIS 90 11.535 -5.789 12.769
768 HB2 HIS 90 HB2 HIS 90 11.358 -6.103 15.263
769 HB3 HIS 90 HB3 HIS 90 10.339 -7.503 14.953
770 HD1 HIS 90 HD1 HIS 90 11.604 -9.617 15.089
771 HD2 HIS 90 HD2 HIS 90 13.970 -6.493 13.688
772 HE1 HIS 90 HE1 HIS 90 13.896 -10.594 14.763
773 HE2 HIS 90 HE2 HIS 90 15.261 -8.741 13.732
774 H ILE 91 H ILE 91 9.020 -5.977 11.319
775 HA ILE 91 HA ILE 91 8.786 -8.816 10.721
776 HB ILE 91 HB ILE 91 7.494 -6.421 9.404
777 HG12 ILE 91 HG12 ILE 91 6.419 -8.518 11.302
778 HG13 ILE 91 HG13 ILE 91 6.690 -6.819 11.673
779 HG21 ILE 91 HG21 ILE 91 7.754 -8.239 7.803
780 HG22 ILE 91 HG22 ILE 91 6.059 -8.049 8.254
781 HG23 ILE 91 HG23 ILE 91 7.012 -9.364 8.940
782 HD11 ILE 91 HD11 ILE 91 4.711 -7.892 9.682
783 HD12 ILE 91 HD12 ILE 91 4.975 -6.190 10.065
784 HD13 ILE 91 HD13 ILE 91 4.340 -7.284 11.296
785 H ILE 92 H ILE 92 9.873 -5.847 9.123
786 HA ILE 92 HA ILE 92 11.677 -7.497 7.500
787 HB ILE 92 HB ILE 92 11.428 -5.847 5.638
788 HG12 ILE 92 HG12 ILE 92 8.965 -4.969 7.166
789 HG13 ILE 92 HG13 ILE 92 10.442 -4.024 7.011
790 HG21 ILE 92 HG21 ILE 92 9.314 -6.779 4.797
791 HG22 ILE 92 HG22 ILE 92 8.967 -7.401 6.410
792 HG23 ILE 92 HG23 ILE 92 10.358 -8.007 5.512
793 HD11 ILE 92 HD11 ILE 92 10.111 -3.943 4.581
794 HD12 ILE 92 HD12 ILE 92 8.760 -3.236 5.468
795 HD13 ILE 92 HD13 ILE 92 8.610 -4.850 4.771
796 H GLU 93 H GLU 93 13.592 -6.407 6.810
797 HA GLU 93 HA GLU 93 14.357 -4.221 8.619
798 HB2 GLU 93 HB2 GLU 93 15.651 -6.343 8.725
799 HB3 GLU 93 HB3 GLU 93 16.107 -6.121 7.044
800 HG2 GLU 93 HG2 GLU 93 17.283 -4.067 7.634
801 HG3 GLU 93 HG3 GLU 93 16.825 -4.293 9.323
802 H TYR 94 H TYR 94 14.213 -5.252 5.282
803 HA TYR 94 HA TYR 94 14.822 -2.501 4.434
804 HB2 TYR 94 HB2 TYR 94 16.614 -3.952 3.702
805 HB3 TYR 94 HB3 TYR 94 15.467 -5.118 3.057
806 HD1 TYR 94 HD2 TYR 94 16.752 -1.659 2.592
807 HD2 TYR 94 HD1 TYR 94 14.736 -4.969 0.832
808 HE1 TYR 94 HE2 TYR 94 16.887 -0.567 0.390
809 HE2 TYR 94 HE1 TYR 94 14.867 -3.887 -1.371
810 HH TYR 94 HH TYR 94 15.098 -1.613 -2.293
811 H ASN 95 H ASN 95 13.387 -1.552 3.020
812 HA ASN 95 HA ASN 95 10.932 -3.078 2.521
813 HB2 ASN 95 HB2 ASN 95 9.795 -0.935 2.281
814 HB3 ASN 95 HB3 ASN 95 10.659 -0.992 3.812
815 HD21 ASN 95 HD21 ASN 95 9.730 1.259 2.136
816 HD22 ASN 95 HD22 ASN 95 11.127 2.239 1.856
817 HA PRO 96 HA PRO 96 11.813 -3.247 -1.772
818 HB2 PRO 96 HB2 PRO 96 8.949 -3.460 -2.300
819 HB3 PRO 96 HB3 PRO 96 10.203 -4.694 -2.445
820 HG2 PRO 96 HG2 PRO 96 8.295 -4.787 -0.534
821 HG3 PRO 96 HG3 PRO 96 9.936 -5.404 -0.269
822 HD2 PRO 96 HD2 PRO 96 8.736 -2.793 0.583
823 HD3 PRO 96 HD3 PRO 96 9.775 -3.907 1.501
824 H ALA 97 H ALA 97 10.198 -0.671 -0.418
825 HA ALA 97 HA ALA 97 9.789 0.650 -3.020
826 HB1 ALA 97 HB1 ALA 97 8.526 1.301 -0.356
827 HB2 ALA 97 HB2 ALA 97 7.749 0.438 -1.684
828 HB3 ALA 97 HB3 ALA 97 8.213 2.129 -1.883
829 H ALA 98 H ALA 98 12.292 0.364 -1.415
830 HA ALA 98 HA ALA 98 12.859 2.840 -0.141
831 HB1 ALA 98 HB1 ALA 98 14.767 0.774 -1.223
832 HB2 ALA 98 HB2 ALA 98 14.059 0.779 0.392
833 HB3 ALA 98 HB3 ALA 98 15.166 2.065 -0.091
834 H ALA 99 H ALA 99 13.235 1.661 -3.431
835 HA ALA 99 HA ALA 99 14.743 4.069 -4.148
836 HB1 ALA 99 HB1 ALA 99 15.654 1.915 -4.870
837 HB2 ALA 99 HB2 ALA 99 15.241 2.944 -6.242
838 HB3 ALA 99 HB3 ALA 99 14.184 1.606 -5.794
839 H PHE 100 H PHE 100 11.583 3.197 -3.953
840 HA PHE 100 HA PHE 100 10.714 4.387 -6.445
841 HB2 PHE 100 HB2 PHE 100 9.235 3.204 -4.102
842 HB3 PHE 100 HB3 PHE 100 8.397 4.085 -5.376
843 HD1 PHE 100 HD1 PHE 100 8.744 3.271 -7.780
844 HD2 PHE 100 HD2 PHE 100 9.683 0.942 -4.349
845 HE1 PHE 100 HE1 PHE 100 8.652 1.227 -9.149
846 HE2 PHE 100 HE2 PHE 100 9.595 -1.105 -5.708
847 HZ PHE 100 HZ PHE 100 9.080 -0.968 -8.112
848 H ASP 101 H ASP 101 10.730 6.492 -6.682
849 HA ASP 101 HA ASP 101 9.473 8.173 -4.667
850 HB2 ASP 101 HB2 ASP 101 11.784 8.301 -3.968
851 HB3 ASP 101 HB3 ASP 101 12.313 8.611 -5.620
852 HA PRO 102 HA PRO 102 7.964 9.710 -8.559
853 HB2 PRO 102 HB2 PRO 102 6.170 11.455 -7.581
854 HB3 PRO 102 HB3 PRO 102 5.927 9.708 -7.489
855 HG2 PRO 102 HG2 PRO 102 6.874 11.600 -5.374
856 HG3 PRO 102 HG3 PRO 102 5.733 10.248 -5.242
857 HD2 PRO 102 HD2 PRO 102 8.365 10.103 -4.505
858 HD3 PRO 102 HD3 PRO 102 7.401 8.705 -5.020
859 H GLY 103 H GLY 103 10.290 11.082 -6.931
860 HA2 GLY 103 HA2 GLY 103 11.670 12.853 -7.419
861 HA3 GLY 103 HA3 GLY 103 10.624 13.219 -8.782
862 H ASP 104 H ASP 104 9.441 13.014 -5.513
863 HA ASP 104 HA ASP 104 8.451 14.495 -4.122
864 HB2 ASP 104 HB2 ASP 104 10.694 15.483 -3.980
865 HB3 ASP 104 HB3 ASP 104 10.336 16.499 -5.373
866 H ALA 105 H ALA 105 6.409 14.424 -4.943
867 HA ALA 105 HA ALA 105 5.695 16.571 -6.831
868 HB1 ALA 105 HB1 ALA 105 3.787 15.212 -7.505
869 HB2 ALA 105 HB2 ALA 105 4.260 13.958 -6.359
870 HB3 ALA 105 HB3 ALA 105 5.296 14.329 -7.738
871 H GLY 106 H GLY 106 5.196 18.207 -5.459
872 HA2 GLY 106 HA2 GLY 106 3.560 19.360 -4.221
873 HA3 GLY 106 HA3 GLY 106 2.847 17.819 -3.765
874 H GLY 107 H GLY 107 4.254 20.380 -2.483
875 HA2 GLY 107 HA2 GLY 107 5.772 18.839 -0.463
876 HA3 GLY 107 HA3 GLY 107 6.238 20.456 -0.991
877 H LYS 108 H LYS 108 2.998 19.362 -0.514
878 HA LYS 108 HA LYS 108 1.373 19.793 1.011
879 HB2 LYS 108 HB2 LYS 108 3.676 20.240 2.590
880 HB3 LYS 108 HB3 LYS 108 2.596 21.602 2.863
881 HG2 LYS 108 HG2 LYS 108 2.247 19.748 4.449
882 HG3 LYS 108 HG3 LYS 108 0.809 20.128 3.498
883 HD2 LYS 108 HD2 LYS 108 1.389 18.275 1.961
884 HD3 LYS 108 HD3 LYS 108 2.743 17.866 3.011
885 HE2 LYS 108 HE2 LYS 108 -0.152 17.896 3.831
886 HE3 LYS 108 HE3 LYS 108 0.765 16.454 3.404
887 HZ1 LYS 108 HZ1 LYS 108 0.616 16.785 5.805
888 HZ2 LYS 108 HZ2 LYS 108 1.413 18.277 5.665
889 HZ3 LYS 108 HZ3 LYS 108 2.225 16.842 5.270
890 H LEU 109 H LEU 109 -0.187 21.124 0.607
891 HA LEU 109 HA LEU 109 0.524 23.697 -0.626
892 HB2 LEU 109 HB2 LEU 109 -1.985 22.035 -0.868
893 HB3 LEU 109 HB3 LEU 109 -1.731 23.581 -1.650
894 HG LEU 109 HG LEU 109 -0.077 21.110 -2.166
895 HD11 LEU 109 HD11 LEU 109 -2.301 22.360 -3.774
896 HD12 LEU 109 HD12 LEU 109 -2.342 20.794 -2.966
897 HD13 LEU 109 HD13 LEU 109 -1.254 21.054 -4.329
898 HD21 LEU 109 HD21 LEU 109 -0.170 23.772 -3.581
899 HD22 LEU 109 HD22 LEU 109 0.804 22.377 -4.050
900 HD23 LEU 109 HD23 LEU 109 1.128 23.208 -2.527
901 H GLU 110 H GLU 110 -2.353 22.442 1.047
902 HA GLU 110 HA GLU 110 -3.836 23.415 2.456
903 HB2 GLU 110 HB2 GLU 110 -1.268 24.626 3.470
904 HB3 GLU 110 HB3 GLU 110 -2.818 24.918 4.250
905 HG2 GLU 110 HG2 GLU 110 -1.468 22.254 3.877
906 HG3 GLU 110 HG3 GLU 110 -1.642 23.150 5.385
907 H HIS 111 H HIS 111 -3.731 26.104 3.578
908 HA HIS 111 HA HIS 111 -3.634 27.992 1.471
909 HB2 HIS 111 HB2 HIS 111 -6.023 28.402 1.172
910 HB3 HIS 111 HB3 HIS 111 -5.637 26.746 0.720
911 HD1 HIS 111 HD1 HIS 111 -8.102 28.577 2.473
912 HD2 HIS 111 HD2 HIS 111 -6.208 24.939 3.124
913 HE1 HIS 111 HE1 HIS 111 -9.577 27.325 4.080
914 HE2 HIS 111 HE2 HIS 111 -8.315 25.207 4.594
915 H HIS 112 H HIS 112 -3.733 30.037 2.255
916 HA HIS 112 HA HIS 112 -4.431 30.329 5.104
917 HB2 HIS 112 HB2 HIS 112 -2.636 32.049 3.376
918 HB3 HIS 112 HB3 HIS 112 -3.031 32.382 5.057
919 HD1 HIS 112 HD1 HIS 112 -0.209 31.510 3.494
920 HD2 HIS 112 HD2 HIS 112 -2.436 29.436 6.336
921 HE1 HIS 112 HE1 HIS 112 1.387 29.869 4.552
922 HE2 HIS 112 HE2 HIS 112 0.051 28.711 6.350
923 H HIS 113 H HIS 113 -4.921 31.544 1.866
924 HA HIS 113 HA HIS 113 -7.040 33.332 2.869
925 HB2 HIS 113 HB2 HIS 113 -5.228 34.438 1.588
926 HB3 HIS 113 HB3 HIS 113 -5.578 33.396 0.215
927 HD1 HIS 113 HD1 HIS 113 -6.794 36.433 2.009
928 HD2 HIS 113 HD2 HIS 113 -7.915 34.061 -1.225
929 HE1 HIS 113 HE1 HIS 113 -8.553 37.747 0.773
930 HE2 HIS 113 HE2 HIS 113 -9.242 36.286 -1.160
931 H HIS 114 H HIS 114 -8.990 32.426 2.729
932 HA HIS 114 HA HIS 114 -9.642 30.928 0.266
933 HB2 HIS 114 HB2 HIS 114 -9.561 29.470 2.293
934 HB3 HIS 114 HB3 HIS 114 -10.822 30.460 3.015
935 HD1 HIS 114 HD1 HIS 114 -10.251 27.756 0.521
936 HD2 HIS 114 HD2 HIS 114 -13.406 30.095 1.903
937 HE1 HIS 114 HE1 HIS 114 -12.344 26.639 -0.314
938 HE2 HIS 114 HE2 HIS 114 -14.238 27.958 0.697
939 H HIS 115 H HIS 115 -10.843 32.978 2.876
940 HA HIS 115 HA HIS 115 -12.235 34.666 1.053
941 HB2 HIS 115 HB2 HIS 115 -13.942 32.932 1.130
942 HB3 HIS 115 HB3 HIS 115 -13.899 32.921 2.890
943 HD1 HIS 115 HD1 HIS 115 -15.870 34.061 3.830
944 HD2 HIS 115 HD2 HIS 115 -14.626 35.827 0.273
945 HE1 HIS 115 HE1 HIS 115 -17.438 35.985 3.440
946 HE2 HIS 115 HE2 HIS 115 -16.515 37.174 1.428
947 H HIS 116 H HIS 116 -12.098 36.637 1.870
948 HA HIS 116 HA HIS 116 -11.175 37.061 4.547
949 HB2 HIS 116 HB2 HIS 116 -10.537 38.515 2.642
950 HB3 HIS 116 HB3 HIS 116 -12.202 39.071 2.525
951 HD1 HIS 116 HD1 HIS 116 -9.083 39.490 4.517
952 HD2 HIS 116 HD2 HIS 116 -13.003 40.868 4.540
953 HE1 HIS 116 HE1 HIS 116 -9.106 41.448 6.096
954 HE2 HIS 116 HE2 HIS 116 -11.538 42.084 6.286
Start of MODEL 16
1 H1 MET 1 H1 MET 1 -4.380 -17.257 5.879
2 H2 MET 1 H2 MET 1 -4.497 -15.598 6.209
3 H3 MET 1 H3 MET 1 -5.899 -16.501 5.911
4 HA MET 1 HA MET 1 -5.599 -16.006 8.268
5 HB2 MET 1 HB2 MET 1 -6.813 -18.026 7.524
6 HB3 MET 1 HB3 MET 1 -5.304 -18.929 7.542
7 HG2 MET 1 HG2 MET 1 -5.121 -18.508 9.966
8 HG3 MET 1 HG3 MET 1 -6.688 -17.700 9.918
9 HE1 MET 1 HE1 MET 1 -8.986 -18.964 9.314
10 HE2 MET 1 HE2 MET 1 -9.043 -20.660 8.827
11 HE3 MET 1 HE3 MET 1 -8.242 -19.472 7.798
12 H ALA 2 H ALA 2 -3.911 -15.165 9.315
13 HA ALA 2 HA ALA 2 -1.863 -16.916 10.291
14 HB1 ALA 2 HB1 ALA 2 -0.888 -16.324 8.117
15 HB2 ALA 2 HB2 ALA 2 0.054 -15.663 9.452
16 HB3 ALA 2 HB3 ALA 2 -1.020 -14.613 8.526
17 H GLU 3 H GLU 3 -2.881 -16.286 12.234
18 HA GLU 3 HA GLU 3 -2.606 -13.446 12.954
19 HB2 GLU 3 HB2 GLU 3 -4.332 -15.614 14.167
20 HB3 GLU 3 HB3 GLU 3 -4.266 -13.947 14.725
21 HG2 GLU 3 HG2 GLU 3 -5.185 -13.152 12.667
22 HG3 GLU 3 HG3 GLU 3 -5.074 -14.755 11.944
23 H LYS 4 H LYS 4 -0.400 -13.543 13.507
24 HA LYS 4 HA LYS 4 0.033 -14.156 16.261
25 HB2 LYS 4 HB2 LYS 4 0.403 -16.369 15.003
26 HB3 LYS 4 HB3 LYS 4 1.799 -15.600 14.274
27 HG2 LYS 4 HG2 LYS 4 1.408 -16.071 17.226
28 HG3 LYS 4 HG3 LYS 4 2.397 -17.056 16.150
29 HD2 LYS 4 HD2 LYS 4 3.577 -14.781 15.633
30 HD3 LYS 4 HD3 LYS 4 2.874 -14.289 17.175
31 HE2 LYS 4 HE2 LYS 4 5.061 -15.092 17.629
32 HE3 LYS 4 HE3 LYS 4 3.932 -16.329 18.181
33 HZ1 LYS 4 HZ1 LYS 4 5.858 -17.213 16.926
34 HZ2 LYS 4 HZ2 LYS 4 5.303 -16.388 15.552
35 HZ3 LYS 4 HZ3 LYS 4 4.362 -17.620 16.237
36 H ASN 5 H ASN 5 2.137 -14.033 13.442
37 HA ASN 5 HA ASN 5 2.983 -11.360 13.614
38 HB2 ASN 5 HB2 ASN 5 3.855 -12.253 15.840
39 HB3 ASN 5 HB3 ASN 5 4.940 -13.275 14.910
40 HD21 ASN 5 HD21 ASN 5 6.755 -12.307 15.786
41 HD22 ASN 5 HD22 ASN 5 7.251 -10.705 15.352
42 H ALA 6 H ALA 6 2.358 -13.465 11.746
43 HA ALA 6 HA ALA 6 4.677 -13.260 10.007
44 HB1 ALA 6 HB1 ALA 6 5.073 -15.362 11.195
45 HB2 ALA 6 HB2 ALA 6 4.700 -15.659 9.497
46 HB3 ALA 6 HB3 ALA 6 3.470 -15.935 10.731
47 H TYR 7 H TYR 7 2.399 -11.871 9.751
48 HA TYR 7 HA TYR 7 0.556 -13.420 8.087
49 HB2 TYR 7 HB2 TYR 7 -0.890 -11.305 8.386
50 HB3 TYR 7 HB3 TYR 7 -0.684 -12.392 9.752
51 HD1 TYR 7 HD1 TYR 7 0.489 -9.174 8.308
52 HD2 TYR 7 HD2 TYR 7 0.242 -11.627 11.775
53 HE1 TYR 7 HE1 TYR 7 1.270 -7.297 9.689
54 HE2 TYR 7 HE2 TYR 7 1.019 -9.753 13.163
55 HH TYR 7 HH TYR 7 1.079 -6.595 12.118
56 H THR 8 H THR 8 -0.660 -11.671 6.544
57 HA THR 8 HA THR 8 1.388 -11.150 4.548
58 HB THR 8 HB THR 8 -0.581 -10.879 3.026
59 HG1 THR 8 HG1 THR 8 -2.563 -11.877 4.215
60 HG21 THR 8 HG21 THR 8 -1.178 -13.247 3.004
61 HG22 THR 8 HG22 THR 8 -0.546 -13.438 4.640
62 HG23 THR 8 HG23 THR 8 0.548 -13.054 3.311
63 H VAL 9 H VAL 9 0.785 -9.217 3.035
64 HA VAL 9 HA VAL 9 1.071 -6.830 4.496
65 HB VAL 9 HB VAL 9 0.734 -5.654 2.357
66 HG11 VAL 9 HG11 VAL 9 2.933 -6.507 2.872
67 HG12 VAL 9 HG12 VAL 9 2.622 -6.667 1.143
68 HG13 VAL 9 HG13 VAL 9 2.511 -8.079 2.193
69 HG21 VAL 9 HG21 VAL 9 0.134 -8.391 1.234
70 HG22 VAL 9 HG22 VAL 9 0.343 -6.912 0.295
71 HG23 VAL 9 HG23 VAL 9 -1.018 -7.066 1.406
72 H ALA 10 H ALA 10 -1.741 -8.507 3.269
73 HA ALA 10 HA ALA 10 -3.604 -6.397 3.526
74 HB1 ALA 10 HB1 ALA 10 -5.315 -8.123 3.423
75 HB2 ALA 10 HB2 ALA 10 -4.101 -9.368 3.722
76 HB3 ALA 10 HB3 ALA 10 -4.057 -8.434 2.226
77 H GLN 11 H GLN 11 -2.467 -8.894 5.743
78 HA GLN 11 HA GLN 11 -4.234 -8.083 7.854
79 HB2 GLN 11 HB2 GLN 11 -1.778 -9.841 7.926
80 HB3 GLN 11 HB3 GLN 11 -2.899 -9.621 9.259
81 HG2 GLN 11 HG2 GLN 11 -3.555 -10.836 6.586
82 HG3 GLN 11 HG3 GLN 11 -3.302 -11.712 8.094
83 HE21 GLN 11 HE21 GLN 11 -4.705 -9.642 9.655
84 HE22 GLN 11 HE22 GLN 11 -6.390 -9.872 9.330
85 H LEU 12 H LEU 12 -0.954 -7.369 6.866
86 HA LEU 12 HA LEU 12 -0.127 -6.037 9.211
87 HB2 LEU 12 HB2 LEU 12 1.333 -6.813 7.295
88 HB3 LEU 12 HB3 LEU 12 0.755 -5.432 6.387
89 HG LEU 12 HG LEU 12 2.113 -5.047 9.041
90 HD11 LEU 12 HD11 LEU 12 3.438 -5.345 6.350
91 HD12 LEU 12 HD12 LEU 12 3.635 -6.410 7.741
92 HD13 LEU 12 HD13 LEU 12 4.224 -4.749 7.811
93 HD21 LEU 12 HD21 LEU 12 2.699 -2.887 8.076
94 HD22 LEU 12 HD22 LEU 12 0.953 -3.132 8.039
95 HD23 LEU 12 HD23 LEU 12 1.903 -3.332 6.566
96 H ALA 13 H ALA 13 -1.542 -4.840 6.177
97 HA ALA 13 HA ALA 13 -1.723 -2.138 6.933
98 HB1 ALA 13 HB1 ALA 13 -3.294 -1.904 5.095
99 HB2 ALA 13 HB2 ALA 13 -3.483 -3.655 5.008
100 HB3 ALA 13 HB3 ALA 13 -1.931 -2.913 4.611
101 H ASP 14 H ASP 14 -3.753 -4.892 7.575
102 HA ASP 14 HA ASP 14 -6.116 -3.593 8.340
103 HB2 ASP 14 HB2 ASP 14 -5.817 -6.056 7.915
104 HB3 ASP 14 HB3 ASP 14 -5.015 -6.176 9.475
105 H GLU 15 H GLU 15 -3.322 -4.638 10.317
106 HA GLU 15 HA GLU 15 -4.421 -3.423 12.682
107 HB2 GLU 15 HB2 GLU 15 -2.932 -5.412 12.777
108 HB3 GLU 15 HB3 GLU 15 -1.599 -4.413 12.209
109 HG2 GLU 15 HG2 GLU 15 -1.652 -3.091 14.187
110 HG3 GLU 15 HG3 GLU 15 -3.154 -3.844 14.714
111 H TYR 16 H TYR 16 -2.114 -2.549 10.202
112 HA TYR 16 HA TYR 16 -1.033 -0.271 11.445
113 HB2 TYR 16 HB2 TYR 16 0.196 -1.053 9.619
114 HB3 TYR 16 HB3 TYR 16 -1.225 -1.176 8.587
115 HD1 TYR 16 HD1 TYR 16 0.734 1.438 10.425
116 HD2 TYR 16 HD2 TYR 16 -1.509 0.423 6.957
117 HE1 TYR 16 HE1 TYR 16 1.200 3.660 9.475
118 HE2 TYR 16 HE2 TYR 16 -1.045 2.636 6.001
119 HH TYR 16 HH TYR 16 -0.446 4.833 6.690
120 H PHE 17 H PHE 17 -3.817 -0.603 9.222
121 HA PHE 17 HA PHE 17 -4.208 2.196 9.013
122 HB2 PHE 17 HB2 PHE 17 -5.915 1.729 7.583
123 HB3 PHE 17 HB3 PHE 17 -5.136 0.162 7.554
124 HD1 PHE 17 HD2 PHE 17 -8.000 2.072 8.854
125 HD2 PHE 17 HD1 PHE 17 -6.239 -1.771 8.397
126 HE1 PHE 17 HE2 PHE 17 -10.134 1.023 9.491
127 HE2 PHE 17 HE1 PHE 17 -8.368 -2.825 9.025
128 HZ PHE 17 HZ PHE 17 -10.318 -1.431 9.576
129 H GLU 18 H GLU 18 -5.264 -0.183 11.327
130 HA GLU 18 HA GLU 18 -7.308 1.306 12.553
131 HB2 GLU 18 HB2 GLU 18 -6.909 -1.071 13.032
132 HB3 GLU 18 HB3 GLU 18 -5.388 -0.660 13.817
133 HG2 GLU 18 HG2 GLU 18 -6.686 0.712 15.446
134 HG3 GLU 18 HG3 GLU 18 -8.160 0.086 14.711
135 H ARG 19 H ARG 19 -3.817 1.418 12.869
136 HA ARG 19 HA ARG 19 -3.777 2.984 15.243
137 HB2 ARG 19 HB2 ARG 19 -1.791 2.016 13.286
138 HB3 ARG 19 HB3 ARG 19 -1.362 3.495 14.133
139 HG2 ARG 19 HG2 ARG 19 -0.468 1.535 15.255
140 HG3 ARG 19 HG3 ARG 19 -1.637 2.373 16.271
141 HD2 ARG 19 HD2 ARG 19 -3.349 0.731 15.640
142 HD3 ARG 19 HD3 ARG 19 -2.162 -0.112 14.644
143 HE ARG 19 HE ARG 19 -1.112 0.101 17.221
144 HH11 ARG 19 HH11 ARG 19 -3.788 -1.509 15.624
145 HH12 ARG 19 HH12 ARG 19 -3.817 -2.832 16.746
146 HH21 ARG 19 HH21 ARG 19 -1.152 -1.611 18.679
147 HH22 ARG 19 HH22 ARG 19 -2.322 -2.884 18.503
148 H MET 20 H MET 20 -4.064 3.742 11.864
149 HA MET 20 HA MET 20 -3.568 6.586 12.391
150 HB2 MET 20 HB2 MET 20 -3.940 5.071 9.803
151 HB3 MET 20 HB3 MET 20 -3.720 6.811 9.904
152 HG2 MET 20 HG2 MET 20 -1.694 4.937 11.065
153 HG3 MET 20 HG3 MET 20 -1.701 5.317 9.345
154 HE1 MET 20 HE1 MET 20 -0.809 8.312 12.752
155 HE2 MET 20 HE2 MET 20 -0.932 6.563 12.956
156 HE3 MET 20 HE3 MET 20 -2.376 7.515 12.613
157 H ILE 21 H ILE 21 -6.075 4.327 11.680
158 HA ILE 21 HA ILE 21 -8.002 6.492 11.182
159 HB ILE 21 HB ILE 21 -8.246 3.541 10.524
160 HG12 ILE 21 HG12 ILE 21 -6.476 4.592 9.210
161 HG13 ILE 21 HG13 ILE 21 -7.862 4.219 8.192
162 HG21 ILE 21 HG21 ILE 21 -10.417 4.649 10.814
163 HG22 ILE 21 HG22 ILE 21 -10.137 4.197 9.132
164 HG23 ILE 21 HG23 ILE 21 -9.944 5.876 9.637
165 HD11 ILE 21 HD11 ILE 21 -8.550 6.553 8.258
166 HD12 ILE 21 HD12 ILE 21 -6.899 6.394 7.655
167 HD13 ILE 21 HD13 ILE 21 -7.187 6.934 9.310
168 H ALA 22 H ALA 22 -7.300 6.257 13.750
169 HA ALA 22 HA ALA 22 -9.643 4.971 14.987
170 HB1 ALA 22 HB1 ALA 22 -8.320 4.591 17.001
171 HB2 ALA 22 HB2 ALA 22 -6.909 5.305 16.220
172 HB3 ALA 22 HB3 ALA 22 -7.583 3.794 15.609
173 H GLY 23 H GLY 23 -10.142 6.003 17.173
174 HA2 GLY 23 HA2 GLY 23 -10.548 7.869 18.484
175 HA3 GLY 23 HA3 GLY 23 -9.360 8.756 17.540
176 H ARG 24 H ARG 24 -10.130 9.184 15.215
177 HA ARG 24 HA ARG 24 -12.950 9.493 14.873
178 HB2 ARG 24 HB2 ARG 24 -12.818 11.942 14.415
179 HB3 ARG 24 HB3 ARG 24 -12.625 11.516 16.109
180 HG2 ARG 24 HG2 ARG 24 -10.430 12.138 16.159
181 HG3 ARG 24 HG3 ARG 24 -10.194 11.855 14.428
182 HD2 ARG 24 HD2 ARG 24 -11.195 13.853 13.839
183 HD3 ARG 24 HD3 ARG 24 -12.063 13.979 15.367
184 HE ARG 24 HE ARG 24 -9.887 14.511 16.399
185 HH11 ARG 24 HH11 ARG 24 -10.203 14.869 12.932
186 HH12 ARG 24 HH12 ARG 24 -8.984 16.102 12.815
187 HH21 ARG 24 HH21 ARG 24 -8.259 16.093 16.253
188 HH22 ARG 24 HH22 ARG 24 -7.868 16.793 14.710
189 H TRP 25 H TRP 25 -13.326 9.047 12.907
190 HA TRP 25 HA TRP 25 -11.514 9.812 10.770
191 HB2 TRP 25 HB2 TRP 25 -11.347 7.535 9.874
192 HB3 TRP 25 HB3 TRP 25 -10.687 7.600 11.502
193 HD1 TRP 25 HD1 TRP 25 -13.178 5.784 9.421
194 HE1 TRP 25 HE1 TRP 25 -14.519 4.141 10.870
195 HE3 TRP 25 HE3 TRP 25 -11.718 7.386 14.058
196 HZ2 TRP 25 HZ2 TRP 25 -14.906 3.587 13.604
197 HZ3 TRP 25 HZ3 TRP 25 -12.629 6.245 16.034
198 HH2 TRP 25 HH2 TRP 25 -14.190 4.395 15.803
199 H LYS 26 H LYS 26 -14.503 8.155 11.684
200 HA LYS 26 HA LYS 26 -16.547 8.002 10.769
201 HB2 LYS 26 HB2 LYS 26 -15.619 10.567 9.575
202 HB3 LYS 26 HB3 LYS 26 -17.072 9.819 8.921
203 HG2 LYS 26 HG2 LYS 26 -16.584 10.673 11.765
204 HG3 LYS 26 HG3 LYS 26 -17.726 11.371 10.610
205 HD2 LYS 26 HD2 LYS 26 -18.913 9.201 10.527
206 HD3 LYS 26 HD3 LYS 26 -17.812 8.580 11.755
207 HE2 LYS 26 HE2 LYS 26 -18.585 10.333 13.295
208 HE3 LYS 26 HE3 LYS 26 -19.722 10.886 12.065
209 HZ1 LYS 26 HZ1 LYS 26 -20.785 8.708 12.132
210 HZ2 LYS 26 HZ2 LYS 26 -20.807 9.446 13.659
211 HZ3 LYS 26 HZ3 LYS 26 -19.702 8.200 13.336
212 H HIS 27 H HIS 27 -17.364 6.620 9.410
213 HA HIS 27 HA HIS 27 -17.488 5.053 7.774
214 HB2 HIS 27 HB2 HIS 27 -16.007 7.136 6.158
215 HB3 HIS 27 HB3 HIS 27 -16.646 5.641 5.487
216 HD1 HIS 27 HD1 HIS 27 -17.478 8.770 4.952
217 HD2 HIS 27 HD2 HIS 27 -19.628 5.806 6.925
218 HE1 HIS 27 HE1 HIS 27 -19.892 9.456 4.784
219 HE2 HIS 27 HE2 HIS 27 -21.134 7.778 6.197
220 HA PRO 28 HA PRO 28 -13.290 3.450 8.817
221 HB2 PRO 28 HB2 PRO 28 -14.791 0.935 9.103
222 HB3 PRO 28 HB3 PRO 28 -13.729 1.738 10.260
223 HG2 PRO 28 HG2 PRO 28 -16.406 1.628 10.589
224 HG3 PRO 28 HG3 PRO 28 -15.431 2.997 11.152
225 HD2 PRO 28 HD2 PRO 28 -17.173 2.771 8.735
226 HD3 PRO 28 HD3 PRO 28 -16.913 4.159 9.813
227 H ASN 29 H ASN 29 -15.840 2.551 6.684
228 HA ASN 29 HA ASN 29 -14.361 0.618 5.178
229 HB2 ASN 29 HB2 ASN 29 -16.314 0.744 3.603
230 HB3 ASN 29 HB3 ASN 29 -16.733 0.329 5.259
231 HD21 ASN 29 HD21 ASN 29 -18.870 0.983 4.880
232 HD22 ASN 29 HD22 ASN 29 -19.307 2.658 4.809
233 H ILE 30 H ILE 30 -14.545 4.050 5.153
234 HA ILE 30 HA ILE 30 -14.227 4.444 2.356
235 HB ILE 30 HB ILE 30 -15.010 6.139 4.166
236 HG12 ILE 30 HG12 ILE 30 -14.701 6.570 1.690
237 HG13 ILE 30 HG13 ILE 30 -14.580 7.980 2.730
238 HG21 ILE 30 HG21 ILE 30 -12.045 6.663 4.260
239 HG22 ILE 30 HG22 ILE 30 -13.044 6.061 5.584
240 HG23 ILE 30 HG23 ILE 30 -13.298 7.690 4.957
241 HD11 ILE 30 HD11 ILE 30 -12.906 8.037 0.976
242 HD12 ILE 30 HD12 ILE 30 -12.276 6.476 1.504
243 HD13 ILE 30 HD13 ILE 30 -12.138 7.883 2.556
244 H VAL 31 H VAL 31 -11.986 4.031 5.038
245 HA VAL 31 HA VAL 31 -9.680 4.569 3.412
246 HB VAL 31 HB VAL 31 -9.649 5.012 5.838
247 HG11 VAL 31 HG11 VAL 31 -9.754 2.015 6.131
248 HG12 VAL 31 HG12 VAL 31 -11.000 3.162 6.623
249 HG13 VAL 31 HG13 VAL 31 -9.434 3.162 7.433
250 HG21 VAL 31 HG21 VAL 31 -7.445 4.035 6.308
251 HG22 VAL 31 HG22 VAL 31 -7.544 4.696 4.677
252 HG23 VAL 31 HG23 VAL 31 -7.641 2.952 4.929
253 H ARG 32 H ARG 32 -11.479 1.736 4.443
254 HA ARG 32 HA ARG 32 -9.493 -0.158 3.691
255 HB2 ARG 32 HB2 ARG 32 -11.457 -0.537 5.289
256 HB3 ARG 32 HB3 ARG 32 -12.449 -0.724 3.846
257 HG2 ARG 32 HG2 ARG 32 -11.857 -2.906 4.448
258 HG3 ARG 32 HG3 ARG 32 -10.765 -2.497 3.121
259 HD2 ARG 32 HD2 ARG 32 -9.210 -1.685 5.052
260 HD3 ARG 32 HD3 ARG 32 -10.200 -2.760 6.025
261 HE ARG 32 HE ARG 32 -8.740 -3.678 3.646
262 HH11 ARG 32 HH11 ARG 32 -9.710 -4.037 6.997
263 HH12 ARG 32 HH12 ARG 32 -8.838 -5.527 7.222
264 HH21 ARG 32 HH21 ARG 32 -7.640 -5.643 3.916
265 HH22 ARG 32 HH22 ARG 32 -7.691 -6.467 5.450
266 H SER 33 H SER 33 -12.395 1.122 2.114
267 HA SER 33 HA SER 33 -12.438 -0.644 -0.044
268 HB2 SER 33 HB2 SER 33 -13.739 1.231 -1.198
269 HB3 SER 33 HB3 SER 33 -14.390 0.627 0.326
270 HG SER 33 HG SER 33 -13.701 2.438 1.353
271 H ARG 34 H ARG 34 -10.508 2.246 0.468
272 HA ARG 34 HA ARG 34 -9.656 2.317 -2.280
273 HB2 ARG 34 HB2 ARG 34 -8.442 4.217 -1.790
274 HB3 ARG 34 HB3 ARG 34 -9.724 4.303 -0.595
275 HG2 ARG 34 HG2 ARG 34 -8.299 3.697 1.153
276 HG3 ARG 34 HG3 ARG 34 -7.066 3.083 0.049
277 HD2 ARG 34 HD2 ARG 34 -7.842 5.953 0.545
278 HD3 ARG 34 HD3 ARG 34 -6.291 5.180 0.873
279 HE ARG 34 HE ARG 34 -7.350 5.880 -1.789
280 HH11 ARG 34 HH11 ARG 34 -4.662 4.910 0.250
281 HH12 ARG 34 HH12 ARG 34 -3.481 5.136 -0.998
282 HH21 ARG 34 HH21 ARG 34 -5.797 6.171 -3.415
283 HH22 ARG 34 HH22 ARG 34 -4.121 5.831 -3.094
284 H ILE 35 H ILE 35 -8.405 1.002 0.753
285 HA ILE 35 HA ILE 35 -5.817 0.398 -0.255
286 HB ILE 35 HB ILE 35 -7.319 -0.878 2.043
287 HG12 ILE 35 HG12 ILE 35 -5.240 1.323 2.026
288 HG13 ILE 35 HG13 ILE 35 -6.966 1.553 2.288
289 HG21 ILE 35 HG21 ILE 35 -4.381 -0.971 1.356
290 HG22 ILE 35 HG22 ILE 35 -5.516 -2.318 1.271
291 HG23 ILE 35 HG23 ILE 35 -5.111 -1.606 2.832
292 HD11 ILE 35 HD11 ILE 35 -6.841 0.225 4.321
293 HD12 ILE 35 HD12 ILE 35 -5.734 1.596 4.380
294 HD13 ILE 35 HD13 ILE 35 -5.115 -0.025 4.060
295 H GLU 36 H GLU 36 -8.742 -1.500 0.185
296 HA GLU 36 HA GLU 36 -7.820 -3.985 -0.701
297 HB2 GLU 36 HB2 GLU 36 -10.528 -2.680 -0.536
298 HB3 GLU 36 HB3 GLU 36 -10.357 -4.299 -1.188
299 HG2 GLU 36 HG2 GLU 36 -10.743 -3.608 1.453
300 HG3 GLU 36 HG3 GLU 36 -10.279 -5.184 0.858
301 H LYS 37 H LYS 37 -8.616 -1.162 -2.541
302 HA LYS 37 HA LYS 37 -8.841 -2.748 -5.001
303 HB2 LYS 37 HB2 LYS 37 -10.794 -1.388 -4.558
304 HB3 LYS 37 HB3 LYS 37 -9.800 0.039 -4.329
305 HG2 LYS 37 HG2 LYS 37 -9.799 -1.388 -6.956
306 HG3 LYS 37 HG3 LYS 37 -11.105 -0.282 -6.538
307 HD2 LYS 37 HD2 LYS 37 -8.166 0.411 -6.584
308 HD3 LYS 37 HD3 LYS 37 -9.332 0.817 -7.832
309 HE2 LYS 37 HE2 LYS 37 -10.615 2.111 -6.153
310 HE3 LYS 37 HE3 LYS 37 -9.347 1.774 -4.978
311 HZ1 LYS 37 HZ1 LYS 37 -9.026 3.941 -5.933
312 HZ2 LYS 37 HZ2 LYS 37 -9.049 3.319 -7.503
313 HZ3 LYS 37 HZ3 LYS 37 -7.766 2.934 -6.457
314 H ASP 38 H ASP 38 -7.323 0.131 -3.615
315 HA ASP 38 HA ASP 38 -5.955 0.738 -6.100
316 HB2 ASP 38 HB2 ASP 38 -7.047 2.349 -4.331
317 HB3 ASP 38 HB3 ASP 38 -5.497 2.185 -3.517
318 H ILE 39 H ILE 39 -5.195 -0.392 -2.867
319 HA ILE 39 HA ILE 39 -2.339 -0.252 -3.400
320 HB ILE 39 HB ILE 39 -3.865 -0.974 -0.900
321 HG12 ILE 39 HG12 ILE 39 -2.273 1.491 -1.634
322 HG13 ILE 39 HG13 ILE 39 -4.028 1.389 -1.597
323 HG21 ILE 39 HG21 ILE 39 -1.711 -2.132 -0.968
324 HG22 ILE 39 HG22 ILE 39 -1.727 -0.873 0.268
325 HG23 ILE 39 HG23 ILE 39 -0.895 -0.595 -1.261
326 HD11 ILE 39 HD11 ILE 39 -2.184 1.087 0.761
327 HD12 ILE 39 HD12 ILE 39 -3.942 0.957 0.807
328 HD13 ILE 39 HD13 ILE 39 -3.182 2.490 0.381
329 H LYS 40 H LYS 40 -4.731 -2.704 -2.383
330 HA LYS 40 HA LYS 40 -2.925 -4.711 -3.521
331 HB2 LYS 40 HB2 LYS 40 -3.881 -6.216 -1.578
332 HB3 LYS 40 HB3 LYS 40 -2.480 -5.194 -1.344
333 HG2 LYS 40 HG2 LYS 40 -3.674 -4.750 0.549
334 HG3 LYS 40 HG3 LYS 40 -4.225 -3.454 -0.510
335 HD2 LYS 40 HD2 LYS 40 -6.104 -4.448 0.648
336 HD3 LYS 40 HD3 LYS 40 -6.207 -4.790 -1.081
337 HE2 LYS 40 HE2 LYS 40 -5.249 -7.017 -0.679
338 HE3 LYS 40 HE3 LYS 40 -5.196 -6.672 1.049
339 HZ1 LYS 40 HZ1 LYS 40 -7.145 -7.941 0.572
340 HZ2 LYS 40 HZ2 LYS 40 -7.621 -6.872 -0.654
341 HZ3 LYS 40 HZ3 LYS 40 -7.629 -6.363 0.968
342 HA PRO 41 HA PRO 41 -7.079 -5.242 -5.407
343 HB2 PRO 41 HB2 PRO 41 -5.547 -5.806 -7.831
344 HB3 PRO 41 HB3 PRO 41 -6.767 -4.562 -7.547
345 HG2 PRO 41 HG2 PRO 41 -4.138 -3.988 -7.871
346 HG3 PRO 41 HG3 PRO 41 -5.221 -3.012 -6.861
347 HD2 PRO 41 HD2 PRO 41 -3.216 -5.081 -6.048
348 HD3 PRO 41 HD3 PRO 41 -3.602 -3.522 -5.287
349 H ALA 42 H ALA 42 -4.215 -7.113 -6.463
350 HA ALA 42 HA ALA 42 -5.818 -9.558 -6.085
351 HB1 ALA 42 HB1 ALA 42 -3.606 -9.080 -8.075
352 HB2 ALA 42 HB2 ALA 42 -5.332 -9.112 -8.437
353 HB3 ALA 42 HB3 ALA 42 -4.520 -10.576 -7.881
354 H ILE 43 H ILE 43 -3.672 -7.921 -4.503
355 HA ILE 43 HA ILE 43 -1.978 -10.227 -3.804
356 HB ILE 43 HB ILE 43 -0.426 -8.409 -2.856
357 HG12 ILE 43 HG12 ILE 43 -1.930 -6.728 -4.879
358 HG13 ILE 43 HG13 ILE 43 -2.144 -6.576 -3.139
359 HG21 ILE 43 HG21 ILE 43 0.641 -8.128 -5.068
360 HG22 ILE 43 HG22 ILE 43 -0.821 -8.756 -5.831
361 HG23 ILE 43 HG23 ILE 43 0.131 -9.789 -4.765
362 HD11 ILE 43 HD11 ILE 43 0.403 -6.095 -4.670
363 HD12 ILE 43 HD12 ILE 43 0.229 -5.968 -2.920
364 HD13 ILE 43 HD13 ILE 43 -0.651 -4.863 -3.979
365 H GLY 44 H GLY 44 -3.807 -10.874 -2.450
366 HA2 GLY 44 HA2 GLY 44 -4.118 -9.277 -0.002
367 HA3 GLY 44 HA3 GLY 44 -5.163 -10.598 -0.509
368 H SER 45 H SER 45 -3.613 -12.672 -0.940
369 HA SER 45 HA SER 45 -2.480 -13.318 1.641
370 HB2 SER 45 HB2 SER 45 -2.698 -14.919 -0.922
371 HB3 SER 45 HB3 SER 45 -2.104 -15.557 0.609
372 HG SER 45 HG SER 45 -4.688 -14.421 0.231
373 H LEU 46 H LEU 46 -1.191 -11.243 0.130
374 HA LEU 46 HA LEU 46 1.286 -12.390 -0.864
375 HB2 LEU 46 HB2 LEU 46 0.162 -10.497 -2.027
376 HB3 LEU 46 HB3 LEU 46 0.439 -9.500 -0.611
377 HG LEU 46 HG LEU 46 2.893 -9.881 -0.936
378 HD11 LEU 46 HD11 LEU 46 2.809 -11.881 -2.278
379 HD12 LEU 46 HD12 LEU 46 3.638 -10.595 -3.156
380 HD13 LEU 46 HD13 LEU 46 1.972 -11.010 -3.563
381 HD21 LEU 46 HD21 LEU 46 1.410 -8.516 -3.167
382 HD22 LEU 46 HD22 LEU 46 3.101 -8.251 -2.738
383 HD23 LEU 46 HD23 LEU 46 1.823 -7.809 -1.606
384 H LYS 47 H LYS 47 2.637 -13.037 0.682
385 HA LYS 47 HA LYS 47 2.777 -12.023 3.292
386 HB2 LYS 47 HB2 LYS 47 3.605 -14.259 2.461
387 HB3 LYS 47 HB3 LYS 47 4.980 -13.416 1.762
388 HG2 LYS 47 HG2 LYS 47 5.616 -14.379 3.866
389 HG3 LYS 47 HG3 LYS 47 5.594 -12.620 4.016
390 HD2 LYS 47 HD2 LYS 47 4.569 -13.596 5.966
391 HD3 LYS 47 HD3 LYS 47 3.331 -12.780 5.019
392 HE2 LYS 47 HE2 LYS 47 2.507 -14.916 5.806
393 HE3 LYS 47 HE3 LYS 47 2.678 -14.942 4.051
394 HZ1 LYS 47 HZ1 LYS 47 4.306 -16.312 6.095
395 HZ2 LYS 47 HZ2 LYS 47 4.971 -15.965 4.580
396 HZ3 LYS 47 HZ3 LYS 47 3.591 -16.942 4.690
397 H VAL 48 H VAL 48 4.242 -10.612 4.268
398 HA VAL 48 HA VAL 48 5.097 -8.371 2.812
399 HB VAL 48 HB VAL 48 6.246 -9.253 5.461
400 HG11 VAL 48 HG11 VAL 48 5.792 -6.521 4.271
401 HG12 VAL 48 HG12 VAL 48 7.345 -7.338 4.449
402 HG13 VAL 48 HG13 VAL 48 6.438 -6.849 5.880
403 HG21 VAL 48 HG21 VAL 48 3.824 -9.426 5.588
404 HG22 VAL 48 HG22 VAL 48 3.658 -7.790 4.953
405 HG23 VAL 48 HG23 VAL 48 4.394 -8.050 6.534
406 H GLU 49 H GLU 49 6.580 -11.401 3.475
407 HA GLU 49 HA GLU 49 9.270 -10.726 2.819
408 HB2 GLU 49 HB2 GLU 49 8.709 -12.653 4.209
409 HB3 GLU 49 HB3 GLU 49 7.791 -13.363 2.890
410 HG2 GLU 49 HG2 GLU 49 10.038 -13.298 1.613
411 HG3 GLU 49 HG3 GLU 49 10.747 -13.114 3.218
412 H ASP 50 H ASP 50 6.429 -11.421 1.001
413 HA ASP 50 HA ASP 50 7.983 -12.298 -1.328
414 HB2 ASP 50 HB2 ASP 50 6.247 -13.837 -0.462
415 HB3 ASP 50 HB3 ASP 50 5.029 -12.605 -0.760
416 H VAL 51 H VAL 51 6.541 -9.562 -0.128
417 HA VAL 51 HA VAL 51 5.575 -8.623 -2.694
418 HB VAL 51 HB VAL 51 4.236 -7.963 -0.815
419 HG11 VAL 51 HG11 VAL 51 5.927 -8.046 0.941
420 HG12 VAL 51 HG12 VAL 51 5.045 -6.519 0.974
421 HG13 VAL 51 HG13 VAL 51 6.673 -6.583 0.298
422 HG21 VAL 51 HG21 VAL 51 4.355 -6.376 -2.647
423 HG22 VAL 51 HG22 VAL 51 5.757 -5.600 -1.912
424 HG23 VAL 51 HG23 VAL 51 4.186 -5.523 -1.113
425 H LYS 52 H LYS 52 7.511 -8.706 -3.864
426 HA LYS 52 HA LYS 52 9.643 -6.914 -3.145
427 HB2 LYS 52 HB2 LYS 52 10.639 -7.568 -5.300
428 HB3 LYS 52 HB3 LYS 52 10.209 -8.950 -4.311
429 HG2 LYS 52 HG2 LYS 52 8.264 -9.370 -5.666
430 HG3 LYS 52 HG3 LYS 52 8.578 -7.917 -6.618
431 HD2 LYS 52 HD2 LYS 52 9.353 -9.915 -7.785
432 HD3 LYS 52 HD3 LYS 52 10.709 -8.868 -7.366
433 HE2 LYS 52 HE2 LYS 52 10.999 -10.309 -5.299
434 HE3 LYS 52 HE3 LYS 52 9.857 -11.431 -6.037
435 HZ1 LYS 52 HZ1 LYS 52 11.357 -11.633 -7.935
436 HZ2 LYS 52 HZ2 LYS 52 12.122 -12.087 -6.494
437 HZ3 LYS 52 HZ3 LYS 52 12.455 -10.576 -7.193
438 HA PRO 53 HA PRO 53 8.624 -2.995 -4.687
439 HB2 PRO 53 HB2 PRO 53 10.792 -3.424 -6.716
440 HB3 PRO 53 HB3 PRO 53 10.456 -2.003 -5.716
441 HG2 PRO 53 HG2 PRO 53 12.374 -3.686 -5.009
442 HG3 PRO 53 HG3 PRO 53 11.285 -3.005 -3.784
443 HD2 PRO 53 HD2 PRO 53 11.376 -5.751 -4.921
444 HD3 PRO 53 HD3 PRO 53 10.875 -5.208 -3.307
445 H ARG 54 H ARG 54 9.208 -5.295 -7.365
446 HA ARG 54 HA ARG 54 7.893 -3.870 -9.360
447 HB2 ARG 54 HB2 ARG 54 8.517 -6.753 -8.959
448 HB3 ARG 54 HB3 ARG 54 7.436 -6.301 -10.270
449 HG2 ARG 54 HG2 ARG 54 10.251 -5.313 -9.859
450 HG3 ARG 54 HG3 ARG 54 9.716 -6.493 -11.058
451 HD2 ARG 54 HD2 ARG 54 8.179 -4.706 -11.957
452 HD3 ARG 54 HD3 ARG 54 9.013 -3.569 -10.900
453 HE ARG 54 HE ARG 54 10.836 -5.029 -12.542
454 HH11 ARG 54 HH11 ARG 54 8.581 -2.331 -12.581
455 HH12 ARG 54 HH12 ARG 54 9.413 -1.493 -13.850
456 HH21 ARG 54 HH21 ARG 54 11.908 -3.942 -14.235
457 HH22 ARG 54 HH22 ARG 54 11.308 -2.404 -14.791
458 H HIS 55 H HIS 55 6.512 -5.759 -6.775
459 HA HIS 55 HA HIS 55 3.919 -6.032 -7.920
460 HB2 HIS 55 HB2 HIS 55 4.809 -6.044 -5.029
461 HB3 HIS 55 HB3 HIS 55 3.162 -6.387 -5.548
462 HD1 HIS 55 HD1 HIS 55 3.181 -8.449 -7.510
463 HD2 HIS 55 HD2 HIS 55 6.200 -8.306 -4.654
464 HE1 HIS 55 HE1 HIS 55 4.191 -10.753 -7.464
465 HE2 HIS 55 HE2 HIS 55 5.835 -10.701 -5.561
466 H ILE 56 H ILE 56 5.387 -3.654 -5.757
467 HA ILE 56 HA ILE 56 3.091 -1.978 -5.556
468 HB ILE 56 HB ILE 56 6.026 -1.359 -5.136
469 HG12 ILE 56 HG12 ILE 56 5.233 -3.078 -3.620
470 HG13 ILE 56 HG13 ILE 56 5.460 -1.574 -2.731
471 HG21 ILE 56 HG21 ILE 56 4.810 0.692 -5.541
472 HG22 ILE 56 HG22 ILE 56 5.263 0.579 -3.841
473 HG23 ILE 56 HG23 ILE 56 3.604 0.243 -4.335
474 HD11 ILE 56 HD11 ILE 56 3.053 -1.169 -2.809
475 HD12 ILE 56 HD12 ILE 56 3.429 -2.713 -2.044
476 HD13 ILE 56 HD13 ILE 56 2.829 -2.671 -3.703
477 H ASP 57 H ASP 57 5.854 -2.163 -7.688
478 HA ASP 57 HA ASP 57 5.482 0.219 -9.128
479 HB2 ASP 57 HB2 ASP 57 7.533 -1.052 -9.292
480 HB3 ASP 57 HB3 ASP 57 6.671 -2.441 -9.940
481 H ASP 58 H ASP 58 4.023 -2.949 -9.395
482 HA ASP 58 HA ASP 58 2.763 -2.455 -11.918
483 HB2 ASP 58 HB2 ASP 58 3.319 -4.738 -11.152
484 HB3 ASP 58 HB3 ASP 58 2.117 -4.585 -9.872
485 H VAL 59 H VAL 59 1.761 -2.087 -8.545
486 HA VAL 59 HA VAL 59 -0.973 -1.628 -9.285
487 HB VAL 59 HB VAL 59 -1.364 -0.945 -6.975
488 HG11 VAL 59 HG11 VAL 59 0.345 -3.414 -7.197
489 HG12 VAL 59 HG12 VAL 59 -1.386 -3.311 -7.520
490 HG13 VAL 59 HG13 VAL 59 -0.775 -3.053 -5.885
491 HG21 VAL 59 HG21 VAL 59 0.426 -1.010 -5.310
492 HG22 VAL 59 HG22 VAL 59 0.695 0.253 -6.512
493 HG23 VAL 59 HG23 VAL 59 1.607 -1.257 -6.596
494 H LEU 60 H LEU 60 1.837 0.404 -8.684
495 HA LEU 60 HA LEU 60 0.486 2.879 -8.566
496 HB2 LEU 60 HB2 LEU 60 3.310 2.214 -9.389
497 HB3 LEU 60 HB3 LEU 60 2.721 3.848 -9.154
498 HG LEU 60 HG LEU 60 2.821 1.717 -7.021
499 HD11 LEU 60 HD11 LEU 60 4.649 3.041 -6.086
500 HD12 LEU 60 HD12 LEU 60 4.586 4.114 -7.485
501 HD13 LEU 60 HD13 LEU 60 5.045 2.424 -7.689
502 HD21 LEU 60 HD21 LEU 60 1.024 3.302 -6.640
503 HD22 LEU 60 HD22 LEU 60 2.131 4.652 -6.884
504 HD23 LEU 60 HD23 LEU 60 2.334 3.585 -5.493
505 H LYS 61 H LYS 61 1.814 1.067 -11.303
506 HA LYS 61 HA LYS 61 1.377 3.072 -13.246
507 HB2 LYS 61 HB2 LYS 61 1.648 1.319 -14.895
508 HB3 LYS 61 HB3 LYS 61 2.823 1.086 -13.607
509 HG2 LYS 61 HG2 LYS 61 1.298 -0.599 -12.608
510 HG3 LYS 61 HG3 LYS 61 0.267 -0.436 -14.027
511 HD2 LYS 61 HD2 LYS 61 3.147 -1.323 -14.018
512 HD3 LYS 61 HD3 LYS 61 1.740 -2.364 -14.220
513 HE2 LYS 61 HE2 LYS 61 1.146 -1.025 -16.242
514 HE3 LYS 61 HE3 LYS 61 2.693 -0.199 -16.076
515 HZ1 LYS 61 HZ1 LYS 61 2.221 -3.066 -16.635
516 HZ2 LYS 61 HZ2 LYS 61 3.734 -2.467 -16.168
517 HZ3 LYS 61 HZ3 LYS 61 3.020 -1.934 -17.612
518 H ALA 62 H ALA 62 -0.680 0.679 -11.778
519 HA ALA 62 HA ALA 62 -2.827 0.952 -13.654
520 HB1 ALA 62 HB1 ALA 62 -2.817 -0.267 -10.897
521 HB2 ALA 62 HB2 ALA 62 -2.475 -1.118 -12.403
522 HB3 ALA 62 HB3 ALA 62 -4.081 -0.453 -12.114
523 H VAL 63 H VAL 63 -2.178 2.190 -10.378
524 HA VAL 63 HA VAL 63 -4.691 3.413 -10.022
525 HB VAL 63 HB VAL 63 -3.714 4.635 -8.175
526 HG11 VAL 63 HG11 VAL 63 -4.220 2.304 -7.793
527 HG12 VAL 63 HG12 VAL 63 -2.775 2.762 -6.890
528 HG13 VAL 63 HG13 VAL 63 -2.626 1.838 -8.385
529 HG21 VAL 63 HG21 VAL 63 -1.638 5.375 -9.181
530 HG22 VAL 63 HG22 VAL 63 -1.042 3.715 -9.212
531 HG23 VAL 63 HG23 VAL 63 -1.316 4.524 -7.669
532 H MET 64 H MET 64 -1.860 4.427 -11.740
533 HA MET 64 HA MET 64 -2.569 7.195 -11.912
534 HB2 MET 64 HB2 MET 64 -0.664 5.516 -13.544
535 HB3 MET 64 HB3 MET 64 -0.841 7.252 -13.728
536 HG2 MET 64 HG2 MET 64 -0.130 7.550 -11.394
537 HG3 MET 64 HG3 MET 64 0.096 5.805 -11.263
538 HE1 MET 64 HE1 MET 64 3.794 7.015 -11.322
539 HE2 MET 64 HE2 MET 64 2.602 6.003 -10.508
540 HE3 MET 64 HE3 MET 64 2.421 7.758 -10.502
541 H LYS 65 H LYS 65 -2.958 4.378 -14.011
542 HA LYS 65 HA LYS 65 -3.863 5.895 -16.247
543 HB2 LYS 65 HB2 LYS 65 -4.202 3.780 -17.334
544 HB3 LYS 65 HB3 LYS 65 -2.699 3.719 -16.431
545 HG2 LYS 65 HG2 LYS 65 -3.965 2.554 -14.598
546 HG3 LYS 65 HG3 LYS 65 -5.317 2.432 -15.724
547 HD2 LYS 65 HD2 LYS 65 -2.549 1.322 -16.173
548 HD3 LYS 65 HD3 LYS 65 -3.965 0.392 -15.690
549 HE2 LYS 65 HE2 LYS 65 -5.078 0.975 -17.774
550 HE3 LYS 65 HE3 LYS 65 -3.689 1.949 -18.256
551 HZ1 LYS 65 HZ1 LYS 65 -3.602 -0.201 -19.306
552 HZ2 LYS 65 HZ2 LYS 65 -3.702 -0.986 -17.805
553 HZ3 LYS 65 HZ3 LYS 65 -2.331 -0.068 -18.190
554 H ARG 66 H ARG 66 -5.494 4.000 -13.750
555 HA ARG 66 HA ARG 66 -8.071 4.409 -14.988
556 HB2 ARG 66 HB2 ARG 66 -8.998 3.208 -13.079
557 HB3 ARG 66 HB3 ARG 66 -7.645 2.331 -13.776
558 HG2 ARG 66 HG2 ARG 66 -6.243 2.823 -11.975
559 HG3 ARG 66 HG3 ARG 66 -7.281 4.133 -11.411
560 HD2 ARG 66 HD2 ARG 66 -7.446 2.122 -9.999
561 HD3 ARG 66 HD3 ARG 66 -8.983 2.552 -10.748
562 HE ARG 66 HE ARG 66 -7.250 0.305 -11.550
563 HH11 ARG 66 HH11 ARG 66 -10.349 1.930 -11.548
564 HH12 ARG 66 HH12 ARG 66 -11.203 0.592 -12.253
565 HH21 ARG 66 HH21 ARG 66 -8.349 -1.456 -12.457
566 HH22 ARG 66 HH22 ARG 66 -10.055 -1.349 -12.782
567 H GLY 67 H GLY 67 -6.257 5.780 -12.305
568 HA2 GLY 67 HA2 GLY 67 -8.555 7.529 -11.726
569 HA3 GLY 67 HA3 GLY 67 -7.296 7.115 -10.570
570 H ALA 68 H ALA 68 -5.319 8.162 -10.649
571 HA ALA 68 HA ALA 68 -4.652 10.094 -12.624
572 HB1 ALA 68 HB1 ALA 68 -6.507 11.304 -11.544
573 HB2 ALA 68 HB2 ALA 68 -4.961 12.119 -11.312
574 HB3 ALA 68 HB3 ALA 68 -5.669 11.183 -9.996
575 HA PRO 69 HA PRO 69 -0.642 9.592 -10.791
576 HB2 PRO 69 HB2 PRO 69 0.301 12.192 -10.957
577 HB3 PRO 69 HB3 PRO 69 0.353 11.009 -12.267
578 HG2 PRO 69 HG2 PRO 69 -1.615 13.203 -11.770
579 HG3 PRO 69 HG3 PRO 69 -0.909 12.658 -13.302
580 HD2 PRO 69 HD2 PRO 69 -3.397 11.982 -12.607
581 HD3 PRO 69 HD3 PRO 69 -2.338 10.831 -13.451
582 H SER 70 H SER 70 -2.704 12.205 -9.670
583 HA SER 70 HA SER 70 -1.359 12.894 -7.321
584 HB2 SER 70 HB2 SER 70 -4.357 12.875 -7.717
585 HB3 SER 70 HB3 SER 70 -3.429 13.911 -6.632
586 HG SER 70 HG SER 70 -4.159 14.659 -8.889
587 H ILE 71 H ILE 71 -3.621 10.287 -8.021
588 HA ILE 71 HA ILE 71 -4.084 9.468 -5.363
589 HB ILE 71 HB ILE 71 -4.163 7.826 -7.903
590 HG12 ILE 71 HG12 ILE 71 -6.365 9.259 -6.397
591 HG13 ILE 71 HG13 ILE 71 -5.682 9.761 -7.939
592 HG21 ILE 71 HG21 ILE 71 -5.613 6.297 -6.641
593 HG22 ILE 71 HG22 ILE 71 -5.336 7.251 -5.185
594 HG23 ILE 71 HG23 ILE 71 -3.995 6.396 -5.946
595 HD11 ILE 71 HD11 ILE 71 -7.836 8.641 -8.201
596 HD12 ILE 71 HD12 ILE 71 -7.169 7.190 -7.451
597 HD13 ILE 71 HD13 ILE 71 -6.535 7.756 -8.996
598 H ALA 72 H ALA 72 -1.687 8.525 -7.780
599 HA ALA 72 HA ALA 72 -0.448 6.463 -6.341
600 HB1 ALA 72 HB1 ALA 72 0.771 8.338 -8.367
601 HB2 ALA 72 HB2 ALA 72 -0.066 6.827 -8.723
602 HB3 ALA 72 HB3 ALA 72 1.456 6.802 -7.834
603 H ASN 73 H ASN 73 0.036 9.950 -6.311
604 HA ASN 73 HA ASN 73 2.386 10.077 -4.813
605 HB2 ASN 73 HB2 ASN 73 1.520 11.993 -5.995
606 HB3 ASN 73 HB3 ASN 73 0.039 11.966 -5.049
607 HD21 ASN 73 HD21 ASN 73 0.260 14.024 -4.342
608 HD22 ASN 73 HD22 ASN 73 1.464 14.499 -3.204
609 H ASP 74 H ASP 74 -1.011 10.258 -3.749
610 HA ASP 74 HA ASP 74 -0.371 10.322 -0.984
611 HB2 ASP 74 HB2 ASP 74 -2.903 9.816 -2.517
612 HB3 ASP 74 HB3 ASP 74 -2.855 9.601 -0.770
613 H THR 75 H THR 75 -1.213 7.706 -3.212
614 HA THR 75 HA THR 75 -1.380 5.659 -1.298
615 HB THR 75 HB THR 75 -0.578 5.494 -4.214
616 HG1 THR 75 HG1 THR 75 -2.864 4.709 -4.297
617 HG21 THR 75 HG21 THR 75 0.153 3.489 -3.017
618 HG22 THR 75 HG22 THR 75 -1.218 3.122 -4.063
619 HG23 THR 75 HG23 THR 75 -1.459 3.301 -2.325
620 H LEU 76 H LEU 76 1.401 6.962 -3.096
621 HA LEU 76 HA LEU 76 3.354 5.151 -2.271
622 HB2 LEU 76 HB2 LEU 76 3.482 8.074 -2.955
623 HB3 LEU 76 HB3 LEU 76 4.918 7.191 -2.474
624 HG LEU 76 HG LEU 76 3.178 6.454 -4.827
625 HD11 LEU 76 HD11 LEU 76 4.971 7.366 -6.205
626 HD12 LEU 76 HD12 LEU 76 5.826 7.898 -4.758
627 HD13 LEU 76 HD13 LEU 76 4.269 8.613 -5.175
628 HD21 LEU 76 HD21 LEU 76 5.890 5.482 -3.931
629 HD22 LEU 76 HD22 LEU 76 5.084 5.030 -5.434
630 HD23 LEU 76 HD23 LEU 76 4.383 4.567 -3.882
631 H ARG 77 H ARG 77 2.220 8.112 -0.668
632 HA ARG 77 HA ARG 77 3.953 8.077 1.524
633 HB2 ARG 77 HB2 ARG 77 1.093 9.028 1.313
634 HB3 ARG 77 HB3 ARG 77 2.103 9.298 2.726
635 HG2 ARG 77 HG2 ARG 77 3.656 10.600 1.401
636 HG3 ARG 77 HG3 ARG 77 2.708 10.281 -0.054
637 HD2 ARG 77 HD2 ARG 77 0.818 11.466 0.877
638 HD3 ARG 77 HD3 ARG 77 1.679 11.703 2.396
639 HE ARG 77 HE ARG 77 3.276 13.078 1.062
640 HH11 ARG 77 HH11 ARG 77 -0.007 12.606 -0.037
641 HH12 ARG 77 HH12 ARG 77 -0.074 14.102 -0.918
642 HH21 ARG 77 HH21 ARG 77 3.206 15.058 -0.086
643 HH22 ARG 77 HH22 ARG 77 1.773 15.488 -0.967
644 H TRP 78 H TRP 78 0.762 6.589 1.132
645 HA TRP 78 HA TRP 78 0.623 5.450 3.712
646 HB2 TRP 78 HB2 TRP 78 -1.289 5.821 2.085
647 HB3 TRP 78 HB3 TRP 78 -0.726 4.399 1.218
648 HD1 TRP 78 HD1 TRP 78 -1.075 2.011 2.421
649 HE1 TRP 78 HE1 TRP 78 -2.686 1.264 4.283
650 HE3 TRP 78 HE3 TRP 78 -2.426 6.600 4.216
651 HZ2 TRP 78 HZ2 TRP 78 -4.313 2.461 6.251
652 HZ3 TRP 78 HZ3 TRP 78 -4.014 6.713 6.091
653 HH2 TRP 78 HH2 TRP 78 -4.937 4.684 7.086
654 H LEU 79 H LEU 79 1.752 4.201 0.597
655 HA LEU 79 HA LEU 79 2.231 1.554 1.389
656 HB2 LEU 79 HB2 LEU 79 3.613 3.228 -0.704
657 HB3 LEU 79 HB3 LEU 79 3.828 1.499 -0.527
658 HG LEU 79 HG LEU 79 1.207 2.846 -1.164
659 HD11 LEU 79 HD11 LEU 79 3.128 1.356 -2.948
660 HD12 LEU 79 HD12 LEU 79 2.781 3.085 -2.999
661 HD13 LEU 79 HD13 LEU 79 1.522 1.921 -3.412
662 HD21 LEU 79 HD21 LEU 79 0.445 0.573 -1.657
663 HD22 LEU 79 HD22 LEU 79 0.935 0.741 0.029
664 HD23 LEU 79 HD23 LEU 79 2.001 -0.063 -1.122
665 H LYS 80 H LYS 80 4.421 4.367 1.331
666 HA LYS 80 HA LYS 80 6.685 2.940 2.186
667 HB2 LYS 80 HB2 LYS 80 7.008 5.033 1.103
668 HB3 LYS 80 HB3 LYS 80 5.971 5.868 2.251
669 HG2 LYS 80 HG2 LYS 80 8.309 4.527 3.418
670 HG3 LYS 80 HG3 LYS 80 8.663 5.882 2.341
671 HD2 LYS 80 HD2 LYS 80 6.640 6.059 4.555
672 HD3 LYS 80 HD3 LYS 80 8.346 6.421 4.799
673 HE2 LYS 80 HE2 LYS 80 6.663 7.737 2.683
674 HE3 LYS 80 HE3 LYS 80 6.863 8.400 4.302
675 HZ1 LYS 80 HZ1 LYS 80 9.263 8.492 3.921
676 HZ2 LYS 80 HZ2 LYS 80 8.426 9.406 2.762
677 HZ3 LYS 80 HZ3 LYS 80 9.053 7.883 2.351
678 H ARG 81 H ARG 81 4.197 4.740 3.944
679 HA ARG 81 HA ARG 81 5.312 4.442 6.522
680 HB2 ARG 81 HB2 ARG 81 2.464 4.803 5.603
681 HB3 ARG 81 HB3 ARG 81 2.920 4.748 7.297
682 HG2 ARG 81 HG2 ARG 81 4.331 6.718 6.980
683 HG3 ARG 81 HG3 ARG 81 3.861 6.772 5.278
684 HD2 ARG 81 HD2 ARG 81 1.558 7.123 5.871
685 HD3 ARG 81 HD3 ARG 81 1.925 6.909 7.580
686 HE ARG 81 HE ARG 81 3.312 9.085 6.252
687 HH11 ARG 81 HH11 ARG 81 0.549 8.084 8.154
688 HH12 ARG 81 HH12 ARG 81 0.227 9.680 8.765
689 HH21 ARG 81 HH21 ARG 81 2.899 11.188 7.076
690 HH22 ARG 81 HH22 ARG 81 1.559 11.431 8.154
691 H MET 82 H MET 82 3.024 2.467 4.682
692 HA MET 82 HA MET 82 2.433 0.596 6.684
693 HB2 MET 82 HB2 MET 82 1.136 0.832 4.612
694 HB3 MET 82 HB3 MET 82 2.491 0.206 3.685
695 HG2 MET 82 HG2 MET 82 2.301 -1.934 4.816
696 HG3 MET 82 HG3 MET 82 0.975 -1.309 5.797
697 HE1 MET 82 HE1 MET 82 1.670 -0.589 2.005
698 HE2 MET 82 HE2 MET 82 0.706 -1.841 1.220
699 HE3 MET 82 HE3 MET 82 2.133 -2.285 2.159
700 H PHE 83 H PHE 83 4.924 0.545 4.151
701 HA PHE 83 HA PHE 83 6.023 -1.934 5.075
702 HB2 PHE 83 HB2 PHE 83 7.089 0.148 3.163
703 HB3 PHE 83 HB3 PHE 83 7.905 -1.374 3.512
704 HD1 PHE 83 HD1 PHE 83 5.981 -3.400 3.486
705 HD2 PHE 83 HD2 PHE 83 6.084 0.120 1.098
706 HE1 PHE 83 HE1 PHE 83 4.645 -4.536 1.761
707 HE2 PHE 83 HE2 PHE 83 4.745 -1.008 -0.628
708 HZ PHE 83 HZ PHE 83 4.023 -3.339 -0.296
709 H ASN 84 H ASN 84 6.481 1.409 5.844
710 HA ASN 84 HA ASN 84 8.954 1.146 7.216
711 HB2 ASN 84 HB2 ASN 84 8.028 3.334 6.519
712 HB3 ASN 84 HB3 ASN 84 6.713 3.135 7.672
713 HD21 ASN 84 HD21 ASN 84 7.068 3.537 9.808
714 HD22 ASN 84 HD22 ASN 84 8.535 4.224 10.421
715 H TYR 85 H TYR 85 5.587 0.683 8.104
716 HA TYR 85 HA TYR 85 5.917 0.273 10.865
717 HB2 TYR 85 HB2 TYR 85 3.709 0.548 9.887
718 HB3 TYR 85 HB3 TYR 85 3.908 -0.919 8.936
719 HD1 TYR 85 HD2 TYR 85 3.498 0.375 12.382
720 HD2 TYR 85 HD1 TYR 85 3.440 -3.048 9.855
721 HE1 TYR 85 HE2 TYR 85 2.535 -0.959 14.213
722 HE2 TYR 85 HE1 TYR 85 2.481 -4.384 11.675
723 HH TYR 85 HH TYR 85 1.103 -3.112 14.383
724 H ALA 86 H ALA 86 6.381 -1.852 8.096
725 HA ALA 86 HA ALA 86 6.747 -4.252 9.550
726 HB1 ALA 86 HB1 ALA 86 7.762 -5.118 7.505
727 HB2 ALA 86 HB2 ALA 86 7.852 -3.481 6.851
728 HB3 ALA 86 HB3 ALA 86 6.282 -4.227 7.151
729 H ILE 87 H ILE 87 8.874 -1.622 8.650
730 HA ILE 87 HA ILE 87 11.262 -2.905 9.619
731 HB ILE 87 HB ILE 87 10.772 0.020 9.009
732 HG12 ILE 87 HG12 ILE 87 12.017 -2.153 7.304
733 HG13 ILE 87 HG13 ILE 87 10.413 -1.469 7.066
734 HG21 ILE 87 HG21 ILE 87 12.693 -0.309 10.473
735 HG22 ILE 87 HG22 ILE 87 13.221 0.176 8.862
736 HG23 ILE 87 HG23 ILE 87 13.354 -1.511 9.363
737 HD11 ILE 87 HD11 ILE 87 11.409 0.707 6.608
738 HD12 ILE 87 HD12 ILE 87 12.012 -0.532 5.506
739 HD13 ILE 87 HD13 ILE 87 13.017 0.022 6.847
740 H LYS 88 H LYS 88 8.875 -0.637 10.813
741 HA LYS 88 HA LYS 88 9.980 -0.003 13.298
742 HB2 LYS 88 HB2 LYS 88 8.069 1.174 12.438
743 HB3 LYS 88 HB3 LYS 88 7.120 -0.297 12.364
744 HG2 LYS 88 HG2 LYS 88 8.114 0.627 15.013
745 HG3 LYS 88 HG3 LYS 88 6.765 1.481 14.260
746 HD2 LYS 88 HD2 LYS 88 5.751 -0.873 13.942
747 HD3 LYS 88 HD3 LYS 88 6.935 -1.381 15.147
748 HE2 LYS 88 HE2 LYS 88 4.800 0.717 15.487
749 HE3 LYS 88 HE3 LYS 88 4.810 -0.892 16.201
750 HZ1 LYS 88 HZ1 LYS 88 5.520 0.614 17.860
751 HZ2 LYS 88 HZ2 LYS 88 6.614 1.377 16.822
752 HZ3 LYS 88 HZ3 LYS 88 6.916 -0.208 17.350
753 H ARG 89 H ARG 89 7.837 -2.688 12.377
754 HA ARG 89 HA ARG 89 8.032 -4.009 14.904
755 HB2 ARG 89 HB2 ARG 89 7.002 -4.758 12.202
756 HB3 ARG 89 HB3 ARG 89 7.316 -6.034 13.367
757 HG2 ARG 89 HG2 ARG 89 5.838 -4.708 14.964
758 HG3 ARG 89 HG3 ARG 89 5.337 -3.791 13.537
759 HD2 ARG 89 HD2 ARG 89 4.548 -5.789 12.461
760 HD3 ARG 89 HD3 ARG 89 5.216 -6.798 13.740
761 HE ARG 89 HE ARG 89 2.917 -4.966 14.078
762 HH11 ARG 89 HH11 ARG 89 4.717 -7.838 14.973
763 HH12 ARG 89 HH12 ARG 89 3.470 -8.453 16.007
764 HH21 ARG 89 HH21 ARG 89 1.239 -5.806 15.393
765 HH22 ARG 89 HH22 ARG 89 1.484 -7.323 16.216
766 H HIS 90 H HIS 90 10.173 -3.611 12.355
767 HA HIS 90 HA HIS 90 12.195 -4.462 11.818
768 HB2 HIS 90 HB2 HIS 90 11.959 -5.530 14.628
769 HB3 HIS 90 HB3 HIS 90 13.395 -5.776 13.639
770 HD1 HIS 90 HD1 HIS 90 11.949 -3.436 15.993
771 HD2 HIS 90 HD2 HIS 90 14.529 -3.200 12.741
772 HE1 HIS 90 HE1 HIS 90 13.135 -1.234 16.226
773 HE2 HIS 90 HE2 HIS 90 14.621 -1.066 14.192
774 H ILE 91 H ILE 91 10.014 -5.761 10.825
775 HA ILE 91 HA ILE 91 10.387 -8.623 11.073
776 HB ILE 91 HB ILE 91 8.626 -7.021 9.205
777 HG12 ILE 91 HG12 ILE 91 7.941 -8.555 11.720
778 HG13 ILE 91 HG13 ILE 91 8.034 -6.801 11.599
779 HG21 ILE 91 HG21 ILE 91 7.465 -9.141 8.782
780 HG22 ILE 91 HG22 ILE 91 8.666 -9.986 9.757
781 HG23 ILE 91 HG23 ILE 91 9.147 -9.198 8.256
782 HD11 ILE 91 HD11 ILE 91 6.096 -8.580 10.135
783 HD12 ILE 91 HD12 ILE 91 6.186 -6.825 10.000
784 HD13 ILE 91 HD13 ILE 91 5.734 -7.569 11.535
785 H ILE 92 H ILE 92 10.522 -6.315 8.354
786 HA ILE 92 HA ILE 92 12.512 -8.082 7.092
787 HB ILE 92 HB ILE 92 11.730 -7.302 4.902
788 HG12 ILE 92 HG12 ILE 92 9.427 -6.003 6.364
789 HG13 ILE 92 HG13 ILE 92 10.823 -5.111 5.773
790 HG21 ILE 92 HG21 ILE 92 10.821 -9.370 5.757
791 HG22 ILE 92 HG22 ILE 92 9.572 -8.498 4.866
792 HG23 ILE 92 HG23 ILE 92 9.564 -8.491 6.628
793 HD11 ILE 92 HD11 ILE 92 10.285 -5.815 3.489
794 HD12 ILE 92 HD12 ILE 92 8.968 -4.914 4.240
795 HD13 ILE 92 HD13 ILE 92 8.867 -6.670 4.099
796 H GLU 93 H GLU 93 14.066 -7.040 5.729
797 HA GLU 93 HA GLU 93 14.451 -4.180 6.278
798 HB2 GLU 93 HB2 GLU 93 16.085 -5.505 7.534
799 HB3 GLU 93 HB3 GLU 93 16.580 -6.317 6.059
800 HG2 GLU 93 HG2 GLU 93 17.466 -4.266 5.168
801 HG3 GLU 93 HG3 GLU 93 16.866 -3.365 6.559
802 H TYR 94 H TYR 94 13.414 -3.640 4.361
803 HA TYR 94 HA TYR 94 14.963 -3.829 1.947
804 HB2 TYR 94 HB2 TYR 94 12.598 -5.565 2.368
805 HB3 TYR 94 HB3 TYR 94 12.644 -4.701 0.837
806 HD1 TYR 94 HD1 TYR 94 14.746 -4.952 -0.593
807 HD2 TYR 94 HD2 TYR 94 13.810 -7.552 2.640
808 HE1 TYR 94 HE1 TYR 94 16.252 -6.647 -1.531
809 HE2 TYR 94 HE2 TYR 94 15.320 -9.258 1.710
810 HH TYR 94 HH TYR 94 17.509 -8.556 -0.859
811 H ASN 95 H ASN 95 11.656 -3.234 3.107
812 HA ASN 95 HA ASN 95 10.110 -1.659 2.674
813 HB2 ASN 95 HB2 ASN 95 11.986 -0.210 3.646
814 HB3 ASN 95 HB3 ASN 95 12.333 0.254 1.982
815 HD21 ASN 95 HD21 ASN 95 10.068 0.440 4.597
816 HD22 ASN 95 HD22 ASN 95 9.091 1.695 3.930
817 HA PRO 96 HA PRO 96 10.321 -2.630 -1.803
818 HB2 PRO 96 HB2 PRO 96 7.439 -3.065 -1.408
819 HB3 PRO 96 HB3 PRO 96 8.663 -4.161 -2.057
820 HG2 PRO 96 HG2 PRO 96 7.566 -4.546 0.364
821 HG3 PRO 96 HG3 PRO 96 9.261 -4.941 0.031
822 HD2 PRO 96 HD2 PRO 96 8.110 -2.558 1.428
823 HD3 PRO 96 HD3 PRO 96 9.542 -3.524 1.843
824 H ALA 97 H ALA 97 8.816 -0.187 -0.028
825 HA ALA 97 HA ALA 97 7.228 0.991 -2.096
826 HB1 ALA 97 HB1 ALA 97 6.770 1.422 0.268
827 HB2 ALA 97 HB2 ALA 97 7.091 2.923 -0.603
828 HB3 ALA 97 HB3 ALA 97 8.336 2.218 0.429
829 H ALA 98 H ALA 98 10.532 0.819 -1.441
830 HA ALA 98 HA ALA 98 11.439 3.273 -2.515
831 HB1 ALA 98 HB1 ALA 98 13.623 2.217 -2.578
832 HB2 ALA 98 HB2 ALA 98 12.882 0.633 -2.343
833 HB3 ALA 98 HB3 ALA 98 12.798 1.843 -1.064
834 H ALA 99 H ALA 99 9.832 0.829 -4.025
835 HA ALA 99 HA ALA 99 11.154 0.404 -6.443
836 HB1 ALA 99 HB1 ALA 99 9.197 -0.872 -5.697
837 HB2 ALA 99 HB2 ALA 99 8.986 -0.239 -7.330
838 HB3 ALA 99 HB3 ALA 99 8.181 0.543 -5.969
839 H PHE 100 H PHE 100 9.285 3.136 -5.337
840 HA PHE 100 HA PHE 100 9.829 4.464 -7.906
841 HB2 PHE 100 HB2 PHE 100 7.388 3.793 -7.581
842 HB3 PHE 100 HB3 PHE 100 7.342 4.949 -6.256
843 HD1 PHE 100 HD1 PHE 100 7.455 7.341 -6.687
844 HD2 PHE 100 HD2 PHE 100 7.491 4.512 -9.863
845 HE1 PHE 100 HE1 PHE 100 6.943 9.140 -8.289
846 HE2 PHE 100 HE2 PHE 100 6.982 6.300 -11.469
847 HZ PHE 100 HZ PHE 100 6.707 8.616 -10.685
848 H ASP 101 H ASP 101 10.814 6.398 -7.716
849 HA ASP 101 HA ASP 101 11.113 7.468 -4.992
850 HB2 ASP 101 HB2 ASP 101 13.244 6.806 -5.865
851 HB3 ASP 101 HB3 ASP 101 12.942 7.637 -7.390
852 HA PRO 102 HA PRO 102 9.008 11.001 -6.848
853 HB2 PRO 102 HB2 PRO 102 7.405 11.539 -4.786
854 HB3 PRO 102 HB3 PRO 102 7.069 10.182 -5.867
855 HG2 PRO 102 HG2 PRO 102 8.167 10.173 -3.107
856 HG3 PRO 102 HG3 PRO 102 7.150 8.973 -3.920
857 HD2 PRO 102 HD2 PRO 102 9.965 8.881 -3.585
858 HD3 PRO 102 HD3 PRO 102 8.969 7.794 -4.570
859 H GLY 103 H GLY 103 11.225 10.557 -4.384
860 HA2 GLY 103 HA2 GLY 103 12.679 12.041 -3.384
861 HA3 GLY 103 HA3 GLY 103 11.813 13.364 -4.154
862 H ASP 104 H ASP 104 12.383 14.125 -1.860
863 HA ASP 104 HA ASP 104 9.971 13.702 -0.215
864 HB2 ASP 104 HB2 ASP 104 12.812 14.104 0.748
865 HB3 ASP 104 HB3 ASP 104 11.402 14.236 1.792
866 H ALA 105 H ALA 105 12.430 15.866 -1.425
867 HA ALA 105 HA ALA 105 10.650 18.128 -1.045
868 HB1 ALA 105 HB1 ALA 105 12.307 19.496 0.106
869 HB2 ALA 105 HB2 ALA 105 13.418 18.127 0.161
870 HB3 ALA 105 HB3 ALA 105 11.901 18.069 1.059
871 H GLY 106 H GLY 106 10.573 18.902 -3.054
872 HA2 GLY 106 HA2 GLY 106 12.937 19.922 -4.292
873 HA3 GLY 106 HA3 GLY 106 12.346 18.483 -5.107
874 H GLY 107 H GLY 107 12.268 21.754 -5.123
875 HA2 GLY 107 HA2 GLY 107 10.370 21.798 -7.236
876 HA3 GLY 107 HA3 GLY 107 9.701 22.518 -5.773
877 H LYS 108 H LYS 108 11.306 24.033 -4.663
878 HA LYS 108 HA LYS 108 13.342 25.310 -6.119
879 HB2 LYS 108 HB2 LYS 108 12.195 27.546 -6.361
880 HB3 LYS 108 HB3 LYS 108 11.685 26.304 -7.494
881 HG2 LYS 108 HG2 LYS 108 9.662 25.924 -6.249
882 HG3 LYS 108 HG3 LYS 108 10.188 27.037 -4.984
883 HD2 LYS 108 HD2 LYS 108 9.598 27.745 -7.858
884 HD3 LYS 108 HD3 LYS 108 8.596 28.129 -6.456
885 HE2 LYS 108 HE2 LYS 108 10.448 29.444 -5.522
886 HE3 LYS 108 HE3 LYS 108 11.402 29.096 -6.961
887 HZ1 LYS 108 HZ1 LYS 108 10.365 31.279 -7.057
888 HZ2 LYS 108 HZ2 LYS 108 8.826 30.579 -6.925
889 HZ3 LYS 108 HZ3 LYS 108 9.780 30.279 -8.295
890 H LEU 109 H LEU 109 10.813 25.813 -3.697
891 HA LEU 109 HA LEU 109 10.797 26.830 -1.661
892 HB2 LEU 109 HB2 LEU 109 11.796 24.595 -1.263
893 HB3 LEU 109 HB3 LEU 109 13.389 25.317 -1.386
894 HG LEU 109 HG LEU 109 12.933 26.690 0.596
895 HD11 LEU 109 HD11 LEU 109 10.525 26.934 0.349
896 HD12 LEU 109 HD12 LEU 109 10.925 26.275 1.936
897 HD13 LEU 109 HD13 LEU 109 10.304 25.214 0.671
898 HD21 LEU 109 HD21 LEU 109 12.926 24.883 2.246
899 HD22 LEU 109 HD22 LEU 109 13.973 24.501 0.878
900 HD23 LEU 109 HD23 LEU 109 12.382 23.752 1.006
901 H GLU 110 H GLU 110 11.137 28.964 -2.623
902 HA GLU 110 HA GLU 110 13.753 30.089 -1.886
903 HB2 GLU 110 HB2 GLU 110 13.444 31.803 -3.540
904 HB3 GLU 110 HB3 GLU 110 13.183 30.246 -4.317
905 HG2 GLU 110 HG2 GLU 110 10.917 30.587 -4.543
906 HG3 GLU 110 HG3 GLU 110 10.857 31.761 -3.229
907 H HIS 111 H HIS 111 13.707 32.300 -1.088
908 HA HIS 111 HA HIS 111 11.120 33.305 -0.189
909 HB2 HIS 111 HB2 HIS 111 13.506 32.888 1.626
910 HB3 HIS 111 HB3 HIS 111 12.157 33.942 2.030
911 HD1 HIS 111 HD1 HIS 111 9.744 32.647 2.096
912 HD2 HIS 111 HD2 HIS 111 13.168 30.306 2.390
913 HE1 HIS 111 HE1 HIS 111 8.982 30.450 3.054
914 HE2 HIS 111 HE2 HIS 111 11.096 29.113 3.392
915 H HIS 112 H HIS 112 11.058 35.119 -1.381
916 HA HIS 112 HA HIS 112 13.496 36.749 -1.468
917 HB2 HIS 112 HB2 HIS 112 12.355 38.032 -3.293
918 HB3 HIS 112 HB3 HIS 112 12.693 36.353 -3.678
919 HD1 HIS 112 HD1 HIS 112 10.750 34.877 -4.290
920 HD2 HIS 112 HD2 HIS 112 9.582 38.636 -2.937
921 HE1 HIS 112 HE1 HIS 112 8.297 35.058 -4.819
922 HE2 HIS 112 HE2 HIS 112 7.670 37.419 -4.197
923 H HIS 113 H HIS 113 13.684 38.531 -0.383
924 HA HIS 113 HA HIS 113 11.294 39.632 0.940
925 HB2 HIS 113 HB2 HIS 113 12.742 38.294 2.475
926 HB3 HIS 113 HB3 HIS 113 14.076 39.383 2.120
927 HD1 HIS 113 HD1 HIS 113 14.174 41.567 3.382
928 HD2 HIS 113 HD2 HIS 113 10.660 39.446 4.060
929 HE1 HIS 113 HE1 HIS 113 13.033 42.731 5.297
930 HE2 HIS 113 HE2 HIS 113 11.008 41.318 5.810
931 H HIS 114 H HIS 114 10.977 41.728 0.551
932 HA HIS 114 HA HIS 114 13.083 43.244 -0.773
933 HB2 HIS 114 HB2 HIS 114 10.131 43.606 -0.449
934 HB3 HIS 114 HB3 HIS 114 11.134 45.001 -0.832
935 HD1 HIS 114 HD1 HIS 114 8.966 43.179 -2.628
936 HD2 HIS 114 HD2 HIS 114 13.078 43.658 -3.068
937 HE1 HIS 114 HE1 HIS 114 9.461 42.693 -5.051
938 HE2 HIS 114 HE2 HIS 114 11.971 42.812 -5.245
939 H HIS 115 H HIS 115 14.391 44.513 0.294
940 HA HIS 115 HA HIS 115 13.301 46.077 2.537
941 HB2 HIS 115 HB2 HIS 115 14.916 44.407 3.411
942 HB3 HIS 115 HB3 HIS 115 16.142 45.037 2.316
943 HD1 HIS 115 HD1 HIS 115 14.422 45.732 5.543
944 HD2 HIS 115 HD2 HIS 115 17.227 47.551 3.070
945 HE1 HIS 115 HE1 HIS 115 15.409 47.606 6.894
946 HE2 HIS 115 HE2 HIS 115 16.926 48.823 5.300
947 H HIS 116 H HIS 116 13.172 48.108 1.932
948 HA HIS 116 HA HIS 116 14.690 49.013 -0.388
949 HB2 HIS 116 HB2 HIS 116 12.146 49.349 0.019
950 HB3 HIS 116 HB3 HIS 116 12.646 50.646 1.097
951 HD1 HIS 116 HD1 HIS 116 13.782 52.738 -0.010
952 HD2 HIS 116 HD2 HIS 116 12.324 49.893 -2.678
953 HE1 HIS 116 HE1 HIS 116 13.724 53.872 -2.261
954 HE2 HIS 116 HE2 HIS 116 12.865 52.126 -3.866
Start of MODEL 17
1 H1 MET 1 H1 MET 1 -5.365 -8.296 13.084
2 H2 MET 1 H2 MET 1 -4.373 -9.386 12.264
3 H3 MET 1 H3 MET 1 -3.932 -8.842 13.805
4 HA MET 1 HA MET 1 -5.921 -9.902 14.728
5 HB2 MET 1 HB2 MET 1 -7.203 -9.840 12.600
6 HB3 MET 1 HB3 MET 1 -6.154 -11.096 11.958
7 HG2 MET 1 HG2 MET 1 -6.930 -12.638 13.671
8 HG3 MET 1 HG3 MET 1 -7.954 -11.380 14.355
9 HE1 MET 1 HE1 MET 1 -9.137 -14.189 13.633
10 HE2 MET 1 HE2 MET 1 -10.615 -13.747 12.779
11 HE3 MET 1 HE3 MET 1 -10.130 -12.852 14.218
12 H ALA 2 H ALA 2 -3.801 -11.381 12.260
13 HA ALA 2 HA ALA 2 -2.011 -12.760 12.471
14 HB1 ALA 2 HB1 ALA 2 -1.423 -11.574 14.529
15 HB2 ALA 2 HB2 ALA 2 -1.024 -13.289 14.615
16 HB3 ALA 2 HB3 ALA 2 -2.452 -12.673 15.445
17 H GLU 3 H GLU 3 -4.240 -13.782 15.006
18 HA GLU 3 HA GLU 3 -5.494 -15.651 15.309
19 HB2 GLU 3 HB2 GLU 3 -4.833 -16.249 12.428
20 HB3 GLU 3 HB3 GLU 3 -6.018 -17.111 13.396
21 HG2 GLU 3 HG2 GLU 3 -7.386 -15.155 13.561
22 HG3 GLU 3 HG3 GLU 3 -6.156 -14.181 12.751
23 H LYS 4 H LYS 4 -3.146 -16.973 12.999
24 HA LYS 4 HA LYS 4 -2.665 -19.101 14.956
25 HB2 LYS 4 HB2 LYS 4 -1.978 -20.459 12.969
26 HB3 LYS 4 HB3 LYS 4 -3.655 -19.939 12.947
27 HG2 LYS 4 HG2 LYS 4 -2.701 -17.960 11.516
28 HG3 LYS 4 HG3 LYS 4 -1.380 -19.093 11.224
29 HD2 LYS 4 HD2 LYS 4 -2.960 -19.360 9.457
30 HD3 LYS 4 HD3 LYS 4 -3.108 -20.771 10.508
31 HE2 LYS 4 HE2 LYS 4 -5.070 -19.833 11.557
32 HE3 LYS 4 HE3 LYS 4 -4.883 -18.336 10.647
33 HZ1 LYS 4 HZ1 LYS 4 -5.229 -19.624 8.599
34 HZ2 LYS 4 HZ2 LYS 4 -6.569 -19.673 9.638
35 HZ3 LYS 4 HZ3 LYS 4 -5.529 -21.011 9.533
36 H ASN 5 H ASN 5 -0.867 -17.422 12.365
37 HA ASN 5 HA ASN 5 1.370 -16.803 13.955
38 HB2 ASN 5 HB2 ASN 5 1.719 -19.249 13.944
39 HB3 ASN 5 HB3 ASN 5 1.688 -19.246 12.186
40 HD21 ASN 5 HD21 ASN 5 3.529 -18.504 15.025
41 HD22 ASN 5 HD22 ASN 5 5.038 -18.209 14.220
42 H ALA 6 H ALA 6 2.505 -15.280 12.923
43 HA ALA 6 HA ALA 6 3.376 -13.948 11.315
44 HB1 ALA 6 HB1 ALA 6 3.808 -14.847 9.097
45 HB2 ALA 6 HB2 ALA 6 2.748 -16.215 9.433
46 HB3 ALA 6 HB3 ALA 6 4.241 -16.013 10.347
47 H TYR 7 H TYR 7 2.796 -13.155 8.895
48 HA TYR 7 HA TYR 7 -0.091 -12.699 8.704
49 HB2 TYR 7 HB2 TYR 7 1.966 -10.471 8.616
50 HB3 TYR 7 HB3 TYR 7 0.232 -10.291 8.407
51 HD1 TYR 7 HD1 TYR 7 2.898 -11.018 10.858
52 HD2 TYR 7 HD2 TYR 7 -1.218 -10.090 10.299
53 HE1 TYR 7 HE1 TYR 7 2.682 -10.563 13.263
54 HE2 TYR 7 HE2 TYR 7 -1.444 -9.637 12.707
55 HH TYR 7 HH TYR 7 -0.417 -9.986 14.764
56 H THR 8 H THR 8 -0.592 -11.576 6.576
57 HA THR 8 HA THR 8 1.517 -12.026 4.567
58 HB THR 8 HB THR 8 -0.230 -12.124 2.853
59 HG1 THR 8 HG1 THR 8 -2.340 -11.856 3.326
60 HG21 THR 8 HG21 THR 8 0.468 -14.223 3.920
61 HG22 THR 8 HG22 THR 8 -1.224 -14.279 3.424
62 HG23 THR 8 HG23 THR 8 -0.809 -14.034 5.121
63 H VAL 9 H VAL 9 0.833 -10.392 2.573
64 HA VAL 9 HA VAL 9 1.374 -7.806 3.551
65 HB VAL 9 HB VAL 9 2.041 -8.464 1.314
66 HG11 VAL 9 HG11 VAL 9 0.178 -9.910 0.747
67 HG12 VAL 9 HG12 VAL 9 0.424 -8.690 -0.502
68 HG13 VAL 9 HG13 VAL 9 -0.897 -8.514 0.653
69 HG21 VAL 9 HG21 VAL 9 0.067 -6.182 1.302
70 HG22 VAL 9 HG22 VAL 9 1.291 -6.471 0.064
71 HG23 VAL 9 HG23 VAL 9 1.780 -6.093 1.715
72 H ALA 10 H ALA 10 -1.624 -9.461 2.813
73 HA ALA 10 HA ALA 10 -3.286 -7.148 2.892
74 HB1 ALA 10 HB1 ALA 10 -5.148 -8.713 3.050
75 HB2 ALA 10 HB2 ALA 10 -4.020 -10.037 3.352
76 HB3 ALA 10 HB3 ALA 10 -4.010 -9.207 1.795
77 H GLN 11 H GLN 11 -2.617 -9.727 5.277
78 HA GLN 11 HA GLN 11 -4.183 -8.618 7.323
79 HB2 GLN 11 HB2 GLN 11 -1.912 -10.573 7.332
80 HB3 GLN 11 HB3 GLN 11 -2.564 -9.971 8.849
81 HG2 GLN 11 HG2 GLN 11 -3.752 -11.911 8.553
82 HG3 GLN 11 HG3 GLN 11 -4.847 -10.715 7.867
83 HE21 GLN 11 HE21 GLN 11 -2.711 -13.357 7.233
84 HE22 GLN 11 HE22 GLN 11 -3.194 -13.621 5.590
85 H LEU 12 H LEU 12 -0.890 -7.969 6.332
86 HA LEU 12 HA LEU 12 -0.021 -6.525 8.574
87 HB2 LEU 12 HB2 LEU 12 1.484 -7.241 6.785
88 HB3 LEU 12 HB3 LEU 12 0.689 -6.158 5.660
89 HG LEU 12 HG LEU 12 1.467 -4.228 7.010
90 HD11 LEU 12 HD11 LEU 12 3.008 -6.315 8.543
91 HD12 LEU 12 HD12 LEU 12 1.663 -5.360 9.162
92 HD13 LEU 12 HD13 LEU 12 3.173 -4.568 8.717
93 HD21 LEU 12 HD21 LEU 12 3.792 -4.345 6.304
94 HD22 LEU 12 HD22 LEU 12 2.731 -5.007 5.061
95 HD23 LEU 12 HD23 LEU 12 3.658 -6.090 6.100
96 H ALA 13 H ALA 13 -1.707 -5.464 5.642
97 HA ALA 13 HA ALA 13 -1.755 -2.714 6.282
98 HB1 ALA 13 HB1 ALA 13 -3.390 -2.508 4.508
99 HB2 ALA 13 HB2 ALA 13 -3.652 -4.251 4.515
100 HB3 ALA 13 HB3 ALA 13 -2.094 -3.595 4.011
101 H ASP 14 H ASP 14 -4.130 -5.310 6.755
102 HA ASP 14 HA ASP 14 -6.110 -3.600 7.873
103 HB2 ASP 14 HB2 ASP 14 -5.784 -6.592 7.788
104 HB3 ASP 14 HB3 ASP 14 -7.123 -5.829 8.640
105 H GLU 15 H GLU 15 -3.415 -5.368 9.229
106 HA GLU 15 HA GLU 15 -4.212 -5.067 11.958
107 HB2 GLU 15 HB2 GLU 15 -2.507 -6.715 11.193
108 HB3 GLU 15 HB3 GLU 15 -1.425 -5.383 10.813
109 HG2 GLU 15 HG2 GLU 15 -0.819 -6.373 12.924
110 HG3 GLU 15 HG3 GLU 15 -1.410 -4.731 13.172
111 H TYR 16 H TYR 16 -2.192 -3.241 9.723
112 HA TYR 16 HA TYR 16 -1.455 -1.160 11.474
113 HB2 TYR 16 HB2 TYR 16 -0.394 -1.632 9.268
114 HB3 TYR 16 HB3 TYR 16 -1.846 -1.042 8.473
115 HD1 TYR 16 HD1 TYR 16 0.887 0.004 10.767
116 HD2 TYR 16 HD2 TYR 16 -2.072 1.232 7.968
117 HE1 TYR 16 HE1 TYR 16 1.827 2.277 10.780
118 HE2 TYR 16 HE2 TYR 16 -1.142 3.506 7.977
119 HH TYR 16 HH TYR 16 0.207 4.938 9.479
120 H PHE 17 H PHE 17 -4.247 -1.682 9.406
121 HA PHE 17 HA PHE 17 -5.538 0.768 9.589
122 HB2 PHE 17 HB2 PHE 17 -6.327 -0.971 8.108
123 HB3 PHE 17 HB3 PHE 17 -6.670 -2.036 9.464
124 HD1 PHE 17 HD1 PHE 17 -7.773 0.932 7.617
125 HD2 PHE 17 HD2 PHE 17 -8.679 -1.793 10.758
126 HE1 PHE 17 HE1 PHE 17 -10.078 1.787 7.691
127 HE2 PHE 17 HE2 PHE 17 -10.985 -0.943 10.836
128 HZ PHE 17 HZ PHE 17 -11.687 0.850 9.302
129 H GLU 18 H GLU 18 -5.831 -2.035 11.731
130 HA GLU 18 HA GLU 18 -7.754 -1.003 13.463
131 HB2 GLU 18 HB2 GLU 18 -5.584 -3.053 13.862
132 HB3 GLU 18 HB3 GLU 18 -6.805 -2.709 15.078
133 HG2 GLU 18 HG2 GLU 18 -7.541 -3.480 12.282
134 HG3 GLU 18 HG3 GLU 18 -7.192 -4.685 13.522
135 H ARG 19 H ARG 19 -4.417 -0.228 13.210
136 HA ARG 19 HA ARG 19 -4.357 0.781 15.961
137 HB2 ARG 19 HB2 ARG 19 -2.071 0.281 14.049
138 HB3 ARG 19 HB3 ARG 19 -1.926 0.740 15.745
139 HG2 ARG 19 HG2 ARG 19 -2.941 -1.319 16.447
140 HG3 ARG 19 HG3 ARG 19 -3.279 -1.766 14.777
141 HD2 ARG 19 HD2 ARG 19 -0.811 -1.764 14.370
142 HD3 ARG 19 HD3 ARG 19 -0.584 -1.533 16.105
143 HE ARG 19 HE ARG 19 -2.156 -3.822 15.146
144 HH11 ARG 19 HH11 ARG 19 0.748 -2.599 16.681
145 HH12 ARG 19 HH12 ARG 19 1.181 -4.129 17.380
146 HH21 ARG 19 HH21 ARG 19 -1.594 -5.829 16.035
147 HH22 ARG 19 HH22 ARG 19 -0.146 -5.990 16.978
148 H MET 20 H MET 20 -3.317 1.819 12.689
149 HA MET 20 HA MET 20 -2.796 4.482 13.707
150 HB2 MET 20 HB2 MET 20 -1.302 3.426 12.055
151 HB3 MET 20 HB3 MET 20 -2.613 3.405 10.887
152 HG2 MET 20 HG2 MET 20 -0.971 5.220 10.545
153 HG3 MET 20 HG3 MET 20 -2.623 5.787 10.743
154 HE1 MET 20 HE1 MET 20 0.928 5.464 12.353
155 HE2 MET 20 HE2 MET 20 -0.064 4.558 13.495
156 HE3 MET 20 HE3 MET 20 0.660 6.092 13.979
157 H ILE 21 H ILE 21 -5.315 2.875 11.941
158 HA ILE 21 HA ILE 21 -6.585 5.342 11.082
159 HB ILE 21 HB ILE 21 -7.337 2.432 10.807
160 HG12 ILE 21 HG12 ILE 21 -7.214 3.052 8.357
161 HG13 ILE 21 HG13 ILE 21 -6.564 4.608 8.858
162 HG21 ILE 21 HG21 ILE 21 -9.291 3.102 9.514
163 HG22 ILE 21 HG22 ILE 21 -8.974 4.793 9.901
164 HG23 ILE 21 HG23 ILE 21 -9.405 3.659 11.182
165 HD11 ILE 21 HD11 ILE 21 -4.663 3.469 9.890
166 HD12 ILE 21 HD12 ILE 21 -4.799 3.112 8.168
167 HD13 ILE 21 HD13 ILE 21 -5.312 1.918 9.361
168 H ALA 22 H ALA 22 -6.621 3.254 13.800
169 HA ALA 22 HA ALA 22 -9.219 3.885 14.771
170 HB1 ALA 22 HB1 ALA 22 -8.450 2.924 16.883
171 HB2 ALA 22 HB2 ALA 22 -6.795 2.904 16.274
172 HB3 ALA 22 HB3 ALA 22 -8.027 1.898 15.514
173 H GLY 23 H GLY 23 -6.244 5.592 14.725
174 HA2 GLY 23 HA2 GLY 23 -6.711 7.237 17.025
175 HA3 GLY 23 HA3 GLY 23 -5.516 7.518 15.767
176 H ARG 24 H ARG 24 -6.156 8.605 13.849
177 HA ARG 24 HA ARG 24 -8.786 9.839 13.866
178 HB2 ARG 24 HB2 ARG 24 -7.756 12.050 13.258
179 HB3 ARG 24 HB3 ARG 24 -7.534 11.550 14.928
180 HG2 ARG 24 HG2 ARG 24 -5.410 12.088 14.601
181 HG3 ARG 24 HG3 ARG 24 -5.291 10.560 13.741
182 HD2 ARG 24 HD2 ARG 24 -5.813 11.723 11.643
183 HD3 ARG 24 HD3 ARG 24 -5.867 13.253 12.517
184 HE ARG 24 HE ARG 24 -3.394 11.887 12.917
185 HH11 ARG 24 HH11 ARG 24 -5.164 13.881 10.645
186 HH12 ARG 24 HH12 ARG 24 -3.730 14.504 9.881
187 HH21 ARG 24 HH21 ARG 24 -1.506 12.733 11.936
188 HH22 ARG 24 HH22 ARG 24 -1.653 13.887 10.639
189 H TRP 25 H TRP 25 -9.598 9.201 12.108
190 HA TRP 25 HA TRP 25 -7.923 8.907 9.720
191 HB2 TRP 25 HB2 TRP 25 -9.201 6.946 9.127
192 HB3 TRP 25 HB3 TRP 25 -8.587 6.767 10.763
193 HD1 TRP 25 HD1 TRP 25 -11.638 6.416 8.793
194 HE1 TRP 25 HE1 TRP 25 -13.705 6.098 10.304
195 HE3 TRP 25 HE3 TRP 25 -9.607 7.810 13.267
196 HZ2 TRP 25 HZ2 TRP 25 -14.381 6.415 13.015
197 HZ3 TRP 25 HZ3 TRP 25 -11.034 7.789 15.265
198 HH2 TRP 25 HH2 TRP 25 -13.370 7.109 15.141
199 H LYS 26 H LYS 26 -11.058 9.896 10.963
200 HA LYS 26 HA LYS 26 -12.420 11.559 10.317
201 HB2 LYS 26 HB2 LYS 26 -10.192 12.625 9.750
202 HB3 LYS 26 HB3 LYS 26 -10.514 12.183 8.081
203 HG2 LYS 26 HG2 LYS 26 -11.165 14.441 8.351
204 HG3 LYS 26 HG3 LYS 26 -12.643 13.486 8.242
205 HD2 LYS 26 HD2 LYS 26 -11.430 14.213 10.891
206 HD3 LYS 26 HD3 LYS 26 -12.510 15.305 10.042
207 HE2 LYS 26 HE2 LYS 26 -14.233 13.535 10.021
208 HE3 LYS 26 HE3 LYS 26 -13.146 12.511 10.960
209 HZ1 LYS 26 HZ1 LYS 26 -14.727 13.602 12.397
210 HZ2 LYS 26 HZ2 LYS 26 -14.265 15.128 11.815
211 HZ3 LYS 26 HZ3 LYS 26 -13.168 14.195 12.716
212 H HIS 27 H HIS 27 -11.555 9.156 8.002
213 HA HIS 27 HA HIS 27 -14.132 9.378 6.761
214 HB2 HIS 27 HB2 HIS 27 -13.050 9.403 4.416
215 HB3 HIS 27 HB3 HIS 27 -13.208 10.922 5.283
216 HD1 HIS 27 HD1 HIS 27 -11.191 12.329 5.168
217 HD2 HIS 27 HD2 HIS 27 -10.256 8.289 4.838
218 HE1 HIS 27 HE1 HIS 27 -8.707 12.232 4.782
219 HE2 HIS 27 HE2 HIS 27 -8.213 9.799 4.350
220 HA PRO 28 HA PRO 28 -12.695 5.073 7.489
221 HB2 PRO 28 HB2 PRO 28 -15.344 4.212 7.520
222 HB3 PRO 28 HB3 PRO 28 -14.392 4.657 8.937
223 HG2 PRO 28 HG2 PRO 28 -16.363 6.287 7.397
224 HG3 PRO 28 HG3 PRO 28 -16.096 6.214 9.147
225 HD2 PRO 28 HD2 PRO 28 -15.203 8.259 7.699
226 HD3 PRO 28 HD3 PRO 28 -14.234 7.592 9.033
227 H ASN 29 H ASN 29 -15.275 6.183 5.328
228 HA ASN 29 HA ASN 29 -15.204 3.919 3.628
229 HB2 ASN 29 HB2 ASN 29 -16.545 5.310 2.074
230 HB3 ASN 29 HB3 ASN 29 -17.185 5.305 3.711
231 HD21 ASN 29 HD21 ASN 29 -17.541 7.206 1.510
232 HD22 ASN 29 HD22 ASN 29 -17.066 8.751 2.150
233 H ILE 30 H ILE 30 -13.630 7.073 3.519
234 HA ILE 30 HA ILE 30 -12.535 6.675 0.907
235 HB ILE 30 HB ILE 30 -11.723 8.670 3.024
236 HG12 ILE 30 HG12 ILE 30 -14.074 8.915 2.406
237 HG13 ILE 30 HG13 ILE 30 -13.132 10.251 1.755
238 HG21 ILE 30 HG21 ILE 30 -11.161 8.604 0.061
239 HG22 ILE 30 HG22 ILE 30 -9.986 8.379 1.356
240 HG23 ILE 30 HG23 ILE 30 -10.775 9.942 1.143
241 HD11 ILE 30 HD11 ILE 30 -14.109 7.850 0.224
242 HD12 ILE 30 HD12 ILE 30 -13.127 9.157 -0.440
243 HD13 ILE 30 HD13 ILE 30 -14.759 9.488 0.142
244 H VAL 31 H VAL 31 -11.326 6.243 4.211
245 HA VAL 31 HA VAL 31 -8.644 5.757 3.404
246 HB VAL 31 HB VAL 31 -9.220 6.450 5.712
247 HG11 VAL 31 HG11 VAL 31 -11.197 5.079 6.078
248 HG12 VAL 31 HG12 VAL 31 -9.996 4.804 7.337
249 HG13 VAL 31 HG13 VAL 31 -10.205 3.621 6.046
250 HG21 VAL 31 HG21 VAL 31 -7.050 5.481 5.227
251 HG22 VAL 31 HG22 VAL 31 -7.694 3.860 5.494
252 HG23 VAL 31 HG23 VAL 31 -7.593 5.000 6.836
253 H ARG 32 H ARG 32 -11.397 3.595 4.111
254 HA ARG 32 HA ARG 32 -9.961 1.203 3.619
255 HB2 ARG 32 HB2 ARG 32 -12.841 1.928 3.813
256 HB3 ARG 32 HB3 ARG 32 -12.437 0.421 3.004
257 HG2 ARG 32 HG2 ARG 32 -11.542 1.144 5.785
258 HG3 ARG 32 HG3 ARG 32 -12.961 0.166 5.408
259 HD2 ARG 32 HD2 ARG 32 -11.455 -1.413 4.190
260 HD3 ARG 32 HD3 ARG 32 -10.080 -0.484 4.787
261 HE ARG 32 HE ARG 32 -11.763 -1.265 6.931
262 HH11 ARG 32 HH11 ARG 32 -9.427 -2.649 4.671
263 HH12 ARG 32 HH12 ARG 32 -8.921 -3.884 5.794
264 HH21 ARG 32 HH21 ARG 32 -11.074 -2.904 8.360
265 HH22 ARG 32 HH22 ARG 32 -9.842 -4.022 7.860
266 H SER 33 H SER 33 -11.601 3.493 1.543
267 HA SER 33 HA SER 33 -11.721 2.042 -0.822
268 HB2 SER 33 HB2 SER 33 -12.717 4.268 -0.591
269 HB3 SER 33 HB3 SER 33 -11.115 4.986 -0.442
270 HG SER 33 HG SER 33 -12.081 3.574 -2.712
271 H ARG 34 H ARG 34 -9.037 3.879 0.582
272 HA ARG 34 HA ARG 34 -7.296 3.267 -1.626
273 HB2 ARG 34 HB2 ARG 34 -7.070 4.824 0.889
274 HB3 ARG 34 HB3 ARG 34 -5.577 4.173 0.228
275 HG2 ARG 34 HG2 ARG 34 -6.042 6.479 -0.508
276 HG3 ARG 34 HG3 ARG 34 -5.923 5.338 -1.848
277 HD2 ARG 34 HD2 ARG 34 -8.381 5.200 -1.911
278 HD3 ARG 34 HD3 ARG 34 -8.463 6.404 -0.626
279 HE ARG 34 HE ARG 34 -6.998 7.672 -2.497
280 HH11 ARG 34 HH11 ARG 34 -10.010 5.885 -2.726
281 HH12 ARG 34 HH12 ARG 34 -10.653 6.880 -3.993
282 HH21 ARG 34 HH21 ARG 34 -7.857 8.999 -4.176
283 HH22 ARG 34 HH22 ARG 34 -9.435 8.631 -4.834
284 H ILE 35 H ILE 35 -7.818 1.995 1.622
285 HA ILE 35 HA ILE 35 -5.503 0.361 1.614
286 HB ILE 35 HB ILE 35 -8.049 0.062 3.215
287 HG12 ILE 35 HG12 ILE 35 -5.353 1.254 3.912
288 HG13 ILE 35 HG13 ILE 35 -6.828 2.167 3.609
289 HG21 ILE 35 HG21 ILE 35 -5.361 -1.255 3.603
290 HG22 ILE 35 HG22 ILE 35 -6.841 -2.056 3.075
291 HG23 ILE 35 HG23 ILE 35 -6.737 -1.377 4.701
292 HD11 ILE 35 HD11 ILE 35 -6.346 1.977 5.988
293 HD12 ILE 35 HD12 ILE 35 -6.404 0.219 5.864
294 HD13 ILE 35 HD13 ILE 35 -7.858 1.172 5.570
295 H GLU 36 H GLU 36 -8.874 -0.261 0.669
296 HA GLU 36 HA GLU 36 -8.303 -3.048 0.184
297 HB2 GLU 36 HB2 GLU 36 -10.786 -1.450 -0.449
298 HB3 GLU 36 HB3 GLU 36 -10.645 -3.200 -0.519
299 HG2 GLU 36 HG2 GLU 36 -10.499 -1.450 1.922
300 HG3 GLU 36 HG3 GLU 36 -11.752 -2.618 1.506
301 H LYS 37 H LYS 37 -8.616 -0.135 -1.762
302 HA LYS 37 HA LYS 37 -8.554 -1.744 -4.194
303 HB2 LYS 37 HB2 LYS 37 -10.202 -0.163 -4.446
304 HB3 LYS 37 HB3 LYS 37 -9.311 1.069 -3.571
305 HG2 LYS 37 HG2 LYS 37 -8.135 0.206 -6.131
306 HG3 LYS 37 HG3 LYS 37 -9.662 1.090 -6.224
307 HD2 LYS 37 HD2 LYS 37 -8.765 2.958 -5.107
308 HD3 LYS 37 HD3 LYS 37 -7.350 2.055 -4.568
309 HE2 LYS 37 HE2 LYS 37 -6.555 1.907 -6.854
310 HE3 LYS 37 HE3 LYS 37 -7.995 2.745 -7.424
311 HZ1 LYS 37 HZ1 LYS 37 -6.044 4.204 -7.220
312 HZ2 LYS 37 HZ2 LYS 37 -5.987 3.898 -5.555
313 HZ3 LYS 37 HZ3 LYS 37 -7.321 4.706 -6.230
314 H ASP 38 H ASP 38 -6.569 0.679 -2.523
315 HA ASP 38 HA ASP 38 -4.591 0.571 -4.656
316 HB2 ASP 38 HB2 ASP 38 -4.648 2.108 -2.053
317 HB3 ASP 38 HB3 ASP 38 -3.294 2.149 -3.172
318 H ILE 39 H ILE 39 -4.764 -0.255 -1.196
319 HA ILE 39 HA ILE 39 -2.063 -1.175 -1.142
320 HB ILE 39 HB ILE 39 -4.227 -1.649 0.910
321 HG12 ILE 39 HG12 ILE 39 -3.892 0.740 0.508
322 HG13 ILE 39 HG13 ILE 39 -3.247 0.287 2.082
323 HG21 ILE 39 HG21 ILE 39 -1.222 -1.814 1.130
324 HG22 ILE 39 HG22 ILE 39 -2.349 -3.171 1.159
325 HG23 ILE 39 HG23 ILE 39 -2.362 -1.986 2.465
326 HD11 ILE 39 HD11 ILE 39 -0.993 0.294 1.172
327 HD12 ILE 39 HD12 ILE 39 -1.788 1.847 0.909
328 HD13 ILE 39 HD13 ILE 39 -1.628 0.701 -0.422
329 H LYS 40 H LYS 40 -5.214 -2.883 -1.110
330 HA LYS 40 HA LYS 40 -3.701 -5.309 -1.834
331 HB2 LYS 40 HB2 LYS 40 -6.304 -5.110 -0.319
332 HB3 LYS 40 HB3 LYS 40 -5.659 -6.615 -0.948
333 HG2 LYS 40 HG2 LYS 40 -4.940 -6.734 1.207
334 HG3 LYS 40 HG3 LYS 40 -3.554 -5.929 0.475
335 HD2 LYS 40 HD2 LYS 40 -4.191 -4.852 2.569
336 HD3 LYS 40 HD3 LYS 40 -4.426 -3.764 1.201
337 HE2 LYS 40 HE2 LYS 40 -6.309 -3.603 2.708
338 HE3 LYS 40 HE3 LYS 40 -6.821 -4.330 1.189
339 HZ1 LYS 40 HZ1 LYS 40 -7.808 -5.539 2.952
340 HZ2 LYS 40 HZ2 LYS 40 -6.342 -5.708 3.778
341 HZ3 LYS 40 HZ3 LYS 40 -6.592 -6.523 2.309
342 HA PRO 41 HA PRO 41 -6.593 -4.392 -5.377
343 HB2 PRO 41 HB2 PRO 41 -4.748 -4.285 -7.351
344 HB3 PRO 41 HB3 PRO 41 -5.183 -2.871 -6.388
345 HG2 PRO 41 HG2 PRO 41 -2.805 -4.657 -6.167
346 HG3 PRO 41 HG3 PRO 41 -2.909 -2.897 -5.990
347 HD2 PRO 41 HD2 PRO 41 -2.796 -4.651 -3.885
348 HD3 PRO 41 HD3 PRO 41 -3.518 -3.034 -3.794
349 H ALA 42 H ALA 42 -3.574 -6.231 -5.810
350 HA ALA 42 HA ALA 42 -5.147 -8.668 -6.237
351 HB1 ALA 42 HB1 ALA 42 -4.545 -7.781 -8.447
352 HB2 ALA 42 HB2 ALA 42 -3.745 -9.318 -8.118
353 HB3 ALA 42 HB3 ALA 42 -2.843 -7.806 -7.987
354 H ILE 43 H ILE 43 -3.051 -7.178 -4.380
355 HA ILE 43 HA ILE 43 -1.423 -9.573 -3.870
356 HB ILE 43 HB ILE 43 0.148 -7.888 -2.703
357 HG12 ILE 43 HG12 ILE 43 -1.118 -5.971 -4.665
358 HG13 ILE 43 HG13 ILE 43 -1.551 -5.990 -2.959
359 HG21 ILE 43 HG21 ILE 43 1.328 -7.460 -4.822
360 HG22 ILE 43 HG22 ILE 43 -0.114 -7.965 -5.706
361 HG23 ILE 43 HG23 ILE 43 0.753 -9.121 -4.694
362 HD11 ILE 43 HD11 ILE 43 0.790 -5.501 -2.393
363 HD12 ILE 43 HD12 ILE 43 0.071 -4.257 -3.416
364 HD13 ILE 43 HD13 ILE 43 1.176 -5.442 -4.112
365 H GLY 44 H GLY 44 -2.954 -10.462 -2.495
366 HA2 GLY 44 HA2 GLY 44 -3.144 -9.098 0.118
367 HA3 GLY 44 HA3 GLY 44 -4.498 -9.987 -0.571
368 H SER 45 H SER 45 -3.530 -12.275 -1.436
369 HA SER 45 HA SER 45 -2.648 -13.642 0.948
370 HB2 SER 45 HB2 SER 45 -2.782 -15.630 -0.763
371 HB3 SER 45 HB3 SER 45 -4.265 -14.870 -0.180
372 HG SER 45 HG SER 45 -2.945 -14.508 -2.665
373 H LEU 46 H LEU 46 -0.983 -11.821 -1.000
374 HA LEU 46 HA LEU 46 1.162 -13.504 -1.845
375 HB2 LEU 46 HB2 LEU 46 0.607 -11.350 -2.937
376 HB3 LEU 46 HB3 LEU 46 1.091 -10.505 -1.480
377 HG LEU 46 HG LEU 46 3.387 -11.460 -1.783
378 HD11 LEU 46 HD11 LEU 46 2.277 -12.272 -4.465
379 HD12 LEU 46 HD12 LEU 46 2.816 -13.360 -3.183
380 HD13 LEU 46 HD13 LEU 46 3.978 -12.315 -4.002
381 HD21 LEU 46 HD21 LEU 46 2.867 -9.178 -2.434
382 HD22 LEU 46 HD22 LEU 46 2.324 -9.740 -4.014
383 HD23 LEU 46 HD23 LEU 46 4.019 -9.903 -3.555
384 H LYS 47 H LYS 47 3.002 -14.032 -0.784
385 HA LYS 47 HA LYS 47 3.140 -13.839 2.014
386 HB2 LYS 47 HB2 LYS 47 4.317 -15.489 0.410
387 HB3 LYS 47 HB3 LYS 47 5.544 -14.242 0.245
388 HG2 LYS 47 HG2 LYS 47 6.350 -15.691 1.893
389 HG3 LYS 47 HG3 LYS 47 5.724 -14.296 2.777
390 HD2 LYS 47 HD2 LYS 47 4.985 -16.272 3.902
391 HD3 LYS 47 HD3 LYS 47 3.591 -15.553 3.099
392 HE2 LYS 47 HE2 LYS 47 3.570 -17.947 2.769
393 HE3 LYS 47 HE3 LYS 47 3.885 -17.144 1.233
394 HZ1 LYS 47 HZ1 LYS 47 5.890 -18.454 2.988
395 HZ2 LYS 47 HZ2 LYS 47 6.272 -17.588 1.583
396 HZ3 LYS 47 HZ3 LYS 47 5.351 -19.011 1.479
397 H VAL 48 H VAL 48 4.399 -12.533 3.366
398 HA VAL 48 HA VAL 48 4.746 -9.846 2.576
399 HB VAL 48 HB VAL 48 6.126 -11.100 4.945
400 HG11 VAL 48 HG11 VAL 48 6.687 -8.789 4.478
401 HG12 VAL 48 HG12 VAL 48 5.733 -8.907 5.956
402 HG13 VAL 48 HG13 VAL 48 4.976 -8.359 4.460
403 HG21 VAL 48 HG21 VAL 48 3.817 -11.872 4.961
404 HG22 VAL 48 HG22 VAL 48 3.249 -10.213 4.772
405 HG23 VAL 48 HG23 VAL 48 4.093 -10.695 6.246
406 H GLU 49 H GLU 49 6.841 -12.606 2.520
407 HA GLU 49 HA GLU 49 9.282 -11.142 2.179
408 HB2 GLU 49 HB2 GLU 49 8.693 -14.027 1.500
409 HB3 GLU 49 HB3 GLU 49 10.283 -13.302 1.702
410 HG2 GLU 49 HG2 GLU 49 9.731 -12.857 4.069
411 HG3 GLU 49 HG3 GLU 49 8.203 -13.710 3.836
412 H ASP 50 H ASP 50 6.663 -11.641 0.181
413 HA ASP 50 HA ASP 50 8.305 -11.779 -2.250
414 HB2 ASP 50 HB2 ASP 50 5.433 -12.490 -1.723
415 HB3 ASP 50 HB3 ASP 50 6.030 -12.232 -3.358
416 H VAL 51 H VAL 51 7.013 -9.426 -0.395
417 HA VAL 51 HA VAL 51 5.799 -7.902 -2.522
418 HB VAL 51 HB VAL 51 4.920 -7.620 -0.265
419 HG11 VAL 51 HG11 VAL 51 6.185 -6.370 1.446
420 HG12 VAL 51 HG12 VAL 51 7.618 -6.479 0.425
421 HG13 VAL 51 HG13 VAL 51 6.886 -7.944 1.078
422 HG21 VAL 51 HG21 VAL 51 6.209 -5.112 -1.327
423 HG22 VAL 51 HG22 VAL 51 4.858 -5.174 -0.193
424 HG23 VAL 51 HG23 VAL 51 4.662 -5.789 -1.834
425 H LYS 52 H LYS 52 7.411 -7.891 -3.998
426 HA LYS 52 HA LYS 52 9.988 -6.727 -3.406
427 HB2 LYS 52 HB2 LYS 52 8.832 -7.747 -6.009
428 HB3 LYS 52 HB3 LYS 52 10.523 -7.371 -5.703
429 HG2 LYS 52 HG2 LYS 52 10.714 -9.171 -4.147
430 HG3 LYS 52 HG3 LYS 52 8.979 -9.472 -4.206
431 HD2 LYS 52 HD2 LYS 52 9.162 -10.127 -6.540
432 HD3 LYS 52 HD3 LYS 52 10.890 -9.772 -6.516
433 HE2 LYS 52 HE2 LYS 52 11.246 -11.513 -4.859
434 HE3 LYS 52 HE3 LYS 52 9.514 -11.844 -4.811
435 HZ1 LYS 52 HZ1 LYS 52 11.233 -12.143 -7.215
436 HZ2 LYS 52 HZ2 LYS 52 9.589 -12.548 -7.098
437 HZ3 LYS 52 HZ3 LYS 52 10.744 -13.417 -6.212
438 HA PRO 53 HA PRO 53 9.384 -2.521 -4.493
439 HB2 PRO 53 HB2 PRO 53 11.626 -2.890 -6.430
440 HB3 PRO 53 HB3 PRO 53 11.407 -1.659 -5.179
441 HG2 PRO 53 HG2 PRO 53 13.085 -3.675 -4.787
442 HG3 PRO 53 HG3 PRO 53 12.048 -3.096 -3.469
443 HD2 PRO 53 HD2 PRO 53 11.791 -5.550 -5.152
444 HD3 PRO 53 HD3 PRO 53 11.412 -5.313 -3.436
445 H ARG 54 H ARG 54 9.831 -4.737 -7.219
446 HA ARG 54 HA ARG 54 8.906 -3.107 -9.282
447 HB2 ARG 54 HB2 ARG 54 8.720 -6.087 -8.884
448 HB3 ARG 54 HB3 ARG 54 8.208 -5.290 -10.363
449 HG2 ARG 54 HG2 ARG 54 10.452 -4.493 -10.757
450 HG3 ARG 54 HG3 ARG 54 10.987 -5.170 -9.215
451 HD2 ARG 54 HD2 ARG 54 10.507 -7.401 -9.980
452 HD3 ARG 54 HD3 ARG 54 9.816 -6.779 -11.473
453 HE ARG 54 HE ARG 54 12.479 -5.900 -11.238
454 HH11 ARG 54 HH11 ARG 54 10.642 -8.830 -11.785
455 HH12 ARG 54 HH12 ARG 54 11.874 -9.569 -12.771
456 HH21 ARG 54 HH21 ARG 54 14.118 -6.882 -12.507
457 HH22 ARG 54 HH22 ARG 54 13.854 -8.469 -13.171
458 H HIS 55 H HIS 55 7.126 -5.032 -6.938
459 HA HIS 55 HA HIS 55 4.599 -4.996 -8.165
460 HB2 HIS 55 HB2 HIS 55 5.188 -5.048 -5.204
461 HB3 HIS 55 HB3 HIS 55 3.670 -5.503 -5.969
462 HD1 HIS 55 HD1 HIS 55 5.811 -6.970 -8.253
463 HD2 HIS 55 HD2 HIS 55 4.977 -7.789 -4.258
464 HE1 HIS 55 HE1 HIS 55 6.578 -9.334 -7.858
465 HE2 HIS 55 HE2 HIS 55 5.868 -9.874 -5.513
466 H ILE 56 H ILE 56 6.190 -2.681 -6.059
467 HA ILE 56 HA ILE 56 4.048 -0.984 -5.508
468 HB ILE 56 HB ILE 56 6.957 -0.274 -5.930
469 HG12 ILE 56 HG12 ILE 56 6.602 -1.894 -4.137
470 HG13 ILE 56 HG13 ILE 56 7.070 -0.333 -3.470
471 HG21 ILE 56 HG21 ILE 56 5.555 1.708 -6.148
472 HG22 ILE 56 HG22 ILE 56 6.497 1.760 -4.659
473 HG23 ILE 56 HG23 ILE 56 4.785 1.344 -4.603
474 HD11 ILE 56 HD11 ILE 56 5.313 -1.373 -2.155
475 HD12 ILE 56 HD12 ILE 56 4.270 -1.434 -3.577
476 HD13 ILE 56 HD13 ILE 56 4.746 0.122 -2.897
477 H ASP 57 H ASP 57 6.223 -1.070 -8.299
478 HA ASP 57 HA ASP 57 5.064 1.183 -9.590
479 HB2 ASP 57 HB2 ASP 57 7.307 0.448 -10.175
480 HB3 ASP 57 HB3 ASP 57 6.690 -1.113 -10.709
481 H ASP 58 H ASP 58 4.555 -2.296 -9.765
482 HA ASP 58 HA ASP 58 2.735 -2.356 -11.893
483 HB2 ASP 58 HB2 ASP 58 3.239 -4.190 -9.570
484 HB3 ASP 58 HB3 ASP 58 1.912 -4.503 -10.683
485 H VAL 59 H VAL 59 2.150 -2.073 -8.393
486 HA VAL 59 HA VAL 59 -0.672 -2.114 -8.660
487 HB VAL 59 HB VAL 59 0.344 -2.698 -6.531
488 HG11 VAL 59 HG11 VAL 59 1.170 0.193 -6.337
489 HG12 VAL 59 HG12 VAL 59 2.248 -1.190 -6.531
490 HG13 VAL 59 HG13 VAL 59 1.304 -1.007 -5.052
491 HG21 VAL 59 HG21 VAL 59 -1.082 -1.355 -5.042
492 HG22 VAL 59 HG22 VAL 59 -1.931 -1.906 -6.484
493 HG23 VAL 59 HG23 VAL 59 -1.382 -0.236 -6.371
494 H LEU 60 H LEU 60 1.684 0.539 -8.447
495 HA LEU 60 HA LEU 60 -0.209 2.628 -8.366
496 HB2 LEU 60 HB2 LEU 60 2.600 2.615 -9.480
497 HB3 LEU 60 HB3 LEU 60 1.639 4.059 -9.223
498 HG LEU 60 HG LEU 60 2.581 2.164 -7.067
499 HD11 LEU 60 HD11 LEU 60 4.016 4.023 -6.390
500 HD12 LEU 60 HD12 LEU 60 3.459 4.960 -7.776
501 HD13 LEU 60 HD13 LEU 60 4.390 3.483 -8.026
502 HD21 LEU 60 HD21 LEU 60 1.083 4.775 -6.861
503 HD22 LEU 60 HD22 LEU 60 1.715 3.833 -5.510
504 HD23 LEU 60 HD23 LEU 60 0.427 3.174 -6.519
505 H LYS 61 H LYS 61 1.172 0.798 -11.020
506 HA LYS 61 HA LYS 61 0.136 2.420 -13.095
507 HB2 LYS 61 HB2 LYS 61 1.958 0.986 -13.599
508 HB3 LYS 61 HB3 LYS 61 1.134 -0.422 -12.950
509 HG2 LYS 61 HG2 LYS 61 -0.138 0.937 -15.249
510 HG3 LYS 61 HG3 LYS 61 1.363 0.057 -15.555
511 HD2 LYS 61 HD2 LYS 61 -1.071 -1.093 -14.188
512 HD3 LYS 61 HD3 LYS 61 -0.663 -1.323 -15.884
513 HE2 LYS 61 HE2 LYS 61 1.096 -2.133 -13.576
514 HE3 LYS 61 HE3 LYS 61 0.008 -3.222 -14.433
515 HZ1 LYS 61 HZ1 LYS 61 2.297 -1.760 -15.648
516 HZ2 LYS 61 HZ2 LYS 61 1.245 -2.806 -16.467
517 HZ3 LYS 61 HZ3 LYS 61 2.266 -3.409 -15.256
518 H ALA 62 H ALA 62 -1.113 -0.269 -11.229
519 HA ALA 62 HA ALA 62 -3.435 -0.673 -12.852
520 HB1 ALA 62 HB1 ALA 62 -4.177 -2.157 -11.068
521 HB2 ALA 62 HB2 ALA 62 -2.891 -1.559 -10.021
522 HB3 ALA 62 HB3 ALA 62 -2.491 -2.466 -11.478
523 H VAL 63 H VAL 63 -2.740 1.081 -9.852
524 HA VAL 63 HA VAL 63 -5.472 1.847 -9.462
525 HB VAL 63 HB VAL 63 -4.671 3.296 -7.684
526 HG11 VAL 63 HG11 VAL 63 -3.297 0.617 -7.710
527 HG12 VAL 63 HG12 VAL 63 -4.949 0.946 -7.188
528 HG13 VAL 63 HG13 VAL 63 -3.591 1.600 -6.274
529 HG21 VAL 63 HG21 VAL 63 -1.900 2.600 -8.641
530 HG22 VAL 63 HG22 VAL 63 -2.279 3.466 -7.152
531 HG23 VAL 63 HG23 VAL 63 -2.668 4.186 -8.714
532 H MET 64 H MET 64 -2.860 3.051 -11.321
533 HA MET 64 HA MET 64 -3.839 5.731 -11.606
534 HB2 MET 64 HB2 MET 64 -1.459 5.183 -11.885
535 HB3 MET 64 HB3 MET 64 -1.851 4.178 -13.274
536 HG2 MET 64 HG2 MET 64 -2.688 6.169 -14.446
537 HG3 MET 64 HG3 MET 64 -2.223 7.158 -13.063
538 HE1 MET 64 HE1 MET 64 0.512 5.608 -12.232
539 HE2 MET 64 HE2 MET 64 0.343 7.363 -12.220
540 HE3 MET 64 HE3 MET 64 1.698 6.612 -13.064
541 H LYS 65 H LYS 65 -3.924 2.792 -13.587
542 HA LYS 65 HA LYS 65 -4.998 3.978 -15.895
543 HB2 LYS 65 HB2 LYS 65 -5.419 1.729 -16.666
544 HB3 LYS 65 HB3 LYS 65 -3.865 1.799 -15.856
545 HG2 LYS 65 HG2 LYS 65 -4.976 0.886 -13.818
546 HG3 LYS 65 HG3 LYS 65 -6.426 0.648 -14.794
547 HD2 LYS 65 HD2 LYS 65 -3.716 -0.555 -15.343
548 HD3 LYS 65 HD3 LYS 65 -5.086 -1.398 -14.624
549 HE2 LYS 65 HE2 LYS 65 -6.376 -1.075 -16.657
550 HE3 LYS 65 HE3 LYS 65 -5.045 -0.165 -17.375
551 HZ1 LYS 65 HZ1 LYS 65 -4.953 -3.018 -16.552
552 HZ2 LYS 65 HZ2 LYS 65 -3.669 -2.143 -17.236
553 HZ3 LYS 65 HZ3 LYS 65 -5.061 -2.453 -18.149
554 H ARG 66 H ARG 66 -6.522 2.536 -13.104
555 HA ARG 66 HA ARG 66 -9.156 2.506 -14.178
556 HB2 ARG 66 HB2 ARG 66 -9.887 2.116 -11.857
557 HB3 ARG 66 HB3 ARG 66 -8.581 1.041 -12.336
558 HG2 ARG 66 HG2 ARG 66 -7.042 2.086 -10.971
559 HG3 ARG 66 HG3 ARG 66 -7.975 3.584 -10.898
560 HD2 ARG 66 HD2 ARG 66 -8.096 2.411 -8.782
561 HD3 ARG 66 HD3 ARG 66 -9.677 2.454 -9.558
562 HE ARG 66 HE ARG 66 -7.949 0.066 -9.680
563 HH11 ARG 66 HH11 ARG 66 -11.017 1.611 -9.059
564 HH12 ARG 66 HH12 ARG 66 -11.853 0.122 -8.722
565 HH21 ARG 66 HH21 ARG 66 -9.023 -1.902 -9.218
566 HH22 ARG 66 HH22 ARG 66 -10.712 -1.880 -8.813
567 H GLY 67 H GLY 67 -7.221 5.059 -13.143
568 HA2 GLY 67 HA2 GLY 67 -9.503 6.857 -13.165
569 HA3 GLY 67 HA3 GLY 67 -8.606 6.796 -11.655
570 H ALA 68 H ALA 68 -6.830 8.016 -11.454
571 HA ALA 68 HA ALA 68 -5.574 9.123 -13.854
572 HB1 ALA 68 HB1 ALA 68 -5.602 11.383 -12.904
573 HB2 ALA 68 HB2 ALA 68 -6.540 10.797 -11.530
574 HB3 ALA 68 HB3 ALA 68 -7.237 10.771 -13.149
575 HA PRO 69 HA PRO 69 -1.764 8.363 -11.738
576 HB2 PRO 69 HB2 PRO 69 -0.305 10.576 -12.472
577 HB3 PRO 69 HB3 PRO 69 -0.564 9.168 -13.508
578 HG2 PRO 69 HG2 PRO 69 -1.994 11.796 -13.485
579 HG3 PRO 69 HG3 PRO 69 -1.453 10.824 -14.868
580 HD2 PRO 69 HD2 PRO 69 -4.018 10.838 -14.081
581 HD3 PRO 69 HD3 PRO 69 -3.248 9.362 -14.700
582 H SER 70 H SER 70 -3.561 11.237 -11.181
583 HA SER 70 HA SER 70 -2.024 12.491 -9.205
584 HB2 SER 70 HB2 SER 70 -5.042 12.485 -9.319
585 HB3 SER 70 HB3 SER 70 -3.978 13.771 -8.745
586 HG SER 70 HG SER 70 -4.152 14.504 -10.706
587 H ILE 71 H ILE 71 -4.201 9.763 -9.086
588 HA ILE 71 HA ILE 71 -4.408 9.705 -6.223
589 HB ILE 71 HB ILE 71 -5.084 7.619 -8.305
590 HG12 ILE 71 HG12 ILE 71 -7.441 8.139 -7.427
591 HG13 ILE 71 HG13 ILE 71 -6.722 9.561 -6.681
592 HG21 ILE 71 HG21 ILE 71 -6.210 6.379 -6.512
593 HG22 ILE 71 HG22 ILE 71 -5.570 7.524 -5.331
594 HG23 ILE 71 HG23 ILE 71 -4.470 6.493 -6.246
595 HD11 ILE 71 HD11 ILE 71 -6.034 10.361 -8.881
596 HD12 ILE 71 HD12 ILE 71 -7.778 10.112 -8.790
597 HD13 ILE 71 HD13 ILE 71 -6.759 8.935 -9.623
598 H ALA 72 H ALA 72 -2.384 8.217 -8.661
599 HA ALA 72 HA ALA 72 -1.322 6.097 -7.199
600 HB1 ALA 72 HB1 ALA 72 -1.115 6.363 -9.644
601 HB2 ALA 72 HB2 ALA 72 0.426 6.003 -8.863
602 HB3 ALA 72 HB3 ALA 72 0.060 7.649 -9.382
603 H ASN 73 H ASN 73 0.043 9.359 -7.681
604 HA ASN 73 HA ASN 73 2.329 8.884 -6.089
605 HB2 ASN 73 HB2 ASN 73 2.683 11.311 -6.131
606 HB3 ASN 73 HB3 ASN 73 2.291 10.694 -7.730
607 HD21 ASN 73 HD21 ASN 73 1.239 12.663 -5.080
608 HD22 ASN 73 HD22 ASN 73 -0.104 13.388 -5.887
609 H ASP 74 H ASP 74 -0.917 9.727 -5.276
610 HA ASP 74 HA ASP 74 -0.322 10.801 -2.685
611 HB2 ASP 74 HB2 ASP 74 -2.387 11.369 -3.957
612 HB3 ASP 74 HB3 ASP 74 -2.948 9.715 -3.727
613 H THR 75 H THR 75 -1.233 7.664 -3.981
614 HA THR 75 HA THR 75 -1.689 6.256 -1.618
615 HB THR 75 HB THR 75 -0.390 5.156 -4.119
616 HG1 THR 75 HG1 THR 75 -2.922 4.679 -4.286
617 HG21 THR 75 HG21 THR 75 -0.420 3.603 -2.222
618 HG22 THR 75 HG22 THR 75 -1.534 3.079 -3.483
619 HG23 THR 75 HG23 THR 75 -2.154 3.862 -2.031
620 H LEU 76 H LEU 76 1.302 7.234 -3.132
621 HA LEU 76 HA LEU 76 3.176 5.560 -1.998
622 HB2 LEU 76 HB2 LEU 76 3.204 8.390 -2.888
623 HB3 LEU 76 HB3 LEU 76 4.562 7.833 -1.932
624 HG LEU 76 HG LEU 76 5.029 7.728 -4.310
625 HD11 LEU 76 HD11 LEU 76 4.768 5.010 -3.045
626 HD12 LEU 76 HD12 LEU 76 6.125 6.123 -2.862
627 HD13 LEU 76 HD13 LEU 76 5.783 5.400 -4.435
628 HD21 LEU 76 HD21 LEU 76 2.769 7.369 -5.143
629 HD22 LEU 76 HD22 LEU 76 2.772 5.747 -4.452
630 HD23 LEU 76 HD23 LEU 76 3.881 6.147 -5.762
631 H ARG 77 H ARG 77 1.809 8.523 -0.611
632 HA ARG 77 HA ARG 77 3.286 8.736 1.717
633 HB2 ARG 77 HB2 ARG 77 0.313 9.103 1.845
634 HB3 ARG 77 HB3 ARG 77 1.571 10.023 2.645
635 HG2 ARG 77 HG2 ARG 77 2.169 11.040 0.487
636 HG3 ARG 77 HG3 ARG 77 0.841 10.149 -0.270
637 HD2 ARG 77 HD2 ARG 77 -0.607 11.218 1.588
638 HD3 ARG 77 HD3 ARG 77 0.726 12.354 1.749
639 HE ARG 77 HE ARG 77 -0.983 12.014 -0.626
640 HH11 ARG 77 HH11 ARG 77 1.375 13.853 1.193
641 HH12 ARG 77 HH12 ARG 77 1.195 15.284 0.229
642 HH21 ARG 77 HH21 ARG 77 -1.239 13.882 -1.880
643 HH22 ARG 77 HH22 ARG 77 -0.303 15.308 -1.521
644 H TRP 78 H TRP 78 0.375 6.845 1.134
645 HA TRP 78 HA TRP 78 0.154 5.871 3.793
646 HB2 TRP 78 HB2 TRP 78 -1.676 6.136 2.000
647 HB3 TRP 78 HB3 TRP 78 -1.092 4.600 1.365
648 HD1 TRP 78 HD1 TRP 78 -2.092 2.486 2.424
649 HE1 TRP 78 HE1 TRP 78 -3.555 1.989 4.484
650 HE3 TRP 78 HE3 TRP 78 -2.097 7.131 4.546
651 HZ2 TRP 78 HZ2 TRP 78 -4.576 3.392 6.712
652 HZ3 TRP 78 HZ3 TRP 78 -3.341 7.474 6.640
653 HH2 TRP 78 HH2 TRP 78 -4.555 5.641 7.699
654 H LEU 79 H LEU 79 1.592 4.665 0.832
655 HA LEU 79 HA LEU 79 2.056 2.012 1.631
656 HB2 LEU 79 HB2 LEU 79 3.604 3.760 -0.281
657 HB3 LEU 79 HB3 LEU 79 3.839 2.033 -0.112
658 HG LEU 79 HG LEU 79 1.255 3.321 -0.996
659 HD11 LEU 79 HD11 LEU 79 1.845 2.518 -3.227
660 HD12 LEU 79 HD12 LEU 79 3.398 1.946 -2.617
661 HD13 LEU 79 HD13 LEU 79 3.038 3.673 -2.633
662 HD21 LEU 79 HD21 LEU 79 0.936 1.168 0.083
663 HD22 LEU 79 HD22 LEU 79 2.174 0.449 -0.946
664 HD23 LEU 79 HD23 LEU 79 0.666 1.028 -1.655
665 H LYS 80 H LYS 80 4.213 4.852 1.765
666 HA LYS 80 HA LYS 80 6.382 3.359 2.791
667 HB2 LYS 80 HB2 LYS 80 7.427 5.580 3.253
668 HB3 LYS 80 HB3 LYS 80 6.888 5.349 1.601
669 HG2 LYS 80 HG2 LYS 80 6.194 7.485 1.982
670 HG3 LYS 80 HG3 LYS 80 4.745 6.591 2.441
671 HD2 LYS 80 HD2 LYS 80 5.240 8.331 4.072
672 HD3 LYS 80 HD3 LYS 80 5.410 6.734 4.798
673 HE2 LYS 80 HE2 LYS 80 7.799 6.853 4.646
674 HE3 LYS 80 HE3 LYS 80 7.713 8.340 3.704
675 HZ1 LYS 80 HZ1 LYS 80 8.263 8.643 6.103
676 HZ2 LYS 80 HZ2 LYS 80 6.701 8.113 6.490
677 HZ3 LYS 80 HZ3 LYS 80 6.918 9.528 5.575
678 H ARG 81 H ARG 81 3.782 5.113 4.414
679 HA ARG 81 HA ARG 81 5.063 4.989 6.974
680 HB2 ARG 81 HB2 ARG 81 2.978 5.747 7.923
681 HB3 ARG 81 HB3 ARG 81 3.336 6.690 6.493
682 HG2 ARG 81 HG2 ARG 81 1.741 5.270 5.228
683 HG3 ARG 81 HG3 ARG 81 1.319 4.482 6.751
684 HD2 ARG 81 HD2 ARG 81 0.933 7.368 5.990
685 HD3 ARG 81 HD3 ARG 81 -0.302 6.177 6.394
686 HE ARG 81 HE ARG 81 1.385 6.425 8.599
687 HH11 ARG 81 HH11 ARG 81 -0.920 8.379 6.829
688 HH12 ARG 81 HH12 ARG 81 -1.301 9.395 8.187
689 HH21 ARG 81 HH21 ARG 81 0.898 7.759 10.388
690 HH22 ARG 81 HH22 ARG 81 -0.267 9.039 10.204
691 H MET 82 H MET 82 2.834 2.948 5.202
692 HA MET 82 HA MET 82 2.151 1.233 7.355
693 HB2 MET 82 HB2 MET 82 0.821 1.374 5.286
694 HB3 MET 82 HB3 MET 82 2.156 0.673 4.384
695 HG2 MET 82 HG2 MET 82 1.958 -1.382 5.711
696 HG3 MET 82 HG3 MET 82 0.592 -0.677 6.573
697 HE1 MET 82 HE1 MET 82 1.457 -0.329 2.735
698 HE2 MET 82 HE2 MET 82 0.566 -1.699 2.072
699 HE3 MET 82 HE3 MET 82 1.942 -1.975 3.140
700 H PHE 83 H PHE 83 4.542 0.980 4.735
701 HA PHE 83 HA PHE 83 5.588 -1.502 5.638
702 HB2 PHE 83 HB2 PHE 83 6.716 0.585 3.773
703 HB3 PHE 83 HB3 PHE 83 7.523 -0.941 4.117
704 HD1 PHE 83 HD1 PHE 83 5.758 -3.013 3.936
705 HD2 PHE 83 HD2 PHE 83 5.604 0.644 1.772
706 HE1 PHE 83 HE1 PHE 83 4.473 -4.126 2.159
707 HE2 PHE 83 HE2 PHE 83 4.309 -0.457 -0.007
708 HZ PHE 83 HZ PHE 83 3.741 -2.846 0.186
709 H ASN 84 H ASN 84 6.316 1.841 6.355
710 HA ASN 84 HA ASN 84 8.818 1.577 7.562
711 HB2 ASN 84 HB2 ASN 84 7.792 3.756 7.099
712 HB3 ASN 84 HB3 ASN 84 6.553 3.446 8.309
713 HD21 ASN 84 HD21 ASN 84 7.054 3.674 10.475
714 HD22 ASN 84 HD22 ASN 84 8.531 4.385 11.026
715 H TYR 85 H TYR 85 5.586 1.095 8.876
716 HA TYR 85 HA TYR 85 6.343 0.631 11.560
717 HB2 TYR 85 HB2 TYR 85 4.026 1.151 10.729
718 HB3 TYR 85 HB3 TYR 85 3.943 -0.479 10.076
719 HD1 TYR 85 HD1 TYR 85 4.064 1.513 13.164
720 HD2 TYR 85 HD2 TYR 85 3.504 -2.354 11.495
721 HE1 TYR 85 HE1 TYR 85 3.193 0.717 15.321
722 HE2 TYR 85 HE2 TYR 85 2.633 -3.164 13.645
723 HH TYR 85 HH TYR 85 2.829 -2.550 16.051
724 H ALA 86 H ALA 86 5.998 -1.469 8.755
725 HA ALA 86 HA ALA 86 6.375 -3.913 10.165
726 HB1 ALA 86 HB1 ALA 86 6.761 -3.319 7.231
727 HB2 ALA 86 HB2 ALA 86 5.250 -3.817 7.992
728 HB3 ALA 86 HB3 ALA 86 6.625 -4.921 7.959
729 H ILE 87 H ILE 87 8.525 -1.551 8.764
730 HA ILE 87 HA ILE 87 10.889 -3.130 8.769
731 HB ILE 87 HB ILE 87 10.608 -0.129 9.043
732 HG12 ILE 87 HG12 ILE 87 11.194 -1.804 6.592
733 HG13 ILE 87 HG13 ILE 87 9.629 -1.086 6.964
734 HG21 ILE 87 HG21 ILE 87 12.938 -0.035 8.297
735 HG22 ILE 87 HG22 ILE 87 13.011 -1.798 8.304
736 HG23 ILE 87 HG23 ILE 87 12.783 -0.918 9.817
737 HD11 ILE 87 HD11 ILE 87 10.632 1.139 6.840
738 HD12 ILE 87 HD12 ILE 87 10.836 0.239 5.336
739 HD13 ILE 87 HD13 ILE 87 12.191 0.409 6.452
740 H LYS 88 H LYS 88 9.471 -0.874 11.096
741 HA LYS 88 HA LYS 88 11.460 -0.990 13.068
742 HB2 LYS 88 HB2 LYS 88 8.495 -0.680 13.491
743 HB3 LYS 88 HB3 LYS 88 9.768 -0.156 14.580
744 HG2 LYS 88 HG2 LYS 88 10.449 1.561 13.098
745 HG3 LYS 88 HG3 LYS 88 9.423 0.928 11.801
746 HD2 LYS 88 HD2 LYS 88 8.471 2.899 12.995
747 HD3 LYS 88 HD3 LYS 88 7.439 1.472 13.021
748 HE2 LYS 88 HE2 LYS 88 7.422 2.366 15.215
749 HE3 LYS 88 HE3 LYS 88 8.416 0.922 15.254
750 HZ1 LYS 88 HZ1 LYS 88 9.531 2.602 16.478
751 HZ2 LYS 88 HZ2 LYS 88 9.367 3.734 15.232
752 HZ3 LYS 88 HZ3 LYS 88 10.388 2.396 15.030
753 H ARG 89 H ARG 89 8.402 -2.709 12.804
754 HA ARG 89 HA ARG 89 8.885 -4.527 14.925
755 HB2 ARG 89 HB2 ARG 89 6.642 -4.004 14.059
756 HB3 ARG 89 HB3 ARG 89 7.048 -4.780 12.536
757 HG2 ARG 89 HG2 ARG 89 7.185 -6.921 13.592
758 HG3 ARG 89 HG3 ARG 89 6.994 -6.192 15.187
759 HD2 ARG 89 HD2 ARG 89 4.752 -5.520 14.670
760 HD3 ARG 89 HD3 ARG 89 4.933 -6.040 12.994
761 HE ARG 89 HE ARG 89 5.243 -8.344 13.987
762 HH11 ARG 89 HH11 ARG 89 3.330 -5.860 15.566
763 HH12 ARG 89 HH12 ARG 89 2.282 -7.002 16.356
764 HH21 ARG 89 HH21 ARG 89 3.909 -9.829 15.067
765 HH22 ARG 89 HH22 ARG 89 2.630 -9.259 16.092
766 H HIS 90 H HIS 90 10.189 -4.303 11.843
767 HA HIS 90 HA HIS 90 11.701 -5.502 10.687
768 HB2 HIS 90 HB2 HIS 90 12.203 -6.117 13.406
769 HB3 HIS 90 HB3 HIS 90 12.393 -7.606 12.484
770 HD1 HIS 90 HD1 HIS 90 14.444 -5.113 13.711
771 HD2 HIS 90 HD2 HIS 90 13.970 -6.729 9.907
772 HE1 HIS 90 HE1 HIS 90 16.563 -4.573 12.471
773 HE2 HIS 90 HE2 HIS 90 16.191 -5.416 10.126
774 H ILE 91 H ILE 91 9.055 -6.165 10.267
775 HA ILE 91 HA ILE 91 8.924 -9.033 9.903
776 HB ILE 91 HB ILE 91 7.216 -6.896 8.604
777 HG12 ILE 91 HG12 ILE 91 6.712 -8.476 11.136
778 HG13 ILE 91 HG13 ILE 91 7.114 -6.763 11.069
779 HG21 ILE 91 HG21 ILE 91 5.600 -8.717 8.304
780 HG22 ILE 91 HG22 ILE 91 6.752 -9.850 9.013
781 HG23 ILE 91 HG23 ILE 91 7.124 -9.056 7.482
782 HD11 ILE 91 HD11 ILE 91 5.035 -6.318 9.880
783 HD12 ILE 91 HD12 ILE 91 4.736 -7.111 11.427
784 HD13 ILE 91 HD13 ILE 91 4.636 -8.035 9.928
785 H ILE 92 H ILE 92 9.363 -6.152 7.905
786 HA ILE 92 HA ILE 92 11.038 -7.705 6.085
787 HB ILE 92 HB ILE 92 10.052 -6.323 4.163
788 HG12 ILE 92 HG12 ILE 92 7.705 -6.175 6.064
789 HG13 ILE 92 HG13 ILE 92 8.732 -4.810 5.642
790 HG21 ILE 92 HG21 ILE 92 9.793 -8.723 4.341
791 HG22 ILE 92 HG22 ILE 92 8.305 -7.987 3.743
792 HG23 ILE 92 HG23 ILE 92 8.416 -8.512 5.422
793 HD11 ILE 92 HD11 ILE 92 8.035 -5.019 3.312
794 HD12 ILE 92 HD12 ILE 92 6.663 -4.770 4.390
795 HD13 ILE 92 HD13 ILE 92 6.999 -6.378 3.749
796 H GLU 93 H GLU 93 12.936 -6.760 5.992
797 HA GLU 93 HA GLU 93 13.168 -3.902 6.598
798 HB2 GLU 93 HB2 GLU 93 14.627 -5.691 7.688
799 HB3 GLU 93 HB3 GLU 93 15.411 -5.869 6.124
800 HG2 GLU 93 HG2 GLU 93 15.993 -3.457 6.211
801 HG3 GLU 93 HG3 GLU 93 15.344 -3.407 7.849
802 H TYR 94 H TYR 94 12.547 -5.669 3.986
803 HA TYR 94 HA TYR 94 14.383 -4.664 2.056
804 HB2 TYR 94 HB2 TYR 94 11.579 -5.616 1.476
805 HB3 TYR 94 HB3 TYR 94 12.985 -5.676 0.422
806 HD1 TYR 94 HD2 TYR 94 14.962 -7.179 1.257
807 HD2 TYR 94 HD1 TYR 94 10.958 -7.508 2.653
808 HE1 TYR 94 HE2 TYR 94 15.418 -9.478 2.006
809 HE2 TYR 94 HE1 TYR 94 11.399 -9.806 3.403
810 HH TYR 94 HH TYR 94 14.566 -11.110 3.579
811 H ASN 95 H ASN 95 11.054 -3.867 2.920
812 HA ASN 95 HA ASN 95 9.639 -2.240 2.337
813 HB2 ASN 95 HB2 ASN 95 11.001 -1.124 4.033
814 HB3 ASN 95 HB3 ASN 95 12.088 -0.539 2.774
815 HD21 ASN 95 HD21 ASN 95 11.576 1.575 3.520
816 HD22 ASN 95 HD22 ASN 95 10.119 2.331 3.017
817 HA PRO 96 HA PRO 96 10.614 -2.139 -2.136
818 HB2 PRO 96 HB2 PRO 96 7.920 -2.067 -2.755
819 HB3 PRO 96 HB3 PRO 96 8.886 -3.539 -2.607
820 HG2 PRO 96 HG2 PRO 96 7.070 -2.253 -0.605
821 HG3 PRO 96 HG3 PRO 96 7.274 -3.973 -0.994
822 HD2 PRO 96 HD2 PRO 96 8.388 -2.909 1.186
823 HD3 PRO 96 HD3 PRO 96 9.239 -4.141 0.233
824 H ALA 97 H ALA 97 8.700 -0.120 -0.035
825 HA ALA 97 HA ALA 97 8.232 1.945 -1.981
826 HB1 ALA 97 HB1 ALA 97 7.311 3.212 -0.114
827 HB2 ALA 97 HB2 ALA 97 7.915 2.001 1.018
828 HB3 ALA 97 HB3 ALA 97 6.663 1.572 -0.148
829 H ALA 98 H ALA 98 10.880 1.026 -0.099
830 HA ALA 98 HA ALA 98 12.029 3.634 0.277
831 HB1 ALA 98 HB1 ALA 98 12.626 1.777 1.755
832 HB2 ALA 98 HB2 ALA 98 14.049 2.427 0.939
833 HB3 ALA 98 HB3 ALA 98 13.332 0.913 0.388
834 H ALA 99 H ALA 99 11.644 1.541 -2.329
835 HA ALA 99 HA ALA 99 14.004 2.395 -3.771
836 HB1 ALA 99 HB1 ALA 99 11.652 0.769 -4.729
837 HB2 ALA 99 HB2 ALA 99 13.135 0.111 -4.039
838 HB3 ALA 99 HB3 ALA 99 13.188 0.986 -5.569
839 H PHE 100 H PHE 100 10.539 3.077 -3.730
840 HA PHE 100 HA PHE 100 11.051 5.370 -5.472
841 HB2 PHE 100 HB2 PHE 100 10.245 3.623 -6.966
842 HB3 PHE 100 HB3 PHE 100 8.850 3.348 -5.930
843 HD1 PHE 100 HD2 PHE 100 10.504 6.034 -7.910
844 HD2 PHE 100 HD1 PHE 100 6.865 4.433 -6.387
845 HE1 PHE 100 HE2 PHE 100 9.237 7.724 -9.172
846 HE2 PHE 100 HE1 PHE 100 5.592 6.122 -7.645
847 HZ PHE 100 HZ PHE 100 6.780 7.769 -9.040
848 H ASP 101 H ASP 101 10.309 7.125 -4.590
849 HA ASP 101 HA ASP 101 7.585 7.222 -3.604
850 HB2 ASP 101 HB2 ASP 101 8.045 8.209 -1.509
851 HB3 ASP 101 HB3 ASP 101 9.204 6.889 -1.603
852 HA PRO 102 HA PRO 102 7.486 11.021 -5.834
853 HB2 PRO 102 HB2 PRO 102 6.732 12.567 -3.414
854 HB3 PRO 102 HB3 PRO 102 5.894 12.423 -4.963
855 HG2 PRO 102 HG2 PRO 102 4.981 11.172 -2.791
856 HG3 PRO 102 HG3 PRO 102 4.902 10.410 -4.392
857 HD2 PRO 102 HD2 PRO 102 6.799 9.898 -2.135
858 HD3 PRO 102 HD3 PRO 102 6.056 8.750 -3.267
859 H GLY 103 H GLY 103 8.327 12.388 -2.673
860 HA2 GLY 103 HA2 GLY 103 10.224 13.451 -1.935
861 HA3 GLY 103 HA3 GLY 103 11.081 12.763 -3.303
862 H ASP 104 H ASP 104 10.496 13.793 -5.456
863 HA ASP 104 HA ASP 104 10.741 15.581 -6.818
864 HB2 ASP 104 HB2 ASP 104 8.454 16.145 -6.025
865 HB3 ASP 104 HB3 ASP 104 9.164 17.108 -4.733
866 H ALA 105 H ALA 105 12.882 15.883 -6.787
867 HA ALA 105 HA ALA 105 14.335 16.759 -4.532
868 HB1 ALA 105 HB1 ALA 105 16.262 16.777 -5.994
869 HB2 ALA 105 HB2 ALA 105 15.217 16.704 -7.412
870 HB3 ALA 105 HB3 ALA 105 15.281 15.342 -6.295
871 H GLY 106 H GLY 106 12.758 18.501 -7.080
872 HA2 GLY 106 HA2 GLY 106 14.302 20.899 -6.829
873 HA3 GLY 106 HA3 GLY 106 12.753 20.736 -7.641
874 H GLY 107 H GLY 107 11.084 19.924 -5.646
875 HA2 GLY 107 HA2 GLY 107 9.958 20.710 -3.761
876 HA3 GLY 107 HA3 GLY 107 11.292 21.820 -3.453
877 H LYS 108 H LYS 108 9.409 21.354 -6.377
878 HA LYS 108 HA LYS 108 8.856 24.238 -6.362
879 HB2 LYS 108 HB2 LYS 108 8.637 23.876 -8.889
880 HB3 LYS 108 HB3 LYS 108 10.248 23.809 -8.191
881 HG2 LYS 108 HG2 LYS 108 10.225 22.021 -9.656
882 HG3 LYS 108 HG3 LYS 108 9.878 21.266 -8.102
883 HD2 LYS 108 HD2 LYS 108 8.387 20.324 -9.695
884 HD3 LYS 108 HD3 LYS 108 7.443 21.414 -8.685
885 HE2 LYS 108 HE2 LYS 108 7.396 23.078 -10.374
886 HE3 LYS 108 HE3 LYS 108 8.609 22.231 -11.333
887 HZ1 LYS 108 HZ1 LYS 108 5.868 21.228 -10.770
888 HZ2 LYS 108 HZ2 LYS 108 7.035 20.466 -11.738
889 HZ3 LYS 108 HZ3 LYS 108 6.371 21.948 -12.221
890 H LEU 109 H LEU 109 6.933 24.779 -7.844
891 HA LEU 109 HA LEU 109 4.708 23.011 -7.917
892 HB2 LEU 109 HB2 LEU 109 4.950 23.485 -5.432
893 HB3 LEU 109 HB3 LEU 109 4.584 25.160 -5.792
894 HG LEU 109 HG LEU 109 2.372 24.444 -6.677
895 HD11 LEU 109 HD11 LEU 109 3.191 21.757 -5.581
896 HD12 LEU 109 HD12 LEU 109 2.935 22.159 -7.280
897 HD13 LEU 109 HD13 LEU 109 1.578 22.188 -6.153
898 HD21 LEU 109 HD21 LEU 109 2.991 23.644 -3.836
899 HD22 LEU 109 HD22 LEU 109 1.383 23.980 -4.483
900 HD23 LEU 109 HD23 LEU 109 2.588 25.265 -4.401
901 H GLU 110 H GLU 110 2.602 24.523 -8.185
902 HA GLU 110 HA GLU 110 3.140 26.309 -10.332
903 HB2 GLU 110 HB2 GLU 110 0.590 25.983 -8.737
904 HB3 GLU 110 HB3 GLU 110 0.739 26.773 -10.302
905 HG2 GLU 110 HG2 GLU 110 1.424 24.642 -11.302
906 HG3 GLU 110 HG3 GLU 110 1.243 23.861 -9.732
907 H HIS 111 H HIS 111 4.083 28.201 -10.035
908 HA HIS 111 HA HIS 111 3.231 29.937 -7.838
909 HB2 HIS 111 HB2 HIS 111 5.128 28.469 -7.069
910 HB3 HIS 111 HB3 HIS 111 6.130 29.202 -8.313
911 HD1 HIS 111 HD1 HIS 111 7.531 31.044 -7.499
912 HD2 HIS 111 HD2 HIS 111 4.089 30.594 -5.210
913 HE1 HIS 111 HE1 HIS 111 7.731 32.721 -5.632
914 HE2 HIS 111 HE2 HIS 111 5.733 32.288 -4.150
915 H HIS 112 H HIS 112 3.365 29.724 -10.935
916 HA HIS 112 HA HIS 112 4.927 32.134 -11.504
917 HB2 HIS 112 HB2 HIS 112 3.790 29.972 -13.257
918 HB3 HIS 112 HB3 HIS 112 4.355 31.496 -13.928
919 HD1 HIS 112 HD1 HIS 112 6.845 31.847 -14.130
920 HD2 HIS 112 HD2 HIS 112 5.834 28.316 -12.179
921 HE1 HIS 112 HE1 HIS 112 8.986 30.540 -13.937
922 HE2 HIS 112 HE2 HIS 112 8.315 28.330 -12.922
923 H HIS 113 H HIS 113 3.897 33.972 -11.318
924 HA HIS 113 HA HIS 113 1.554 34.407 -12.948
925 HB2 HIS 113 HB2 HIS 113 0.152 35.387 -11.243
926 HB3 HIS 113 HB3 HIS 113 0.577 33.761 -10.736
927 HD1 HIS 113 HD1 HIS 113 -0.022 36.785 -9.211
928 HD2 HIS 113 HD2 HIS 113 3.209 34.169 -9.021
929 HE1 HIS 113 HE1 HIS 113 1.172 37.333 -7.071
930 HE2 HIS 113 HE2 HIS 113 3.231 35.886 -7.093
931 H HIS 114 H HIS 114 1.998 36.181 -14.090
932 HA HIS 114 HA HIS 114 4.210 37.830 -13.385
933 HB2 HIS 114 HB2 HIS 114 3.690 39.166 -15.368
934 HB3 HIS 114 HB3 HIS 114 3.694 37.449 -15.733
935 HD1 HIS 114 HD1 HIS 114 1.787 40.442 -16.278
936 HD2 HIS 114 HD2 HIS 114 0.909 36.395 -15.874
937 HE1 HIS 114 HE1 HIS 114 -0.485 40.132 -17.304
938 HE2 HIS 114 HE2 HIS 114 -0.878 37.639 -17.266
939 H HIS 115 H HIS 115 0.816 38.041 -12.803
940 HA HIS 115 HA HIS 115 1.253 39.985 -10.786
941 HB2 HIS 115 HB2 HIS 115 1.210 41.490 -12.771
942 HB3 HIS 115 HB3 HIS 115 -0.411 40.915 -13.141
943 HD1 HIS 115 HD1 HIS 115 -2.200 42.406 -12.317
944 HD2 HIS 115 HD2 HIS 115 1.238 42.677 -9.982
945 HE1 HIS 115 HE1 HIS 115 -2.691 44.150 -10.575
946 HE2 HIS 115 HE2 HIS 115 -0.551 44.411 -9.271
947 H HIS 116 H HIS 116 -1.605 39.508 -12.840
948 HA HIS 116 HA HIS 116 -3.182 38.788 -10.520
949 HB2 HIS 116 HB2 HIS 116 -4.038 40.251 -12.365
950 HB3 HIS 116 HB3 HIS 116 -3.987 38.862 -13.440
951 HD1 HIS 116 HD1 HIS 116 -6.061 40.526 -10.894
952 HD2 HIS 116 HD2 HIS 116 -5.942 36.835 -12.821
953 HE1 HIS 116 HE1 HIS 116 -8.315 39.477 -10.504
954 HE2 HIS 116 HE2 HIS 116 -8.265 37.305 -11.780
Start of MODEL 18
1 H1 MET 1 H1 MET 1 5.373 -13.741 16.686
2 H2 MET 1 H2 MET 1 4.743 -14.989 17.641
3 H3 MET 1 H3 MET 1 5.318 -13.573 18.373
4 HA MET 1 HA MET 1 2.961 -13.506 18.383
5 HB2 MET 1 HB2 MET 1 4.159 -11.703 16.273
6 HB3 MET 1 HB3 MET 1 2.569 -11.467 16.988
7 HG2 MET 1 HG2 MET 1 5.196 -11.437 18.457
8 HG3 MET 1 HG3 MET 1 4.226 -10.029 18.027
9 HE1 MET 1 HE1 MET 1 4.468 -9.349 20.640
10 HE2 MET 1 HE2 MET 1 5.307 -10.858 21.001
11 HE3 MET 1 HE3 MET 1 3.909 -10.375 21.961
12 H ALA 2 H ALA 2 4.303 -14.305 15.226
13 HA ALA 2 HA ALA 2 1.637 -14.904 14.198
14 HB1 ALA 2 HB1 ALA 2 2.760 -15.334 12.074
15 HB2 ALA 2 HB2 ALA 2 4.327 -15.110 12.853
16 HB3 ALA 2 HB3 ALA 2 3.207 -13.754 12.716
17 H GLU 3 H GLU 3 4.741 -16.554 14.365
18 HA GLU 3 HA GLU 3 5.381 -18.684 14.725
19 HB2 GLU 3 HB2 GLU 3 2.808 -18.646 16.273
20 HB3 GLU 3 HB3 GLU 3 3.762 -20.114 16.143
21 HG2 GLU 3 HG2 GLU 3 4.262 -18.980 18.203
22 HG3 GLU 3 HG3 GLU 3 5.673 -18.949 17.146
23 H LYS 4 H LYS 4 1.954 -19.494 14.555
24 HA LYS 4 HA LYS 4 2.586 -21.356 12.392
25 HB2 LYS 4 HB2 LYS 4 0.277 -22.254 12.941
26 HB3 LYS 4 HB3 LYS 4 1.488 -22.415 14.208
27 HG2 LYS 4 HG2 LYS 4 0.576 -20.538 15.392
28 HG3 LYS 4 HG3 LYS 4 -0.555 -20.212 14.078
29 HD2 LYS 4 HD2 LYS 4 -1.644 -22.353 14.477
30 HD3 LYS 4 HD3 LYS 4 -0.495 -22.701 15.772
31 HE2 LYS 4 HE2 LYS 4 -2.661 -21.865 16.605
32 HE3 LYS 4 HE3 LYS 4 -1.309 -20.835 17.058
33 HZ1 LYS 4 HZ1 LYS 4 -1.901 -19.300 15.321
34 HZ2 LYS 4 HZ2 LYS 4 -3.253 -19.579 16.304
35 HZ3 LYS 4 HZ3 LYS 4 -3.147 -20.317 14.781
36 H ASN 5 H ASN 5 0.404 -18.698 13.184
37 HA ASN 5 HA ASN 5 -0.987 -18.800 10.674
38 HB2 ASN 5 HB2 ASN 5 -0.942 -16.797 12.934
39 HB3 ASN 5 HB3 ASN 5 -1.898 -16.557 11.476
40 HD21 ASN 5 HD21 ASN 5 -3.726 -16.525 12.888
41 HD22 ASN 5 HD22 ASN 5 -4.420 -18.010 13.445
42 H ALA 6 H ALA 6 -0.197 -18.096 8.800
43 HA ALA 6 HA ALA 6 2.150 -16.426 8.707
44 HB1 ALA 6 HB1 ALA 6 1.829 -18.234 7.093
45 HB2 ALA 6 HB2 ALA 6 1.976 -16.671 6.287
46 HB3 ALA 6 HB3 ALA 6 0.392 -17.426 6.467
47 H TYR 7 H TYR 7 2.291 -14.311 8.178
48 HA TYR 7 HA TYR 7 -0.229 -12.816 8.183
49 HB2 TYR 7 HB2 TYR 7 1.667 -12.437 9.894
50 HB3 TYR 7 HB3 TYR 7 2.518 -11.647 8.573
51 HD1 TYR 7 HD1 TYR 7 -0.638 -11.539 10.531
52 HD2 TYR 7 HD2 TYR 7 2.095 -9.391 8.079
53 HE1 TYR 7 HE1 TYR 7 -1.825 -9.450 11.052
54 HE2 TYR 7 HE2 TYR 7 0.913 -7.295 8.594
55 HH TYR 7 HH TYR 7 -1.404 -7.055 11.089
56 H THR 8 H THR 8 -0.929 -11.950 6.350
57 HA THR 8 HA THR 8 0.977 -11.595 4.137
58 HB THR 8 HB THR 8 -1.108 -11.577 2.694
59 HG1 THR 8 HG1 THR 8 -3.014 -12.281 3.594
60 HG21 THR 8 HG21 THR 8 -0.552 -14.081 4.287
61 HG22 THR 8 HG22 THR 8 0.345 -13.541 2.868
62 HG23 THR 8 HG23 THR 8 -1.348 -14.012 2.715
63 H VAL 9 H VAL 9 0.323 -9.788 2.586
64 HA VAL 9 HA VAL 9 0.483 -7.359 4.025
65 HB VAL 9 HB VAL 9 1.511 -7.685 1.808
66 HG11 VAL 9 HG11 VAL 9 -0.244 -8.966 0.734
67 HG12 VAL 9 HG12 VAL 9 0.147 -7.532 -0.215
68 HG13 VAL 9 HG13 VAL 9 -1.314 -7.565 0.772
69 HG21 VAL 9 HG21 VAL 9 -0.470 -5.413 1.908
70 HG22 VAL 9 HG22 VAL 9 0.950 -5.495 0.865
71 HG23 VAL 9 HG23 VAL 9 1.146 -5.421 2.616
72 H ALA 10 H ALA 10 -2.208 -9.132 2.734
73 HA ALA 10 HA ALA 10 -4.098 -7.066 2.523
74 HB1 ALA 10 HB1 ALA 10 -5.784 -8.814 2.625
75 HB2 ALA 10 HB2 ALA 10 -4.583 -9.959 3.224
76 HB3 ALA 10 HB3 ALA 10 -4.445 -9.308 1.590
77 H GLN 11 H GLN 11 -3.106 -9.069 5.256
78 HA GLN 11 HA GLN 11 -5.089 -7.975 7.022
79 HB2 GLN 11 HB2 GLN 11 -2.653 -9.686 7.532
80 HB3 GLN 11 HB3 GLN 11 -3.781 -9.193 8.789
81 HG2 GLN 11 HG2 GLN 11 -4.475 -10.833 6.362
82 HG3 GLN 11 HG3 GLN 11 -4.221 -11.458 7.991
83 HE21 GLN 11 HE21 GLN 11 -6.325 -9.631 5.919
84 HE22 GLN 11 HE22 GLN 11 -7.701 -9.634 6.966
85 H LEU 12 H LEU 12 -1.804 -7.272 6.143
86 HA LEU 12 HA LEU 12 -1.103 -5.599 8.293
87 HB2 LEU 12 HB2 LEU 12 0.514 -6.475 6.654
88 HB3 LEU 12 HB3 LEU 12 -0.206 -5.476 5.407
89 HG LEU 12 HG LEU 12 0.487 -3.455 6.655
90 HD11 LEU 12 HD11 LEU 12 0.519 -4.406 8.899
91 HD12 LEU 12 HD12 LEU 12 2.068 -3.664 8.502
92 HD13 LEU 12 HD13 LEU 12 1.893 -5.420 8.460
93 HD21 LEU 12 HD21 LEU 12 1.893 -4.368 4.874
94 HD22 LEU 12 HD22 LEU 12 2.730 -5.380 6.053
95 HD23 LEU 12 HD23 LEU 12 2.863 -3.623 6.144
96 H ALA 13 H ALA 13 -2.910 -5.050 5.339
97 HA ALA 13 HA ALA 13 -3.114 -2.247 5.482
98 HB1 ALA 13 HB1 ALA 13 -5.054 -2.492 4.011
99 HB2 ALA 13 HB2 ALA 13 -5.087 -4.227 4.334
100 HB3 ALA 13 HB3 ALA 13 -3.717 -3.514 3.481
101 H ASP 14 H ASP 14 -5.126 -4.832 6.827
102 HA ASP 14 HA ASP 14 -7.071 -3.174 8.016
103 HB2 ASP 14 HB2 ASP 14 -6.224 -6.005 8.333
104 HB3 ASP 14 HB3 ASP 14 -7.167 -5.297 9.639
105 H GLU 15 H GLU 15 -4.109 -4.627 9.317
106 HA GLU 15 HA GLU 15 -4.301 -3.644 11.927
107 HB2 GLU 15 HB2 GLU 15 -2.680 -5.349 11.238
108 HB3 GLU 15 HB3 GLU 15 -1.841 -4.165 10.248
109 HG2 GLU 15 HG2 GLU 15 -0.635 -4.554 12.298
110 HG3 GLU 15 HG3 GLU 15 -1.251 -2.903 12.262
111 H TYR 16 H TYR 16 -2.802 -2.232 9.048
112 HA TYR 16 HA TYR 16 -1.687 -0.007 10.371
113 HB2 TYR 16 HB2 TYR 16 -0.886 -0.844 8.197
114 HB3 TYR 16 HB3 TYR 16 -2.385 -0.304 7.446
115 HD1 TYR 16 HD1 TYR 16 0.809 0.759 8.896
116 HD2 TYR 16 HD2 TYR 16 -2.794 2.054 7.040
117 HE1 TYR 16 HE1 TYR 16 1.806 2.973 8.511
118 HE2 TYR 16 HE2 TYR 16 -1.803 4.266 6.649
119 HH TYR 16 HH TYR 16 1.459 4.886 6.910
120 H PHE 17 H PHE 17 -4.783 -0.397 8.634
121 HA PHE 17 HA PHE 17 -5.302 2.415 8.750
122 HB2 PHE 17 HB2 PHE 17 -7.098 2.042 7.413
123 HB3 PHE 17 HB3 PHE 17 -6.252 0.535 7.113
124 HD1 PHE 17 HD2 PHE 17 -7.098 -1.559 8.020
125 HD2 PHE 17 HD1 PHE 17 -9.158 2.110 8.632
126 HE1 PHE 17 HE2 PHE 17 -9.118 -2.802 8.667
127 HE2 PHE 17 HE1 PHE 17 -11.183 0.872 9.273
128 HZ PHE 17 HZ PHE 17 -11.162 -1.589 9.291
129 H GLU 18 H GLU 18 -6.044 -0.316 10.797
130 HA GLU 18 HA GLU 18 -7.866 1.035 12.503
131 HB2 GLU 18 HB2 GLU 18 -6.105 -1.375 12.834
132 HB3 GLU 18 HB3 GLU 18 -7.005 -0.727 14.199
133 HG2 GLU 18 HG2 GLU 18 -8.243 -1.604 11.597
134 HG3 GLU 18 HG3 GLU 18 -8.141 -2.598 13.049
135 H ARG 19 H ARG 19 -4.469 1.234 12.077
136 HA ARG 19 HA ARG 19 -3.956 2.372 14.697
137 HB2 ARG 19 HB2 ARG 19 -2.165 2.084 12.279
138 HB3 ARG 19 HB3 ARG 19 -1.645 2.658 13.856
139 HG2 ARG 19 HG2 ARG 19 -2.771 -0.072 13.281
140 HG3 ARG 19 HG3 ARG 19 -1.059 0.318 13.465
141 HD2 ARG 19 HD2 ARG 19 -1.422 1.008 15.744
142 HD3 ARG 19 HD3 ARG 19 -3.160 0.768 15.575
143 HE ARG 19 HE ARG 19 -2.361 -1.666 15.024
144 HH11 ARG 19 HH11 ARG 19 -1.023 0.491 17.456
145 HH12 ARG 19 HH12 ARG 19 -0.630 -0.807 18.550
146 HH21 ARG 19 HH21 ARG 19 -1.858 -3.332 16.444
147 HH22 ARG 19 HH22 ARG 19 -1.117 -2.986 17.978
148 H MET 20 H MET 20 -3.599 3.528 11.333
149 HA MET 20 HA MET 20 -3.075 6.199 12.344
150 HB2 MET 20 HB2 MET 20 -3.118 5.206 9.492
151 HB3 MET 20 HB3 MET 20 -2.498 6.757 10.042
152 HG2 MET 20 HG2 MET 20 -1.394 4.037 10.689
153 HG3 MET 20 HG3 MET 20 -0.674 5.252 9.635
154 HE1 MET 20 HE1 MET 20 0.899 3.786 11.994
155 HE2 MET 20 HE2 MET 20 1.780 5.144 12.694
156 HE3 MET 20 HE3 MET 20 1.632 4.996 10.943
157 H ILE 21 H ILE 21 -5.791 4.508 11.222
158 HA ILE 21 HA ILE 21 -7.173 7.013 10.504
159 HB ILE 21 HB ILE 21 -8.091 4.203 9.869
160 HG12 ILE 21 HG12 ILE 21 -6.467 6.121 8.176
161 HG13 ILE 21 HG13 ILE 21 -5.921 4.574 8.812
162 HG21 ILE 21 HG21 ILE 21 -9.846 5.890 9.793
163 HG22 ILE 21 HG22 ILE 21 -9.456 5.329 8.165
164 HG23 ILE 21 HG23 ILE 21 -8.857 6.890 8.727
165 HD11 ILE 21 HD11 ILE 21 -6.458 4.418 6.457
166 HD12 ILE 21 HD12 ILE 21 -8.101 4.974 6.779
167 HD13 ILE 21 HD13 ILE 21 -7.553 3.423 7.418
168 H ALA 22 H ALA 22 -6.563 5.698 13.179
169 HA ALA 22 HA ALA 22 -9.321 5.532 14.181
170 HB1 ALA 22 HB1 ALA 22 -8.382 4.518 16.190
171 HB2 ALA 22 HB2 ALA 22 -6.757 4.696 15.530
172 HB3 ALA 22 HB3 ALA 22 -7.915 3.620 14.746
173 H GLY 23 H GLY 23 -9.963 7.565 14.540
174 HA2 GLY 23 HA2 GLY 23 -9.362 8.973 16.794
175 HA3 GLY 23 HA3 GLY 23 -8.221 9.591 15.606
176 H ARG 24 H ARG 24 -9.076 10.554 13.664
177 HA ARG 24 HA ARG 24 -11.908 11.241 13.683
178 HB2 ARG 24 HB2 ARG 24 -10.854 13.100 14.870
179 HB3 ARG 24 HB3 ARG 24 -9.672 13.286 13.581
180 HG2 ARG 24 HG2 ARG 24 -11.410 14.989 13.462
181 HG3 ARG 24 HG3 ARG 24 -11.430 13.948 12.038
182 HD2 ARG 24 HD2 ARG 24 -13.237 12.616 13.177
183 HD3 ARG 24 HD3 ARG 24 -13.306 13.896 14.388
184 HE ARG 24 HE ARG 24 -13.537 14.984 11.781
185 HH11 ARG 24 HH11 ARG 24 -15.353 13.237 14.233
186 HH12 ARG 24 HH12 ARG 24 -16.900 13.729 13.608
187 HH21 ARG 24 HH21 ARG 24 -15.566 15.614 10.961
188 HH22 ARG 24 HH22 ARG 24 -17.024 15.102 11.767
189 H TRP 25 H TRP 25 -12.394 10.244 11.813
190 HA TRP 25 HA TRP 25 -10.850 10.974 9.430
191 HB2 TRP 25 HB2 TRP 25 -10.670 8.664 8.716
192 HB3 TRP 25 HB3 TRP 25 -9.963 8.825 10.312
193 HD1 TRP 25 HD1 TRP 25 -12.389 6.838 8.399
194 HE1 TRP 25 HE1 TRP 25 -13.689 5.246 9.936
195 HE3 TRP 25 HE3 TRP 25 -11.018 8.753 12.935
196 HZ2 TRP 25 HZ2 TRP 25 -14.074 4.830 12.688
197 HZ3 TRP 25 HZ3 TRP 25 -11.890 7.686 14.972
198 HH2 TRP 25 HH2 TRP 25 -13.389 5.767 14.848
199 H LYS 26 H LYS 26 -13.760 9.390 10.691
200 HA LYS 26 HA LYS 26 -15.884 9.195 9.939
201 HB2 LYS 26 HB2 LYS 26 -15.094 11.316 7.934
202 HB3 LYS 26 HB3 LYS 26 -16.728 10.719 8.168
203 HG2 LYS 26 HG2 LYS 26 -15.139 12.010 10.370
204 HG3 LYS 26 HG3 LYS 26 -16.157 12.923 9.260
205 HD2 LYS 26 HD2 LYS 26 -17.508 12.563 11.147
206 HD3 LYS 26 HD3 LYS 26 -18.049 11.359 9.978
207 HE2 LYS 26 HE2 LYS 26 -16.790 9.638 11.099
208 HE3 LYS 26 HE3 LYS 26 -16.070 10.821 12.188
209 HZ1 LYS 26 HZ1 LYS 26 -17.878 9.598 13.241
210 HZ2 LYS 26 HZ2 LYS 26 -18.966 10.146 12.063
211 HZ3 LYS 26 HZ3 LYS 26 -18.248 11.251 13.129
212 H HIS 27 H HIS 27 -16.569 7.452 8.980
213 HA HIS 27 HA HIS 27 -16.959 5.803 7.474
214 HB2 HIS 27 HB2 HIS 27 -15.695 7.704 5.494
215 HB3 HIS 27 HB3 HIS 27 -16.458 6.181 5.058
216 HD1 HIS 27 HD1 HIS 27 -17.321 9.243 4.313
217 HD2 HIS 27 HD2 HIS 27 -19.175 6.602 6.946
218 HE1 HIS 27 HE1 HIS 27 -19.706 10.016 4.490
219 HE2 HIS 27 HE2 HIS 27 -20.850 8.262 5.891
220 HA PRO 28 HA PRO 28 -12.633 4.340 8.105
221 HB2 PRO 28 HB2 PRO 28 -13.327 2.026 9.362
222 HB3 PRO 28 HB3 PRO 28 -13.144 3.568 10.203
223 HG2 PRO 28 HG2 PRO 28 -15.629 2.175 9.307
224 HG3 PRO 28 HG3 PRO 28 -15.325 3.082 10.798
225 HD2 PRO 28 HD2 PRO 28 -16.687 4.101 8.662
226 HD3 PRO 28 HD3 PRO 28 -15.771 5.098 9.808
227 H ASN 29 H ASN 29 -15.490 2.573 6.985
228 HA ASN 29 HA ASN 29 -13.960 0.488 5.739
229 HB2 ASN 29 HB2 ASN 29 -16.090 -0.362 4.937
230 HB3 ASN 29 HB3 ASN 29 -16.217 0.065 6.637
231 HD21 ASN 29 HD21 ASN 29 -18.312 -0.247 4.689
232 HD22 ASN 29 HD22 ASN 29 -19.152 1.263 4.607
233 H ILE 30 H ILE 30 -15.116 3.590 4.791
234 HA ILE 30 HA ILE 30 -15.117 3.136 1.978
235 HB ILE 30 HB ILE 30 -14.872 5.719 3.532
236 HG12 ILE 30 HG12 ILE 30 -16.990 4.554 3.906
237 HG13 ILE 30 HG13 ILE 30 -17.251 6.001 2.938
238 HG21 ILE 30 HG21 ILE 30 -13.940 5.941 1.277
239 HG22 ILE 30 HG22 ILE 30 -15.434 6.862 1.458
240 HG23 ILE 30 HG23 ILE 30 -15.445 5.323 0.596
241 HD11 ILE 30 HD11 ILE 30 -17.087 3.190 1.873
242 HD12 ILE 30 HD12 ILE 30 -17.398 4.647 0.928
243 HD13 ILE 30 HD13 ILE 30 -18.567 4.112 2.136
244 H VAL 31 H VAL 31 -12.764 4.597 4.220
245 HA VAL 31 HA VAL 31 -10.761 4.894 2.219
246 HB VAL 31 HB VAL 31 -10.741 6.274 4.244
247 HG11 VAL 31 HG11 VAL 31 -10.065 3.725 5.697
248 HG12 VAL 31 HG12 VAL 31 -11.546 4.667 5.862
249 HG13 VAL 31 HG13 VAL 31 -10.007 5.344 6.393
250 HG21 VAL 31 HG21 VAL 31 -8.353 6.128 4.754
251 HG22 VAL 31 HG22 VAL 31 -8.655 5.957 3.024
252 HG23 VAL 31 HG23 VAL 31 -8.289 4.535 4.001
253 H ARG 32 H ARG 32 -11.659 2.334 4.442
254 HA ARG 32 HA ARG 32 -9.430 0.657 4.070
255 HB2 ARG 32 HB2 ARG 32 -10.940 0.164 5.840
256 HB3 ARG 32 HB3 ARG 32 -12.315 0.099 4.753
257 HG2 ARG 32 HG2 ARG 32 -11.530 -2.104 5.631
258 HG3 ARG 32 HG3 ARG 32 -11.634 -1.992 3.874
259 HD2 ARG 32 HD2 ARG 32 -9.309 -1.904 3.630
260 HD3 ARG 32 HD3 ARG 32 -9.055 -1.477 5.317
261 HE ARG 32 HE ARG 32 -9.037 -3.701 5.834
262 HH11 ARG 32 HH11 ARG 32 -10.595 -3.326 2.722
263 HH12 ARG 32 HH12 ARG 32 -10.655 -5.032 2.396
264 HH21 ARG 32 HH21 ARG 32 -9.085 -5.931 5.429
265 HH22 ARG 32 HH22 ARG 32 -9.802 -6.523 3.954
266 H SER 33 H SER 33 -12.474 0.953 2.287
267 HA SER 33 HA SER 33 -12.003 -1.049 0.377
268 HB2 SER 33 HB2 SER 33 -14.199 0.054 0.758
269 HB3 SER 33 HB3 SER 33 -13.559 1.534 0.049
270 HG SER 33 HG SER 33 -13.503 -0.905 -1.384
271 H ARG 34 H ARG 34 -10.866 2.229 0.657
272 HA ARG 34 HA ARG 34 -9.875 2.491 -2.004
273 HB2 ARG 34 HB2 ARG 34 -10.285 4.211 0.079
274 HB3 ARG 34 HB3 ARG 34 -8.539 4.020 0.139
275 HG2 ARG 34 HG2 ARG 34 -9.108 5.935 -1.197
276 HG3 ARG 34 HG3 ARG 34 -8.409 4.683 -2.227
277 HD2 ARG 34 HD2 ARG 34 -10.572 4.037 -3.019
278 HD3 ARG 34 HD3 ARG 34 -11.367 5.102 -1.862
279 HE ARG 34 HE ARG 34 -9.872 6.828 -3.274
280 HH11 ARG 34 HH11 ARG 34 -12.081 4.282 -4.241
281 HH12 ARG 34 HH12 ARG 34 -12.563 5.083 -5.710
282 HH21 ARG 34 HH21 ARG 34 -10.494 7.883 -5.205
283 HH22 ARG 34 HH22 ARG 34 -11.645 7.122 -6.270
284 H ILE 35 H ILE 35 -8.320 1.900 1.128
285 HA ILE 35 HA ILE 35 -5.694 1.568 0.295
286 HB ILE 35 HB ILE 35 -7.152 0.264 2.595
287 HG12 ILE 35 HG12 ILE 35 -5.323 2.675 2.510
288 HG13 ILE 35 HG13 ILE 35 -7.081 2.746 2.587
289 HG21 ILE 35 HG21 ILE 35 -5.166 -1.031 2.127
290 HG22 ILE 35 HG22 ILE 35 -4.918 -0.080 3.592
291 HG23 ILE 35 HG23 ILE 35 -4.186 0.434 2.072
292 HD11 ILE 35 HD11 ILE 35 -5.278 1.544 4.669
293 HD12 ILE 35 HD12 ILE 35 -7.036 1.640 4.754
294 HD13 ILE 35 HD13 ILE 35 -6.070 3.116 4.764
295 H GLU 36 H GLU 36 -8.285 -0.868 0.445
296 HA GLU 36 HA GLU 36 -6.430 -2.999 -0.009
297 HB2 GLU 36 HB2 GLU 36 -8.380 -4.467 -0.022
298 HB3 GLU 36 HB3 GLU 36 -8.385 -3.384 1.359
299 HG2 GLU 36 HG2 GLU 36 -10.565 -3.273 0.748
300 HG3 GLU 36 HG3 GLU 36 -9.922 -1.930 -0.191
301 H LYS 37 H LYS 37 -7.912 -0.810 -2.131
302 HA LYS 37 HA LYS 37 -7.479 -2.715 -4.330
303 HB2 LYS 37 HB2 LYS 37 -8.896 -1.365 -5.729
304 HB3 LYS 37 HB3 LYS 37 -9.748 -1.766 -4.248
305 HG2 LYS 37 HG2 LYS 37 -9.376 0.455 -3.386
306 HG3 LYS 37 HG3 LYS 37 -8.397 0.868 -4.797
307 HD2 LYS 37 HD2 LYS 37 -11.325 0.130 -4.812
308 HD3 LYS 37 HD3 LYS 37 -10.660 1.748 -5.035
309 HE2 LYS 37 HE2 LYS 37 -9.612 1.107 -7.087
310 HE3 LYS 37 HE3 LYS 37 -10.016 -0.586 -6.826
311 HZ1 LYS 37 HZ1 LYS 37 -11.953 1.612 -7.329
312 HZ2 LYS 37 HZ2 LYS 37 -12.361 -0.006 -7.023
313 HZ3 LYS 37 HZ3 LYS 37 -11.502 0.397 -8.425
314 H ASP 38 H ASP 38 -6.253 0.058 -2.835
315 HA ASP 38 HA ASP 38 -4.684 0.895 -5.133
316 HB2 ASP 38 HB2 ASP 38 -5.417 2.684 -3.742
317 HB3 ASP 38 HB3 ASP 38 -4.878 1.865 -2.282
318 H ILE 39 H ILE 39 -4.049 -0.314 -1.860
319 HA ILE 39 HA ILE 39 -1.258 -0.689 -2.393
320 HB ILE 39 HB ILE 39 -2.984 -1.399 -0.017
321 HG12 ILE 39 HG12 ILE 39 -0.954 0.795 -0.497
322 HG13 ILE 39 HG13 ILE 39 -2.703 0.992 -0.444
323 HG21 ILE 39 HG21 ILE 39 0.018 -1.589 -0.303
324 HG22 ILE 39 HG22 ILE 39 -1.100 -2.935 -0.086
325 HG23 ILE 39 HG23 ILE 39 -0.873 -1.758 1.208
326 HD11 ILE 39 HD11 ILE 39 -0.950 0.135 1.845
327 HD12 ILE 39 HD12 ILE 39 -2.701 0.332 1.904
328 HD13 ILE 39 HD13 ILE 39 -1.665 1.730 1.617
329 H LYS 40 H LYS 40 -4.089 -2.806 -2.170
330 HA LYS 40 HA LYS 40 -2.367 -4.973 -3.163
331 HB2 LYS 40 HB2 LYS 40 -3.995 -6.547 -1.930
332 HB3 LYS 40 HB3 LYS 40 -2.754 -5.720 -1.000
333 HG2 LYS 40 HG2 LYS 40 -4.248 -4.487 0.157
334 HG3 LYS 40 HG3 LYS 40 -5.348 -4.332 -1.214
335 HD2 LYS 40 HD2 LYS 40 -4.990 -6.922 0.278
336 HD3 LYS 40 HD3 LYS 40 -6.168 -5.703 0.767
337 HE2 LYS 40 HE2 LYS 40 -7.200 -5.821 -1.455
338 HE3 LYS 40 HE3 LYS 40 -6.031 -7.049 -1.931
339 HZ1 LYS 40 HZ1 LYS 40 -6.977 -8.604 -0.496
340 HZ2 LYS 40 HZ2 LYS 40 -8.316 -7.819 -1.181
341 HZ3 LYS 40 HZ3 LYS 40 -7.823 -7.432 0.393
342 HA PRO 41 HA PRO 41 -6.006 -4.306 -6.047
343 HB2 PRO 41 HB2 PRO 41 -3.887 -4.447 -8.090
344 HB3 PRO 41 HB3 PRO 41 -5.171 -3.251 -7.886
345 HG2 PRO 41 HG2 PRO 41 -2.610 -2.661 -7.360
346 HG3 PRO 41 HG3 PRO 41 -3.941 -1.987 -6.399
347 HD2 PRO 41 HD2 PRO 41 -2.101 -4.266 -5.754
348 HD3 PRO 41 HD3 PRO 41 -2.678 -2.955 -4.703
349 H ALA 42 H ALA 42 -3.252 -6.445 -5.937
350 HA ALA 42 HA ALA 42 -4.925 -8.687 -6.649
351 HB1 ALA 42 HB1 ALA 42 -4.173 -7.905 -8.848
352 HB2 ALA 42 HB2 ALA 42 -3.508 -9.492 -8.459
353 HB3 ALA 42 HB3 ALA 42 -2.497 -8.054 -8.321
354 H ILE 43 H ILE 43 -1.911 -7.383 -5.566
355 HA ILE 43 HA ILE 43 -0.710 -9.892 -4.878
356 HB ILE 43 HB ILE 43 0.929 -8.372 -3.653
357 HG12 ILE 43 HG12 ILE 43 -0.490 -6.203 -5.194
358 HG13 ILE 43 HG13 ILE 43 -0.823 -6.513 -3.496
359 HG21 ILE 43 HG21 ILE 43 0.443 -7.993 -6.605
360 HG22 ILE 43 HG22 ILE 43 1.394 -9.273 -5.852
361 HG23 ILE 43 HG23 ILE 43 1.945 -7.599 -5.769
362 HD11 ILE 43 HD11 ILE 43 1.839 -5.735 -4.674
363 HD12 ILE 43 HD12 ILE 43 1.516 -6.037 -2.966
364 HD13 ILE 43 HD13 ILE 43 0.745 -4.678 -3.783
365 H GLY 44 H GLY 44 -3.366 -9.068 -3.620
366 HA2 GLY 44 HA2 GLY 44 -2.904 -8.367 -0.912
367 HA3 GLY 44 HA3 GLY 44 -4.398 -9.016 -1.567
368 H SER 45 H SER 45 -3.050 -11.452 -2.554
369 HA SER 45 HA SER 45 -3.173 -12.888 -0.028
370 HB2 SER 45 HB2 SER 45 -3.113 -13.919 -2.874
371 HB3 SER 45 HB3 SER 45 -3.389 -14.897 -1.431
372 HG SER 45 HG SER 45 -5.224 -13.773 -2.824
373 H LEU 46 H LEU 46 -0.774 -11.339 -1.355
374 HA LEU 46 HA LEU 46 1.212 -13.469 -1.278
375 HB2 LEU 46 HB2 LEU 46 1.239 -10.607 -2.129
376 HB3 LEU 46 HB3 LEU 46 2.750 -11.364 -1.668
377 HG LEU 46 HG LEU 46 2.331 -13.116 -3.407
378 HD11 LEU 46 HD11 LEU 46 0.109 -11.266 -4.253
379 HD12 LEU 46 HD12 LEU 46 -0.094 -12.879 -3.571
380 HD13 LEU 46 HD13 LEU 46 0.686 -12.678 -5.139
381 HD21 LEU 46 HD21 LEU 46 2.441 -10.266 -4.378
382 HD22 LEU 46 HD22 LEU 46 2.953 -11.690 -5.284
383 HD23 LEU 46 HD23 LEU 46 3.810 -11.225 -3.815
384 H LYS 47 H LYS 47 2.988 -13.448 0.109
385 HA LYS 47 HA LYS 47 2.500 -12.748 2.795
386 HB2 LYS 47 HB2 LYS 47 4.111 -14.500 1.733
387 HB3 LYS 47 HB3 LYS 47 5.246 -13.164 1.638
388 HG2 LYS 47 HG2 LYS 47 5.739 -14.363 3.610
389 HG3 LYS 47 HG3 LYS 47 4.955 -12.863 4.108
390 HD2 LYS 47 HD2 LYS 47 4.126 -14.813 5.359
391 HD3 LYS 47 HD3 LYS 47 2.854 -14.033 4.421
392 HE2 LYS 47 HE2 LYS 47 2.759 -16.493 4.286
393 HE3 LYS 47 HE3 LYS 47 3.011 -15.734 2.715
394 HZ1 LYS 47 HZ1 LYS 47 5.190 -16.894 4.379
395 HZ2 LYS 47 HZ2 LYS 47 5.321 -16.308 2.791
396 HZ3 LYS 47 HZ3 LYS 47 4.418 -17.708 3.104
397 H VAL 48 H VAL 48 3.659 -11.169 4.101
398 HA VAL 48 HA VAL 48 3.816 -8.595 3.011
399 HB VAL 48 HB VAL 48 5.229 -9.571 5.504
400 HG11 VAL 48 HG11 VAL 48 5.015 -7.247 6.252
401 HG12 VAL 48 HG12 VAL 48 4.307 -6.814 4.695
402 HG13 VAL 48 HG13 VAL 48 5.977 -7.374 4.781
403 HG21 VAL 48 HG21 VAL 48 2.430 -8.496 5.171
404 HG22 VAL 48 HG22 VAL 48 3.219 -8.847 6.709
405 HG23 VAL 48 HG23 VAL 48 2.870 -10.155 5.580
406 H GLU 49 H GLU 49 6.156 -11.144 3.204
407 HA GLU 49 HA GLU 49 8.460 -9.566 2.615
408 HB2 GLU 49 HB2 GLU 49 8.626 -11.775 3.680
409 HB3 GLU 49 HB3 GLU 49 7.952 -12.526 2.241
410 HG2 GLU 49 HG2 GLU 49 9.929 -11.610 0.977
411 HG3 GLU 49 HG3 GLU 49 10.620 -11.177 2.540
412 H ASP 50 H ASP 50 5.871 -10.887 0.734
413 HA ASP 50 HA ASP 50 7.508 -10.912 -1.686
414 HB2 ASP 50 HB2 ASP 50 5.668 -12.723 -0.779
415 HB3 ASP 50 HB3 ASP 50 4.738 -11.806 -1.965
416 H VAL 51 H VAL 51 5.960 -8.600 -0.180
417 HA VAL 51 HA VAL 51 4.487 -7.455 -2.392
418 HB VAL 51 HB VAL 51 3.967 -7.023 0.043
419 HG11 VAL 51 HG11 VAL 51 5.243 -5.269 1.202
420 HG12 VAL 51 HG12 VAL 51 6.427 -5.290 -0.106
421 HG13 VAL 51 HG13 VAL 51 6.202 -6.719 0.904
422 HG21 VAL 51 HG21 VAL 51 3.027 -5.636 -1.708
423 HG22 VAL 51 HG22 VAL 51 4.457 -4.604 -1.680
424 HG23 VAL 51 HG23 VAL 51 3.390 -4.672 -0.277
425 H LYS 52 H LYS 52 7.092 -8.293 -2.936
426 HA LYS 52 HA LYS 52 9.214 -6.594 -2.632
427 HB2 LYS 52 HB2 LYS 52 8.613 -8.524 -4.875
428 HB3 LYS 52 HB3 LYS 52 10.201 -7.843 -4.530
429 HG2 LYS 52 HG2 LYS 52 10.268 -8.909 -2.398
430 HG3 LYS 52 HG3 LYS 52 8.598 -9.437 -2.548
431 HD2 LYS 52 HD2 LYS 52 9.202 -10.918 -4.365
432 HD3 LYS 52 HD3 LYS 52 10.870 -10.330 -4.319
433 HE2 LYS 52 HE2 LYS 52 11.188 -11.226 -2.118
434 HE3 LYS 52 HE3 LYS 52 9.481 -11.643 -1.990
435 HZ1 LYS 52 HZ1 LYS 52 11.024 -13.518 -2.503
436 HZ2 LYS 52 HZ2 LYS 52 11.280 -12.821 -4.031
437 HZ3 LYS 52 HZ3 LYS 52 9.730 -13.340 -3.581
438 HA PRO 53 HA PRO 53 9.342 -2.874 -4.729
439 HB2 PRO 53 HB2 PRO 53 11.328 -4.215 -6.529
440 HB3 PRO 53 HB3 PRO 53 11.377 -2.598 -5.815
441 HG2 PRO 53 HG2 PRO 53 12.723 -4.622 -4.716
442 HG3 PRO 53 HG3 PRO 53 11.926 -3.395 -3.716
443 HD2 PRO 53 HD2 PRO 53 11.212 -6.220 -4.135
444 HD3 PRO 53 HD3 PRO 53 10.758 -5.125 -2.816
445 H ARG 54 H ARG 54 9.629 -5.418 -7.263
446 HA ARG 54 HA ARG 54 8.651 -3.697 -9.281
447 HB2 ARG 54 HB2 ARG 54 8.580 -5.631 -10.727
448 HB3 ARG 54 HB3 ARG 54 10.049 -5.668 -9.763
449 HG2 ARG 54 HG2 ARG 54 9.186 -7.385 -8.367
450 HG3 ARG 54 HG3 ARG 54 7.572 -7.223 -9.065
451 HD2 ARG 54 HD2 ARG 54 8.443 -7.963 -11.231
452 HD3 ARG 54 HD3 ARG 54 10.049 -8.135 -10.522
453 HE ARG 54 HE ARG 54 9.090 -9.888 -9.086
454 HH11 ARG 54 HH11 ARG 54 7.339 -8.988 -11.980
455 HH12 ARG 54 HH12 ARG 54 6.554 -10.526 -12.134
456 HH21 ARG 54 HH21 ARG 54 8.095 -11.917 -9.303
457 HH22 ARG 54 HH22 ARG 54 6.956 -12.190 -10.597
458 H HIS 55 H HIS 55 6.991 -5.518 -6.892
459 HA HIS 55 HA HIS 55 4.521 -5.727 -8.358
460 HB2 HIS 55 HB2 HIS 55 5.119 -6.069 -5.411
461 HB3 HIS 55 HB3 HIS 55 3.533 -6.327 -6.131
462 HD1 HIS 55 HD1 HIS 55 5.687 -8.435 -4.765
463 HD2 HIS 55 HD2 HIS 55 4.490 -8.095 -8.729
464 HE1 HIS 55 HE1 HIS 55 6.201 -10.655 -5.810
465 HE2 HIS 55 HE2 HIS 55 5.419 -10.448 -8.202
466 H ILE 56 H ILE 56 5.921 -3.523 -6.001
467 HA ILE 56 HA ILE 56 3.615 -1.897 -5.665
468 HB ILE 56 HB ILE 56 6.542 -1.192 -5.332
469 HG12 ILE 56 HG12 ILE 56 5.836 -3.020 -3.871
470 HG13 ILE 56 HG13 ILE 56 6.120 -1.558 -2.931
471 HG21 ILE 56 HG21 ILE 56 4.092 0.265 -4.352
472 HG22 ILE 56 HG22 ILE 56 5.205 0.817 -5.604
473 HG23 ILE 56 HG23 ILE 56 5.757 0.665 -3.936
474 HD11 ILE 56 HD11 ILE 56 4.134 -2.751 -2.181
475 HD12 ILE 56 HD12 ILE 56 3.427 -2.593 -3.790
476 HD13 ILE 56 HD13 ILE 56 3.724 -1.156 -2.811
477 H ASP 57 H ASP 57 6.387 -1.805 -7.831
478 HA ASP 57 HA ASP 57 5.792 0.556 -9.221
479 HB2 ASP 57 HB2 ASP 57 7.937 -0.473 -9.513
480 HB3 ASP 57 HB3 ASP 57 7.211 -1.982 -10.044
481 H ASP 58 H ASP 58 4.668 -2.736 -9.582
482 HA ASP 58 HA ASP 58 3.365 -2.304 -12.093
483 HB2 ASP 58 HB2 ASP 58 4.268 -4.513 -11.214
484 HB3 ASP 58 HB3 ASP 58 2.849 -4.578 -10.174
485 H VAL 59 H VAL 59 2.268 -2.422 -8.721
486 HA VAL 59 HA VAL 59 -0.494 -2.260 -9.414
487 HB VAL 59 HB VAL 59 -0.931 -1.835 -7.052
488 HG11 VAL 59 HG11 VAL 59 -0.615 -4.121 -7.777
489 HG12 VAL 59 HG12 VAL 59 0.022 -3.905 -6.147
490 HG13 VAL 59 HG13 VAL 59 1.125 -3.985 -7.521
491 HG21 VAL 59 HG21 VAL 59 2.066 -1.721 -6.725
492 HG22 VAL 59 HG22 VAL 59 0.882 -1.727 -5.418
493 HG23 VAL 59 HG23 VAL 59 0.950 -0.368 -6.540
494 H LEU 60 H LEU 60 2.021 0.087 -8.918
495 HA LEU 60 HA LEU 60 0.373 2.337 -8.477
496 HB2 LEU 60 HB2 LEU 60 3.187 2.069 -9.502
497 HB3 LEU 60 HB3 LEU 60 2.408 3.625 -9.307
498 HG LEU 60 HG LEU 60 2.937 1.633 -7.101
499 HD11 LEU 60 HD11 LEU 60 4.182 4.319 -7.671
500 HD12 LEU 60 HD12 LEU 60 4.956 2.752 -7.910
501 HD13 LEU 60 HD13 LEU 60 4.526 3.284 -6.284
502 HD21 LEU 60 HD21 LEU 60 2.158 3.423 -5.608
503 HD22 LEU 60 HD22 LEU 60 0.885 2.862 -6.696
504 HD23 LEU 60 HD23 LEU 60 1.712 4.386 -7.017
505 H LYS 61 H LYS 61 1.572 0.817 -11.435
506 HA LYS 61 HA LYS 61 0.715 2.745 -13.296
507 HB2 LYS 61 HB2 LYS 61 0.398 -0.201 -13.777
508 HB3 LYS 61 HB3 LYS 61 0.826 1.051 -14.923
509 HG2 LYS 61 HG2 LYS 61 2.997 0.864 -14.506
510 HG3 LYS 61 HG3 LYS 61 2.747 0.709 -12.761
511 HD2 LYS 61 HD2 LYS 61 2.907 -1.501 -12.870
512 HD3 LYS 61 HD3 LYS 61 1.676 -1.570 -14.132
513 HE2 LYS 61 HE2 LYS 61 3.717 -2.557 -14.887
514 HE3 LYS 61 HE3 LYS 61 3.374 -1.094 -15.802
515 HZ1 LYS 61 HZ1 LYS 61 4.930 0.077 -14.256
516 HZ2 LYS 61 HZ2 LYS 61 5.664 -1.060 -15.271
517 HZ3 LYS 61 HZ3 LYS 61 5.388 -1.436 -13.642
518 H ALA 62 H ALA 62 -0.841 -0.229 -12.256
519 HA ALA 62 HA ALA 62 -3.332 0.013 -13.344
520 HB1 ALA 62 HB1 ALA 62 -4.156 -1.409 -11.539
521 HB2 ALA 62 HB2 ALA 62 -2.704 -1.063 -10.599
522 HB3 ALA 62 HB3 ALA 62 -2.581 -1.950 -12.118
523 H VAL 63 H VAL 63 -2.397 1.363 -10.147
524 HA VAL 63 HA VAL 63 -5.012 2.355 -9.639
525 HB VAL 63 HB VAL 63 -3.363 1.828 -7.849
526 HG11 VAL 63 HG11 VAL 63 -1.707 3.497 -7.212
527 HG12 VAL 63 HG12 VAL 63 -2.112 4.453 -8.638
528 HG13 VAL 63 HG13 VAL 63 -1.383 2.857 -8.824
529 HG21 VAL 63 HG21 VAL 63 -4.015 3.679 -6.382
530 HG22 VAL 63 HG22 VAL 63 -5.367 3.110 -7.361
531 HG23 VAL 63 HG23 VAL 63 -4.535 4.606 -7.790
532 H MET 64 H MET 64 -2.240 3.743 -11.272
533 HA MET 64 HA MET 64 -3.165 6.443 -11.185
534 HB2 MET 64 HB2 MET 64 -1.238 5.050 -13.048
535 HB3 MET 64 HB3 MET 64 -1.596 6.769 -13.138
536 HG2 MET 64 HG2 MET 64 -0.780 7.034 -10.834
537 HG3 MET 64 HG3 MET 64 -0.363 5.321 -10.808
538 HE1 MET 64 HE1 MET 64 3.187 6.898 -11.008
539 HE2 MET 64 HE2 MET 64 2.146 5.735 -10.186
540 HE3 MET 64 HE3 MET 64 1.805 7.461 -10.069
541 H LYS 65 H LYS 65 -3.827 3.696 -13.240
542 HA LYS 65 HA LYS 65 -5.026 5.309 -15.297
543 HB2 LYS 65 HB2 LYS 65 -3.744 3.286 -15.842
544 HB3 LYS 65 HB3 LYS 65 -4.882 2.311 -14.930
545 HG2 LYS 65 HG2 LYS 65 -5.844 3.971 -17.217
546 HG3 LYS 65 HG3 LYS 65 -5.045 2.424 -17.511
547 HD2 LYS 65 HD2 LYS 65 -7.423 2.791 -15.691
548 HD3 LYS 65 HD3 LYS 65 -7.522 2.287 -17.372
549 HE2 LYS 65 HE2 LYS 65 -5.907 0.822 -15.305
550 HE3 LYS 65 HE3 LYS 65 -7.585 0.435 -15.670
551 HZ1 LYS 65 HZ1 LYS 65 -6.980 -0.108 -17.914
552 HZ2 LYS 65 HZ2 LYS 65 -5.975 -0.974 -16.859
553 HZ3 LYS 65 HZ3 LYS 65 -5.377 0.393 -17.664
554 H ARG 66 H ARG 66 -6.154 2.888 -12.924
555 HA ARG 66 HA ARG 66 -8.892 3.381 -13.738
556 HB2 ARG 66 HB2 ARG 66 -9.501 1.545 -12.311
557 HB3 ARG 66 HB3 ARG 66 -8.110 1.091 -13.279
558 HG2 ARG 66 HG2 ARG 66 -6.654 1.505 -11.331
559 HG3 ARG 66 HG3 ARG 66 -8.090 1.877 -10.370
560 HD2 ARG 66 HD2 ARG 66 -8.968 -0.385 -10.998
561 HD3 ARG 66 HD3 ARG 66 -7.391 -0.733 -11.695
562 HE ARG 66 HE ARG 66 -6.815 0.018 -9.149
563 HH11 ARG 66 HH11 ARG 66 -8.973 -2.346 -10.578
564 HH12 ARG 66 HH12 ARG 66 -8.859 -3.452 -9.238
565 HH21 ARG 66 HH21 ARG 66 -6.684 -1.434 -7.363
566 HH22 ARG 66 HH22 ARG 66 -7.582 -2.927 -7.411
567 H GLY 67 H GLY 67 -6.785 4.676 -11.475
568 HA2 GLY 67 HA2 GLY 67 -9.081 5.856 -10.038
569 HA3 GLY 67 HA3 GLY 67 -7.510 5.581 -9.290
570 H ALA 68 H ALA 68 -5.858 6.980 -9.640
571 HA ALA 68 HA ALA 68 -5.768 8.886 -11.724
572 HB1 ALA 68 HB1 ALA 68 -6.076 10.938 -10.434
573 HB2 ALA 68 HB2 ALA 68 -6.506 9.989 -9.012
574 HB3 ALA 68 HB3 ALA 68 -7.549 9.969 -10.432
575 HA PRO 69 HA PRO 69 -1.523 8.694 -10.465
576 HB2 PRO 69 HB2 PRO 69 -0.696 11.130 -11.456
577 HB3 PRO 69 HB3 PRO 69 -0.872 9.665 -12.426
578 HG2 PRO 69 HG2 PRO 69 -2.749 11.973 -12.118
579 HG3 PRO 69 HG3 PRO 69 -2.324 11.060 -13.577
580 HD2 PRO 69 HD2 PRO 69 -4.631 10.636 -12.269
581 HD3 PRO 69 HD3 PRO 69 -3.743 9.308 -13.044
582 H SER 70 H SER 70 -3.601 11.353 -9.653
583 HA SER 70 HA SER 70 -1.950 12.730 -7.834
584 HB2 SER 70 HB2 SER 70 -4.927 12.591 -7.512
585 HB3 SER 70 HB3 SER 70 -3.850 13.980 -7.357
586 HG SER 70 HG SER 70 -4.122 14.384 -9.402
587 H ILE 71 H ILE 71 -3.928 9.873 -7.553
588 HA ILE 71 HA ILE 71 -3.873 9.775 -4.687
589 HB ILE 71 HB ILE 71 -4.678 7.786 -6.803
590 HG12 ILE 71 HG12 ILE 71 -6.865 7.964 -5.479
591 HG13 ILE 71 HG13 ILE 71 -6.135 9.347 -4.673
592 HG21 ILE 71 HG21 ILE 71 -5.376 6.248 -5.017
593 HG22 ILE 71 HG22 ILE 71 -4.583 7.287 -3.833
594 HG23 ILE 71 HG23 ILE 71 -3.627 6.471 -5.071
595 HD11 ILE 71 HD11 ILE 71 -7.577 10.055 -6.477
596 HD12 ILE 71 HD12 ILE 71 -6.660 9.076 -7.621
597 HD13 ILE 71 HD13 ILE 71 -5.899 10.461 -6.837
598 H ALA 72 H ALA 72 -2.111 8.208 -7.315
599 HA ALA 72 HA ALA 72 -0.777 6.265 -5.863
600 HB1 ALA 72 HB1 ALA 72 0.737 6.107 -7.743
601 HB2 ALA 72 HB2 ALA 72 0.192 7.677 -8.333
602 HB3 ALA 72 HB3 ALA 72 -0.925 6.315 -8.297
603 H ASN 73 H ASN 73 0.204 9.641 -6.423
604 HA ASN 73 HA ASN 73 2.814 9.211 -5.330
605 HB2 ASN 73 HB2 ASN 73 3.136 11.604 -5.465
606 HB3 ASN 73 HB3 ASN 73 2.358 11.045 -6.937
607 HD21 ASN 73 HD21 ASN 73 2.041 12.931 -4.057
608 HD22 ASN 73 HD22 ASN 73 0.535 13.687 -4.471
609 H ASP 74 H ASP 74 -0.286 10.207 -4.032
610 HA ASP 74 HA ASP 74 0.793 10.970 -1.482
611 HB2 ASP 74 HB2 ASP 74 -1.340 11.909 -2.364
612 HB3 ASP 74 HB3 ASP 74 -2.078 10.320 -2.163
613 H THR 75 H THR 75 -0.754 8.090 -2.838
614 HA THR 75 HA THR 75 -0.820 6.667 -0.390
615 HB THR 75 HB THR 75 -1.034 4.617 -1.868
616 HG1 THR 75 HG1 THR 75 -1.380 4.985 -4.064
617 HG21 THR 75 HG21 THR 75 -2.953 6.909 -2.283
618 HG22 THR 75 HG22 THR 75 -2.960 5.778 -0.930
619 HG23 THR 75 HG23 THR 75 -3.315 5.206 -2.561
620 H LEU 76 H LEU 76 1.628 7.080 -2.871
621 HA LEU 76 HA LEU 76 3.513 5.227 -2.055
622 HB2 LEU 76 HB2 LEU 76 3.778 6.782 -3.965
623 HB3 LEU 76 HB3 LEU 76 4.035 8.098 -2.838
624 HG LEU 76 HG LEU 76 6.084 6.988 -2.024
625 HD11 LEU 76 HD11 LEU 76 5.519 5.003 -4.224
626 HD12 LEU 76 HD12 LEU 76 5.491 4.680 -2.490
627 HD13 LEU 76 HD13 LEU 76 7.008 5.099 -3.284
628 HD21 LEU 76 HD21 LEU 76 6.238 8.660 -3.779
629 HD22 LEU 76 HD22 LEU 76 5.972 7.423 -5.006
630 HD23 LEU 76 HD23 LEU 76 7.439 7.392 -4.029
631 H ARG 77 H ARG 77 2.706 8.366 -0.610
632 HA ARG 77 HA ARG 77 4.616 8.348 1.478
633 HB2 ARG 77 HB2 ARG 77 1.837 9.543 1.424
634 HB3 ARG 77 HB3 ARG 77 3.059 9.897 2.632
635 HG2 ARG 77 HG2 ARG 77 4.426 11.010 1.037
636 HG3 ARG 77 HG3 ARG 77 3.410 10.458 -0.301
637 HD2 ARG 77 HD2 ARG 77 1.583 11.803 0.437
638 HD3 ARG 77 HD3 ARG 77 2.405 12.191 1.946
639 HE ARG 77 HE ARG 77 4.113 13.246 0.263
640 HH11 ARG 77 HH11 ARG 77 0.608 13.301 0.068
641 HH12 ARG 77 HH12 ARG 77 0.551 14.872 -0.667
642 HH21 ARG 77 HH21 ARG 77 4.034 15.322 -0.704
643 HH22 ARG 77 HH22 ARG 77 2.497 16.017 -1.114
644 H TRP 78 H TRP 78 1.346 7.109 1.201
645 HA TRP 78 HA TRP 78 0.937 6.233 3.835
646 HB2 TRP 78 HB2 TRP 78 -0.699 6.490 1.852
647 HB3 TRP 78 HB3 TRP 78 -0.173 4.883 1.376
648 HD1 TRP 78 HD1 TRP 78 -1.097 2.831 2.776
649 HE1 TRP 78 HE1 TRP 78 -3.007 2.618 4.490
650 HE3 TRP 78 HE3 TRP 78 -1.826 7.790 3.802
651 HZ2 TRP 78 HZ2 TRP 78 -4.606 4.335 6.079
652 HZ3 TRP 78 HZ3 TRP 78 -3.556 8.421 5.430
653 HH2 TRP 78 HH2 TRP 78 -4.917 6.730 6.545
654 H LEU 79 H LEU 79 2.132 4.545 0.958
655 HA LEU 79 HA LEU 79 2.679 2.055 2.128
656 HB2 LEU 79 HB2 LEU 79 4.011 3.445 -0.195
657 HB3 LEU 79 HB3 LEU 79 4.248 1.758 0.215
658 HG LEU 79 HG LEU 79 1.603 2.977 -0.580
659 HD11 LEU 79 HD11 LEU 79 1.912 1.762 -2.683
660 HD12 LEU 79 HD12 LEU 79 3.525 1.274 -2.161
661 HD13 LEU 79 HD13 LEU 79 3.167 2.978 -2.443
662 HD21 LEU 79 HD21 LEU 79 2.432 0.108 -0.157
663 HD22 LEU 79 HD22 LEU 79 0.864 0.653 -0.754
664 HD23 LEU 79 HD23 LEU 79 1.368 1.049 0.889
665 H LYS 80 H LYS 80 4.786 4.866 1.599
666 HA LYS 80 HA LYS 80 7.172 4.019 2.612
667 HB2 LYS 80 HB2 LYS 80 5.897 6.484 2.062
668 HB3 LYS 80 HB3 LYS 80 6.580 6.623 3.674
669 HG2 LYS 80 HG2 LYS 80 8.172 5.688 1.311
670 HG3 LYS 80 HG3 LYS 80 8.025 7.385 1.757
671 HD2 LYS 80 HD2 LYS 80 10.002 6.683 2.746
672 HD3 LYS 80 HD3 LYS 80 8.846 6.672 4.062
673 HE2 LYS 80 HE2 LYS 80 8.629 4.292 3.922
674 HE3 LYS 80 HE3 LYS 80 9.607 4.239 2.458
675 HZ1 LYS 80 HZ1 LYS 80 10.657 5.234 5.050
676 HZ2 LYS 80 HZ2 LYS 80 11.537 4.798 3.663
677 HZ3 LYS 80 HZ3 LYS 80 10.756 3.609 4.580
678 H ARG 81 H ARG 81 4.697 5.681 4.508
679 HA ARG 81 HA ARG 81 5.689 5.275 7.052
680 HB2 ARG 81 HB2 ARG 81 2.800 5.322 6.170
681 HB3 ARG 81 HB3 ARG 81 3.340 5.492 7.832
682 HG2 ARG 81 HG2 ARG 81 4.405 7.581 7.336
683 HG3 ARG 81 HG3 ARG 81 4.085 7.383 5.611
684 HD2 ARG 81 HD2 ARG 81 1.684 7.461 6.037
685 HD3 ARG 81 HD3 ARG 81 1.987 7.628 7.765
686 HE ARG 81 HE ARG 81 2.972 9.809 7.301
687 HH11 ARG 81 HH11 ARG 81 1.013 8.371 4.766
688 HH12 ARG 81 HH12 ARG 81 0.640 9.890 4.011
689 HH21 ARG 81 HH21 ARG 81 2.487 11.786 6.332
690 HH22 ARG 81 HH22 ARG 81 1.500 11.843 4.906
691 H MET 82 H MET 82 3.527 3.150 5.192
692 HA MET 82 HA MET 82 3.026 1.320 7.272
693 HB2 MET 82 HB2 MET 82 1.576 1.466 5.336
694 HB3 MET 82 HB3 MET 82 2.884 0.950 4.279
695 HG2 MET 82 HG2 MET 82 2.926 -1.225 5.385
696 HG3 MET 82 HG3 MET 82 1.617 -0.711 6.448
697 HE1 MET 82 HE1 MET 82 -1.358 -0.304 3.942
698 HE2 MET 82 HE2 MET 82 -0.247 0.937 4.524
699 HE3 MET 82 HE3 MET 82 -0.872 -0.281 5.637
700 H PHE 83 H PHE 83 5.302 1.116 4.535
701 HA PHE 83 HA PHE 83 6.296 -1.431 5.264
702 HB2 PHE 83 HB2 PHE 83 7.523 0.731 3.543
703 HB3 PHE 83 HB3 PHE 83 8.167 -0.902 3.697
704 HD1 PHE 83 HD2 PHE 83 5.717 -2.513 3.661
705 HD2 PHE 83 HD1 PHE 83 6.809 0.888 1.347
706 HE1 PHE 83 HE2 PHE 83 4.233 -3.272 1.855
707 HE2 PHE 83 HE1 PHE 83 5.325 0.135 -0.465
708 HZ PHE 83 HZ PHE 83 4.034 -1.950 -0.211
709 H ASN 84 H ASN 84 7.334 1.850 6.034
710 HA ASN 84 HA ASN 84 9.756 1.105 7.305
711 HB2 ASN 84 HB2 ASN 84 9.225 3.420 6.538
712 HB3 ASN 84 HB3 ASN 84 8.063 3.553 7.853
713 HD21 ASN 84 HD21 ASN 84 8.783 3.929 9.914
714 HD22 ASN 84 HD22 ASN 84 10.438 4.238 10.300
715 H TYR 85 H TYR 85 6.439 1.462 8.410
716 HA TYR 85 HA TYR 85 6.909 1.092 11.169
717 HB2 TYR 85 HB2 TYR 85 4.779 1.946 10.214
718 HB3 TYR 85 HB3 TYR 85 4.454 0.348 9.557
719 HD1 TYR 85 HD1 TYR 85 4.887 2.226 12.732
720 HD2 TYR 85 HD2 TYR 85 3.421 -1.315 10.876
721 HE1 TYR 85 HE1 TYR 85 3.754 1.602 14.825
722 HE2 TYR 85 HE2 TYR 85 2.288 -1.949 12.962
723 HH TYR 85 HH TYR 85 1.831 0.194 15.531
724 H ALA 86 H ALA 86 6.404 -1.139 8.499
725 HA ALA 86 HA ALA 86 6.275 -3.506 10.051
726 HB1 ALA 86 HB1 ALA 86 7.138 -3.197 7.175
727 HB2 ALA 86 HB2 ALA 86 5.471 -3.360 7.725
728 HB3 ALA 86 HB3 ALA 86 6.608 -4.687 7.959
729 H ILE 87 H ILE 87 8.913 -1.654 8.645
730 HA ILE 87 HA ILE 87 10.981 -3.518 9.113
731 HB ILE 87 HB ILE 87 11.137 -0.499 8.999
732 HG12 ILE 87 HG12 ILE 87 11.673 -2.580 6.867
733 HG13 ILE 87 HG13 ILE 87 10.240 -1.562 6.950
734 HG21 ILE 87 HG21 ILE 87 13.526 -0.844 8.493
735 HG22 ILE 87 HG22 ILE 87 13.325 -2.567 8.810
736 HG23 ILE 87 HG23 ILE 87 13.093 -1.399 10.110
737 HD11 ILE 87 HD11 ILE 87 11.824 -0.726 5.317
738 HD12 ILE 87 HD12 ILE 87 13.066 -0.607 6.562
739 HD13 ILE 87 HD13 ILE 87 11.633 0.417 6.647
740 H LYS 88 H LYS 88 9.514 -1.025 11.125
741 HA LYS 88 HA LYS 88 11.349 -1.036 13.258
742 HB2 LYS 88 HB2 LYS 88 8.363 -0.617 13.399
743 HB3 LYS 88 HB3 LYS 88 9.547 -0.070 14.576
744 HG2 LYS 88 HG2 LYS 88 10.388 1.568 13.126
745 HG3 LYS 88 HG3 LYS 88 9.582 0.857 11.722
746 HD2 LYS 88 HD2 LYS 88 8.422 2.860 12.541
747 HD3 LYS 88 HD3 LYS 88 7.416 1.417 12.654
748 HE2 LYS 88 HE2 LYS 88 7.103 2.527 14.694
749 HE3 LYS 88 HE3 LYS 88 8.226 1.224 15.048
750 HZ1 LYS 88 HZ1 LYS 88 8.969 3.235 16.096
751 HZ2 LYS 88 HZ2 LYS 88 8.948 4.077 14.625
752 HZ3 LYS 88 HZ3 LYS 88 10.060 2.818 14.867
753 H ARG 89 H ARG 89 8.258 -2.733 12.883
754 HA ARG 89 HA ARG 89 8.625 -4.438 15.139
755 HB2 ARG 89 HB2 ARG 89 6.841 -4.744 12.719
756 HB3 ARG 89 HB3 ARG 89 6.793 -5.806 14.116
757 HG2 ARG 89 HG2 ARG 89 6.266 -3.813 15.521
758 HG3 ARG 89 HG3 ARG 89 6.131 -2.875 14.031
759 HD2 ARG 89 HD2 ARG 89 4.359 -4.336 13.243
760 HD3 ARG 89 HD3 ARG 89 4.528 -5.347 14.676
761 HE ARG 89 HE ARG 89 3.719 -2.522 14.880
762 HH11 ARG 89 HH11 ARG 89 3.190 -5.906 15.539
763 HH12 ARG 89 HH12 ARG 89 1.821 -5.643 16.572
764 HH21 ARG 89 HH21 ARG 89 1.913 -2.139 16.215
765 HH22 ARG 89 HH22 ARG 89 1.103 -3.480 16.978
766 H HIS 90 H HIS 90 10.226 -4.363 12.262
767 HA HIS 90 HA HIS 90 11.549 -5.736 11.068
768 HB2 HIS 90 HB2 HIS 90 12.635 -6.011 13.295
769 HB3 HIS 90 HB3 HIS 90 11.637 -7.436 13.571
770 HD1 HIS 90 HD1 HIS 90 13.340 -9.283 13.482
771 HD2 HIS 90 HD2 HIS 90 13.656 -6.669 10.262
772 HE1 HIS 90 HE1 HIS 90 14.972 -10.350 11.892
773 HE2 HIS 90 HE2 HIS 90 14.973 -8.857 9.860
774 H ILE 91 H ILE 91 8.864 -6.070 10.612
775 HA ILE 91 HA ILE 91 8.314 -8.877 10.283
776 HB ILE 91 HB ILE 91 7.107 -6.521 8.807
777 HG12 ILE 91 HG12 ILE 91 6.110 -7.971 11.271
778 HG13 ILE 91 HG13 ILE 91 6.821 -6.362 11.262
779 HG21 ILE 91 HG21 ILE 91 6.144 -9.359 9.147
780 HG22 ILE 91 HG22 ILE 91 6.753 -8.632 7.660
781 HG23 ILE 91 HG23 ILE 91 5.241 -8.061 8.366
782 HD11 ILE 91 HD11 ILE 91 4.967 -5.577 9.856
783 HD12 ILE 91 HD12 ILE 91 4.421 -6.220 11.404
784 HD13 ILE 91 HD13 ILE 91 4.249 -7.185 9.938
785 H ILE 92 H ILE 92 9.178 -6.218 8.118
786 HA ILE 92 HA ILE 92 10.967 -8.031 6.678
787 HB ILE 92 HB ILE 92 10.440 -6.794 4.557
788 HG12 ILE 92 HG12 ILE 92 8.005 -5.861 6.102
789 HG13 ILE 92 HG13 ILE 92 9.351 -4.835 5.623
790 HG21 ILE 92 HG21 ILE 92 8.379 -8.062 4.081
791 HG22 ILE 92 HG22 ILE 92 8.217 -8.403 5.805
792 HG23 ILE 92 HG23 ILE 92 9.603 -9.026 4.908
793 HD11 ILE 92 HD11 ILE 92 7.481 -6.275 3.759
794 HD12 ILE 92 HD12 ILE 92 8.831 -5.251 3.275
795 HD13 ILE 92 HD13 ILE 92 7.458 -4.553 4.135
796 H GLU 93 H GLU 93 12.950 -7.171 6.313
797 HA GLU 93 HA GLU 93 13.426 -4.489 7.356
798 HB2 GLU 93 HB2 GLU 93 15.871 -5.151 7.013
799 HB3 GLU 93 HB3 GLU 93 14.967 -6.019 8.244
800 HG2 GLU 93 HG2 GLU 93 15.164 -7.149 5.489
801 HG3 GLU 93 HG3 GLU 93 16.524 -7.299 6.600
802 H TYR 94 H TYR 94 12.179 -5.124 4.688
803 HA TYR 94 HA TYR 94 14.037 -3.539 3.047
804 HB2 TYR 94 HB2 TYR 94 12.206 -5.773 2.139
805 HB3 TYR 94 HB3 TYR 94 13.108 -4.719 1.057
806 HD1 TYR 94 HD1 TYR 94 15.651 -4.723 1.245
807 HD2 TYR 94 HD2 TYR 94 13.194 -7.714 3.004
808 HE1 TYR 94 HE1 TYR 94 17.588 -6.229 1.366
809 HE2 TYR 94 HE2 TYR 94 15.126 -9.231 3.134
810 HH TYR 94 HH TYR 94 17.313 -9.534 1.965
811 H ASN 95 H ASN 95 13.186 -1.847 1.920
812 HA ASN 95 HA ASN 95 10.335 -1.281 2.318
813 HB2 ASN 95 HB2 ASN 95 11.871 0.376 3.292
814 HB3 ASN 95 HB3 ASN 95 12.636 0.599 1.723
815 HD21 ASN 95 HD21 ASN 95 11.611 1.787 0.169
816 HD22 ASN 95 HD22 ASN 95 10.227 2.766 0.495
817 HA PRO 96 HA PRO 96 10.739 -2.802 -1.969
818 HB2 PRO 96 HB2 PRO 96 8.019 -3.069 -2.330
819 HB3 PRO 96 HB3 PRO 96 9.074 -4.307 -1.641
820 HG2 PRO 96 HG2 PRO 96 7.324 -2.317 -0.256
821 HG3 PRO 96 HG3 PRO 96 7.595 -4.028 0.124
822 HD2 PRO 96 HD2 PRO 96 8.789 -2.097 1.533
823 HD3 PRO 96 HD3 PRO 96 9.640 -3.607 1.142
824 H ALA 97 H ALA 97 8.851 -0.092 -0.833
825 HA ALA 97 HA ALA 97 7.997 0.791 -3.408
826 HB1 ALA 97 HB1 ALA 97 7.310 2.831 -2.268
827 HB2 ALA 97 HB2 ALA 97 8.194 2.334 -0.824
828 HB3 ALA 97 HB3 ALA 97 6.797 1.404 -1.370
829 H ALA 98 H ALA 98 11.000 0.780 -1.945
830 HA ALA 98 HA ALA 98 11.985 3.334 -2.765
831 HB1 ALA 98 HB1 ALA 98 14.166 2.489 -2.105
832 HB2 ALA 98 HB2 ALA 98 13.512 0.854 -1.988
833 HB3 ALA 98 HB3 ALA 98 12.951 2.110 -0.885
834 H ALA 99 H ALA 99 11.217 0.619 -4.552
835 HA ALA 99 HA ALA 99 13.353 0.807 -6.482
836 HB1 ALA 99 HB1 ALA 99 12.196 -1.318 -6.080
837 HB2 ALA 99 HB2 ALA 99 12.081 -0.817 -7.766
838 HB3 ALA 99 HB3 ALA 99 10.699 -0.609 -6.689
839 H PHE 100 H PHE 100 10.002 1.878 -6.223
840 HA PHE 100 HA PHE 100 10.056 3.154 -8.812
841 HB2 PHE 100 HB2 PHE 100 7.961 2.201 -7.800
842 HB3 PHE 100 HB3 PHE 100 8.029 3.466 -6.579
843 HD1 PHE 100 HD1 PHE 100 7.374 2.700 -10.088
844 HD2 PHE 100 HD2 PHE 100 7.473 5.760 -7.131
845 HE1 PHE 100 HE1 PHE 100 6.101 4.182 -11.583
846 HE2 PHE 100 HE2 PHE 100 6.203 7.249 -8.621
847 HZ PHE 100 HZ PHE 100 5.514 6.458 -10.850
848 H ASP 101 H ASP 101 9.815 4.207 -5.434
849 HA ASP 101 HA ASP 101 11.758 6.246 -5.746
850 HB2 ASP 101 HB2 ASP 101 9.798 7.346 -6.862
851 HB3 ASP 101 HB3 ASP 101 8.918 7.223 -5.341
852 HA PRO 102 HA PRO 102 11.707 4.765 -1.517
853 HB2 PRO 102 HB2 PRO 102 13.889 6.269 -0.746
854 HB3 PRO 102 HB3 PRO 102 13.985 4.682 -1.511
855 HG2 PRO 102 HG2 PRO 102 14.281 7.391 -2.729
856 HG3 PRO 102 HG3 PRO 102 15.185 5.903 -3.062
857 HD2 PRO 102 HD2 PRO 102 13.246 6.776 -4.707
858 HD3 PRO 102 HD3 PRO 102 13.527 5.046 -4.425
859 H GLY 103 H GLY 103 11.817 8.121 -2.531
860 HA2 GLY 103 HA2 GLY 103 10.971 10.037 -1.601
861 HA3 GLY 103 HA3 GLY 103 9.880 8.989 -0.702
862 H ASP 104 H ASP 104 10.002 9.218 1.393
863 HA ASP 104 HA ASP 104 10.700 9.818 3.467
864 HB2 ASP 104 HB2 ASP 104 11.866 7.671 3.238
865 HB3 ASP 104 HB3 ASP 104 13.253 8.486 2.524
866 H ALA 105 H ALA 105 10.560 12.062 2.890
867 HA ALA 105 HA ALA 105 13.068 13.397 2.250
868 HB1 ALA 105 HB1 ALA 105 11.704 15.404 1.948
869 HB2 ALA 105 HB2 ALA 105 10.277 14.518 2.486
870 HB3 ALA 105 HB3 ALA 105 11.088 14.058 0.989
871 H GLY 106 H GLY 106 14.268 13.382 4.090
872 HA2 GLY 106 HA2 GLY 106 13.299 14.136 6.656
873 HA3 GLY 106 HA3 GLY 106 14.987 14.076 6.165
874 H GLY 107 H GLY 107 12.164 16.039 6.486
875 HA2 GLY 107 HA2 GLY 107 13.253 18.457 6.954
876 HA3 GLY 107 HA3 GLY 107 13.308 18.347 5.196
877 H LYS 108 H LYS 108 11.114 17.759 7.886
878 HA LYS 108 HA LYS 108 8.960 18.328 8.271
879 HB2 LYS 108 HB2 LYS 108 9.374 19.980 5.817
880 HB3 LYS 108 HB3 LYS 108 7.745 19.730 6.429
881 HG2 LYS 108 HG2 LYS 108 10.047 20.935 7.950
882 HG3 LYS 108 HG3 LYS 108 8.669 21.802 7.268
883 HD2 LYS 108 HD2 LYS 108 7.772 21.540 9.312
884 HD3 LYS 108 HD3 LYS 108 7.422 19.908 8.764
885 HE2 LYS 108 HE2 LYS 108 8.483 19.949 10.982
886 HE3 LYS 108 HE3 LYS 108 9.449 19.087 9.788
887 HZ1 LYS 108 HZ1 LYS 108 10.990 20.803 9.678
888 HZ2 LYS 108 HZ2 LYS 108 10.626 20.716 11.333
889 HZ3 LYS 108 HZ3 LYS 108 9.941 21.937 10.376
890 H LEU 109 H LEU 109 7.867 16.573 8.299
891 HA LEU 109 HA LEU 109 7.072 15.318 5.751
892 HB2 LEU 109 HB2 LEU 109 8.579 13.898 7.047
893 HB3 LEU 109 HB3 LEU 109 7.537 14.033 8.449
894 HG LEU 109 HG LEU 109 5.750 12.856 7.161
895 HD11 LEU 109 HD11 LEU 109 7.968 12.425 5.165
896 HD12 LEU 109 HD12 LEU 109 6.507 13.376 4.908
897 HD13 LEU 109 HD13 LEU 109 6.393 11.632 5.139
898 HD21 LEU 109 HD21 LEU 109 8.355 11.369 7.460
899 HD22 LEU 109 HD22 LEU 109 6.748 10.647 7.387
900 HD23 LEU 109 HD23 LEU 109 7.190 11.678 8.747
901 H GLU 110 H GLU 110 6.018 15.185 9.144
902 HA GLU 110 HA GLU 110 3.452 16.311 8.456
903 HB2 GLU 110 HB2 GLU 110 2.214 14.381 9.470
904 HB3 GLU 110 HB3 GLU 110 2.971 14.030 7.924
905 HG2 GLU 110 HG2 GLU 110 4.870 13.000 9.180
906 HG3 GLU 110 HG3 GLU 110 3.920 13.199 10.653
907 H HIS 111 H HIS 111 2.444 17.247 10.192
908 HA HIS 111 HA HIS 111 3.952 17.136 12.727
909 HB2 HIS 111 HB2 HIS 111 4.398 19.215 11.448
910 HB3 HIS 111 HB3 HIS 111 2.676 19.572 11.458
911 HD1 HIS 111 HD1 HIS 111 2.239 21.388 13.054
912 HD2 HIS 111 HD2 HIS 111 5.179 18.797 14.447
913 HE1 HIS 111 HE1 HIS 111 2.899 22.262 15.322
914 HE2 HIS 111 HE2 HIS 111 4.834 20.811 16.035
915 H HIS 112 H HIS 112 2.517 15.715 13.703
916 HA HIS 112 HA HIS 112 -0.299 16.524 13.840
917 HB2 HIS 112 HB2 HIS 112 0.242 14.193 13.092
918 HB3 HIS 112 HB3 HIS 112 0.938 13.890 14.680
919 HD1 HIS 112 HD1 HIS 112 -2.038 13.266 12.895
920 HD2 HIS 112 HD2 HIS 112 -1.213 14.511 16.778
921 HE1 HIS 112 HE1 HIS 112 -4.128 12.812 14.219
922 HE2 HIS 112 HE2 HIS 112 -3.671 13.773 16.503
923 H HIS 113 H HIS 113 -0.927 17.603 15.548
924 HA HIS 113 HA HIS 113 0.255 16.949 18.174
925 HB2 HIS 113 HB2 HIS 113 0.655 19.301 17.453
926 HB3 HIS 113 HB3 HIS 113 -1.084 19.531 17.310
927 HD1 HIS 113 HD1 HIS 113 -2.323 20.203 19.381
928 HD2 HIS 113 HD2 HIS 113 1.548 18.926 20.186
929 HE1 HIS 113 HE1 HIS 113 -1.953 20.669 21.819
930 HE2 HIS 113 HE2 HIS 113 0.287 19.643 22.328
931 H HIS 114 H HIS 114 -1.310 16.969 19.984
932 HA HIS 114 HA HIS 114 -3.540 15.397 19.514
933 HB2 HIS 114 HB2 HIS 114 -2.475 15.672 21.721
934 HB3 HIS 114 HB3 HIS 114 -3.128 17.303 21.827
935 HD1 HIS 114 HD1 HIS 114 -4.388 13.726 21.540
936 HD2 HIS 114 HD2 HIS 114 -5.594 17.441 22.971
937 HE1 HIS 114 HE1 HIS 114 -6.559 13.321 22.739
938 HE2 HIS 114 HE2 HIS 114 -7.171 15.544 23.745
939 H HIS 115 H HIS 115 -5.164 15.864 18.273
940 HA HIS 115 HA HIS 115 -7.052 16.776 17.464
941 HB2 HIS 115 HB2 HIS 115 -7.384 17.215 20.015
942 HB3 HIS 115 HB3 HIS 115 -7.088 18.897 19.582
943 HD1 HIS 115 HD1 HIS 115 -9.408 19.863 19.795
944 HD2 HIS 115 HD2 HIS 115 -9.313 16.381 17.511
945 HE1 HIS 115 HE1 HIS 115 -11.714 19.627 18.808
946 HE2 HIS 115 HE2 HIS 115 -11.613 17.549 17.379
947 H HIS 116 H HIS 116 -5.508 19.718 18.772
948 HA HIS 116 HA HIS 116 -5.764 20.950 16.131
949 HB2 HIS 116 HB2 HIS 116 -5.197 22.011 18.882
950 HB3 HIS 116 HB3 HIS 116 -4.785 22.971 17.466
951 HD1 HIS 116 HD1 HIS 116 -6.595 24.391 16.539
952 HD2 HIS 116 HD2 HIS 116 -8.077 21.369 18.986
953 HE1 HIS 116 HE1 HIS 116 -9.061 24.836 16.748
954 HE2 HIS 116 HE2 HIS 116 -9.891 23.128 18.401
Start of MODEL 19
1 H1 MET 1 H1 MET 1 -4.424 -10.474 16.602
2 H2 MET 1 H2 MET 1 -5.565 -9.584 15.721
3 H3 MET 1 H3 MET 1 -4.203 -8.811 16.362
4 HA MET 1 HA MET 1 -4.052 -9.206 13.958
5 HB2 MET 1 HB2 MET 1 -2.058 -10.658 15.718
6 HB3 MET 1 HB3 MET 1 -1.788 -10.278 14.024
7 HG2 MET 1 HG2 MET 1 -0.652 -8.655 15.337
8 HG3 MET 1 HG3 MET 1 -2.034 -7.872 14.577
9 HE1 MET 1 HE1 MET 1 -1.694 -5.994 18.003
10 HE2 MET 1 HE2 MET 1 -1.726 -5.828 16.248
11 HE3 MET 1 HE3 MET 1 -0.369 -6.638 17.033
12 H ALA 2 H ALA 2 -3.064 -11.070 12.507
13 HA ALA 2 HA ALA 2 -5.004 -13.203 12.539
14 HB1 ALA 2 HB1 ALA 2 -4.034 -13.870 10.426
15 HB2 ALA 2 HB2 ALA 2 -2.686 -12.760 10.666
16 HB3 ALA 2 HB3 ALA 2 -4.317 -12.130 10.434
17 H GLU 3 H GLU 3 -4.731 -14.847 13.855
18 HA GLU 3 HA GLU 3 -3.852 -16.603 14.975
19 HB2 GLU 3 HB2 GLU 3 -1.551 -16.335 13.033
20 HB3 GLU 3 HB3 GLU 3 -1.797 -17.686 14.129
21 HG2 GLU 3 HG2 GLU 3 -3.930 -18.179 13.001
22 HG3 GLU 3 HG3 GLU 3 -3.602 -16.870 11.865
23 H LYS 4 H LYS 4 -0.809 -14.956 14.202
24 HA LYS 4 HA LYS 4 -0.501 -13.960 16.881
25 HB2 LYS 4 HB2 LYS 4 1.669 -15.264 17.213
26 HB3 LYS 4 HB3 LYS 4 0.171 -16.154 17.439
27 HG2 LYS 4 HG2 LYS 4 0.400 -17.088 15.184
28 HG3 LYS 4 HG3 LYS 4 1.919 -16.216 14.988
29 HD2 LYS 4 HD2 LYS 4 2.908 -17.461 16.814
30 HD3 LYS 4 HD3 LYS 4 1.376 -18.282 17.118
31 HE2 LYS 4 HE2 LYS 4 1.478 -19.268 14.867
32 HE3 LYS 4 HE3 LYS 4 3.031 -18.475 14.604
33 HZ1 LYS 4 HZ1 LYS 4 3.998 -19.768 16.359
34 HZ2 LYS 4 HZ2 LYS 4 3.230 -20.820 15.275
35 HZ3 LYS 4 HZ3 LYS 4 2.494 -20.453 16.755
36 H ASN 5 H ASN 5 1.482 -14.937 14.087
37 HA ASN 5 HA ASN 5 2.155 -12.222 13.470
38 HB2 ASN 5 HB2 ASN 5 4.624 -12.557 13.704
39 HB3 ASN 5 HB3 ASN 5 3.771 -12.514 15.241
40 HD21 ASN 5 HD21 ASN 5 5.454 -13.577 16.265
41 HD22 ASN 5 HD22 ASN 5 5.730 -15.273 16.056
42 H ALA 6 H ALA 6 4.130 -12.423 11.748
43 HA ALA 6 HA ALA 6 4.705 -13.042 9.642
44 HB1 ALA 6 HB1 ALA 6 3.853 -15.787 10.562
45 HB2 ALA 6 HB2 ALA 6 5.462 -15.086 10.742
46 HB3 ALA 6 HB3 ALA 6 4.826 -15.430 9.135
47 H TYR 7 H TYR 7 2.015 -12.117 10.191
48 HA TYR 7 HA TYR 7 0.206 -13.617 8.560
49 HB2 TYR 7 HB2 TYR 7 -1.190 -11.425 8.826
50 HB3 TYR 7 HB3 TYR 7 -0.948 -12.483 10.208
51 HD1 TYR 7 HD1 TYR 7 0.059 -9.281 8.665
52 HD2 TYR 7 HD2 TYR 7 0.282 -11.761 12.116
53 HE1 TYR 7 HE1 TYR 7 0.957 -7.392 9.960
54 HE2 TYR 7 HE2 TYR 7 1.179 -9.881 13.418
55 HH TYR 7 HH TYR 7 1.077 -6.693 12.361
56 H THR 8 H THR 8 -1.085 -12.233 6.866
57 HA THR 8 HA THR 8 0.878 -11.782 4.793
58 HB THR 8 HB THR 8 -1.107 -11.727 3.293
59 HG1 THR 8 HG1 THR 8 -2.979 -12.707 4.867
60 HG21 THR 8 HG21 THR 8 0.036 -13.842 3.773
61 HG22 THR 8 HG22 THR 8 -1.698 -14.092 3.568
62 HG23 THR 8 HG23 THR 8 -0.994 -14.085 5.185
63 H VAL 9 H VAL 9 0.488 -9.985 3.202
64 HA VAL 9 HA VAL 9 0.628 -7.484 4.464
65 HB VAL 9 HB VAL 9 0.453 -6.495 2.188
66 HG11 VAL 9 HG11 VAL 9 2.607 -7.193 3.034
67 HG12 VAL 9 HG12 VAL 9 2.504 -7.536 1.307
68 HG13 VAL 9 HG13 VAL 9 2.319 -8.842 2.479
69 HG21 VAL 9 HG21 VAL 9 0.340 -7.965 0.240
70 HG22 VAL 9 HG22 VAL 9 -1.126 -8.094 1.213
71 HG23 VAL 9 HG23 VAL 9 0.100 -9.356 1.297
72 H ALA 10 H ALA 10 -2.097 -9.259 3.213
73 HA ALA 10 HA ALA 10 -4.000 -7.217 3.071
74 HB1 ALA 10 HB1 ALA 10 -5.672 -8.965 3.382
75 HB2 ALA 10 HB2 ALA 10 -4.420 -10.081 3.927
76 HB3 ALA 10 HB3 ALA 10 -4.415 -9.494 2.264
77 H GLN 11 H GLN 11 -2.974 -9.226 5.789
78 HA GLN 11 HA GLN 11 -4.725 -7.872 7.638
79 HB2 GLN 11 HB2 GLN 11 -2.847 -10.171 7.759
80 HB3 GLN 11 HB3 GLN 11 -3.166 -9.317 9.263
81 HG2 GLN 11 HG2 GLN 11 -4.615 -11.299 8.853
82 HG3 GLN 11 HG3 GLN 11 -5.486 -9.798 9.140
83 HE21 GLN 11 HE21 GLN 11 -4.645 -12.224 6.799
84 HE22 GLN 11 HE22 GLN 11 -5.813 -11.763 5.605
85 H LEU 12 H LEU 12 -1.363 -7.706 6.679
86 HA LEU 12 HA LEU 12 -0.385 -6.128 8.790
87 HB2 LEU 12 HB2 LEU 12 1.096 -7.149 7.148
88 HB3 LEU 12 HB3 LEU 12 0.413 -6.153 5.877
89 HG LEU 12 HG LEU 12 1.266 -4.137 7.129
90 HD11 LEU 12 HD11 LEU 12 3.043 -4.489 8.763
91 HD12 LEU 12 HD12 LEU 12 2.776 -6.231 8.683
92 HD13 LEU 12 HD13 LEU 12 1.515 -5.175 9.318
93 HD21 LEU 12 HD21 LEU 12 3.272 -6.155 6.143
94 HD22 LEU 12 HD22 LEU 12 3.583 -4.434 6.373
95 HD23 LEU 12 HD23 LEU 12 2.407 -4.965 5.169
96 H ALA 13 H ALA 13 -1.992 -5.274 5.764
97 HA ALA 13 HA ALA 13 -1.845 -2.474 6.066
98 HB1 ALA 13 HB1 ALA 13 -3.589 -2.380 4.373
99 HB2 ALA 13 HB2 ALA 13 -3.912 -4.101 4.589
100 HB3 ALA 13 HB3 ALA 13 -2.362 -3.569 3.939
101 H ASP 14 H ASP 14 -4.168 -4.873 7.180
102 HA ASP 14 HA ASP 14 -6.064 -3.021 8.222
103 HB2 ASP 14 HB2 ASP 14 -6.651 -5.364 7.747
104 HB3 ASP 14 HB3 ASP 14 -5.541 -5.900 9.002
105 H GLU 15 H GLU 15 -3.284 -4.716 9.535
106 HA GLU 15 HA GLU 15 -3.427 -3.941 12.203
107 HB2 GLU 15 HB2 GLU 15 -1.821 -5.581 11.369
108 HB3 GLU 15 HB3 GLU 15 -1.011 -4.341 10.424
109 HG2 GLU 15 HG2 GLU 15 0.228 -4.910 12.436
110 HG3 GLU 15 HG3 GLU 15 -0.292 -3.227 12.444
111 H TYR 16 H TYR 16 -1.722 -2.340 9.517
112 HA TYR 16 HA TYR 16 -0.954 -0.060 10.989
113 HB2 TYR 16 HB2 TYR 16 0.063 -0.781 8.830
114 HB3 TYR 16 HB3 TYR 16 -1.405 -0.271 8.004
115 HD1 TYR 16 HD1 TYR 16 1.357 0.987 10.146
116 HD2 TYR 16 HD2 TYR 16 -1.634 1.946 7.279
117 HE1 TYR 16 HE1 TYR 16 2.282 3.257 9.949
118 HE2 TYR 16 HE2 TYR 16 -0.714 4.214 7.071
119 HH TYR 16 HH TYR 16 0.632 5.779 8.352
120 H PHE 17 H PHE 17 -3.828 -0.857 9.153
121 HA PHE 17 HA PHE 17 -5.032 1.647 8.964
122 HB2 PHE 17 HB2 PHE 17 -5.924 -0.221 7.740
123 HB3 PHE 17 HB3 PHE 17 -6.221 -1.121 9.219
124 HD1 PHE 17 HD2 PHE 17 -7.369 1.670 7.122
125 HD2 PHE 17 HD1 PHE 17 -8.195 -0.766 10.510
126 HE1 PHE 17 HE2 PHE 17 -9.674 2.526 7.170
127 HE2 PHE 17 HE1 PHE 17 -10.502 0.085 10.564
128 HZ PHE 17 HZ PHE 17 -11.244 1.734 8.895
129 H GLU 18 H GLU 18 -5.394 -0.808 11.521
130 HA GLU 18 HA GLU 18 -7.336 0.655 12.961
131 HB2 GLU 18 HB2 GLU 18 -5.532 -1.635 13.686
132 HB3 GLU 18 HB3 GLU 18 -6.644 -0.930 14.850
133 HG2 GLU 18 HG2 GLU 18 -7.488 -2.043 12.191
134 HG3 GLU 18 HG3 GLU 18 -7.472 -2.969 13.692
135 H ARG 19 H ARG 19 -3.806 0.539 13.269
136 HA ARG 19 HA ARG 19 -3.838 1.911 15.786
137 HB2 ARG 19 HB2 ARG 19 -1.648 1.200 13.859
138 HB3 ARG 19 HB3 ARG 19 -1.335 2.242 15.239
139 HG2 ARG 19 HG2 ARG 19 -0.731 -0.017 15.787
140 HG3 ARG 19 HG3 ARG 19 -2.142 0.452 16.735
141 HD2 ARG 19 HD2 ARG 19 -2.793 -0.783 14.178
142 HD3 ARG 19 HD3 ARG 19 -1.892 -1.832 15.250
143 HE ARG 19 HE ARG 19 -4.253 -0.495 16.341
144 HH11 ARG 19 HH11 ARG 19 -2.703 -3.440 15.243
145 HH12 ARG 19 HH12 ARG 19 -4.028 -4.463 15.714
146 HH21 ARG 19 HH21 ARG 19 -6.012 -1.856 16.971
147 HH22 ARG 19 HH22 ARG 19 -5.901 -3.570 16.700
148 H MET 20 H MET 20 -3.583 2.873 12.452
149 HA MET 20 HA MET 20 -3.042 5.644 13.197
150 HB2 MET 20 HB2 MET 20 -3.362 4.298 10.517
151 HB3 MET 20 HB3 MET 20 -3.124 6.031 10.703
152 HG2 MET 20 HG2 MET 20 -1.219 3.886 11.618
153 HG3 MET 20 HG3 MET 20 -1.044 4.882 10.173
154 HE1 MET 20 HE1 MET 20 1.229 4.582 12.403
155 HE2 MET 20 HE2 MET 20 1.774 6.256 12.533
156 HE3 MET 20 HE3 MET 20 1.405 5.563 10.951
157 H ILE 21 H ILE 21 -5.705 3.655 12.319
158 HA ILE 21 HA ILE 21 -7.499 6.001 12.177
159 HB ILE 21 HB ILE 21 -7.684 3.410 10.633
160 HG12 ILE 21 HG12 ILE 21 -7.165 6.230 9.667
161 HG13 ILE 21 HG13 ILE 21 -5.932 4.987 9.849
162 HG21 ILE 21 HG21 ILE 21 -9.894 4.215 11.207
163 HG22 ILE 21 HG22 ILE 21 -9.589 4.449 9.485
164 HG23 ILE 21 HG23 ILE 21 -9.491 5.818 10.592
165 HD11 ILE 21 HD11 ILE 21 -7.038 3.636 8.158
166 HD12 ILE 21 HD12 ILE 21 -6.619 5.232 7.536
167 HD13 ILE 21 HD13 ILE 21 -8.286 4.870 7.984
168 H ALA 22 H ALA 22 -7.613 5.608 14.520
169 HA ALA 22 HA ALA 22 -9.723 3.649 15.121
170 HB1 ALA 22 HB1 ALA 22 -8.681 3.084 17.236
171 HB2 ALA 22 HB2 ALA 22 -7.341 4.175 16.889
172 HB3 ALA 22 HB3 ALA 22 -7.585 2.735 15.899
173 H GLY 23 H GLY 23 -8.270 6.758 15.730
174 HA2 GLY 23 HA2 GLY 23 -10.072 7.323 17.950
175 HA3 GLY 23 HA3 GLY 23 -8.789 8.364 17.354
176 H ARG 24 H ARG 24 -9.177 9.618 15.447
177 HA ARG 24 HA ARG 24 -12.030 10.051 14.894
178 HB2 ARG 24 HB2 ARG 24 -11.139 11.718 16.545
179 HB3 ARG 24 HB3 ARG 24 -9.986 12.244 15.332
180 HG2 ARG 24 HG2 ARG 24 -12.917 12.316 14.737
181 HG3 ARG 24 HG3 ARG 24 -12.175 13.585 15.713
182 HD2 ARG 24 HD2 ARG 24 -10.540 13.949 13.878
183 HD3 ARG 24 HD3 ARG 24 -11.434 12.785 12.902
184 HE ARG 24 HE ARG 24 -12.991 14.999 13.934
185 HH11 ARG 24 HH11 ARG 24 -11.084 13.751 11.286
186 HH12 ARG 24 HH12 ARG 24 -11.776 14.817 10.109
187 HH21 ARG 24 HH21 ARG 24 -13.877 16.455 12.393
188 HH22 ARG 24 HH22 ARG 24 -13.338 16.375 10.740
189 H TRP 25 H TRP 25 -11.990 9.138 12.913
190 HA TRP 25 HA TRP 25 -10.230 10.402 10.923
191 HB2 TRP 25 HB2 TRP 25 -10.179 8.309 9.683
192 HB3 TRP 25 HB3 TRP 25 -9.646 8.019 11.326
193 HD1 TRP 25 HD1 TRP 25 -12.011 6.813 8.799
194 HE1 TRP 25 HE1 TRP 25 -13.609 5.062 9.787
195 HE3 TRP 25 HE3 TRP 25 -10.976 7.474 13.753
196 HZ2 TRP 25 HZ2 TRP 25 -14.328 4.075 12.317
197 HZ3 TRP 25 HZ3 TRP 25 -12.163 6.077 15.393
198 HH2 TRP 25 HH2 TRP 25 -13.803 4.414 14.690
199 H LYS 26 H LYS 26 -13.347 8.848 11.477
200 HA LYS 26 HA LYS 26 -15.428 9.202 10.702
201 HB2 LYS 26 HB2 LYS 26 -14.695 11.653 10.975
202 HB3 LYS 26 HB3 LYS 26 -14.487 11.649 9.230
203 HG2 LYS 26 HG2 LYS 26 -16.653 12.552 9.868
204 HG3 LYS 26 HG3 LYS 26 -16.829 11.065 8.933
205 HD2 LYS 26 HD2 LYS 26 -17.189 9.800 10.985
206 HD3 LYS 26 HD3 LYS 26 -16.962 11.262 11.943
207 HE2 LYS 26 HE2 LYS 26 -19.140 10.847 9.900
208 HE3 LYS 26 HE3 LYS 26 -19.336 10.661 11.641
209 HZ1 LYS 26 HZ1 LYS 26 -18.603 13.166 10.222
210 HZ2 LYS 26 HZ2 LYS 26 -18.721 12.997 11.906
211 HZ3 LYS 26 HZ3 LYS 26 -20.102 12.818 10.935
212 H HIS 27 H HIS 27 -16.308 7.983 9.229
213 HA HIS 27 HA HIS 27 -16.776 6.899 7.293
214 HB2 HIS 27 HB2 HIS 27 -15.104 9.061 5.993
215 HB3 HIS 27 HB3 HIS 27 -16.002 7.836 5.108
216 HD1 HIS 27 HD1 HIS 27 -18.472 8.244 4.727
217 HD2 HIS 27 HD2 HIS 27 -16.748 10.979 7.348
218 HE1 HIS 27 HE1 HIS 27 -20.192 10.050 5.058
219 HE2 HIS 27 HE2 HIS 27 -19.207 11.568 6.811
220 HA PRO 28 HA PRO 28 -12.709 4.755 7.812
221 HB2 PRO 28 HB2 PRO 28 -13.798 2.287 8.234
222 HB3 PRO 28 HB3 PRO 28 -13.560 3.472 9.522
223 HG2 PRO 28 HG2 PRO 28 -16.048 2.810 7.992
224 HG3 PRO 28 HG3 PRO 28 -15.849 3.110 9.729
225 HD2 PRO 28 HD2 PRO 28 -16.804 4.984 8.031
226 HD3 PRO 28 HD3 PRO 28 -15.835 5.402 9.457
227 H ASN 29 H ASN 29 -15.574 3.807 5.953
228 HA ASN 29 HA ASN 29 -14.290 1.821 4.397
229 HB2 ASN 29 HB2 ASN 29 -16.293 1.818 3.024
230 HB3 ASN 29 HB3 ASN 29 -16.735 1.887 4.724
231 HD21 ASN 29 HD21 ASN 29 -18.225 2.653 2.334
232 HD22 ASN 29 HD22 ASN 29 -18.653 4.322 2.546
233 H ILE 30 H ILE 30 -14.575 5.273 4.062
234 HA ILE 30 HA ILE 30 -14.026 5.522 1.322
235 HB ILE 30 HB ILE 30 -13.255 7.416 3.548
236 HG12 ILE 30 HG12 ILE 30 -15.642 6.981 3.560
237 HG13 ILE 30 HG13 ILE 30 -15.344 8.599 2.939
238 HG21 ILE 30 HG21 ILE 30 -12.034 7.896 1.505
239 HG22 ILE 30 HG22 ILE 30 -13.247 9.141 1.802
240 HG23 ILE 30 HG23 ILE 30 -13.539 7.898 0.586
241 HD11 ILE 30 HD11 ILE 30 -15.937 6.166 1.275
242 HD12 ILE 30 HD12 ILE 30 -15.683 7.804 0.671
243 HD13 ILE 30 HD13 ILE 30 -17.081 7.443 1.685
244 H VAL 31 H VAL 31 -11.818 5.646 4.113
245 HA VAL 31 HA VAL 31 -9.496 5.699 2.436
246 HB VAL 31 HB VAL 31 -9.493 6.778 4.650
247 HG11 VAL 31 HG11 VAL 31 -9.350 5.460 6.691
248 HG12 VAL 31 HG12 VAL 31 -9.600 3.982 5.761
249 HG13 VAL 31 HG13 VAL 31 -10.883 5.187 5.862
250 HG21 VAL 31 HG21 VAL 31 -7.495 4.538 4.377
251 HG22 VAL 31 HG22 VAL 31 -7.310 5.948 5.418
252 HG23 VAL 31 HG23 VAL 31 -7.369 6.146 3.665
253 H ARG 32 H ARG 32 -11.375 3.242 4.071
254 HA ARG 32 HA ARG 32 -9.458 1.169 3.931
255 HB2 ARG 32 HB2 ARG 32 -11.539 1.151 5.354
256 HB3 ARG 32 HB3 ARG 32 -12.458 0.817 3.890
257 HG2 ARG 32 HG2 ARG 32 -12.043 -1.241 5.062
258 HG3 ARG 32 HG3 ARG 32 -11.118 -1.234 3.558
259 HD2 ARG 32 HD2 ARG 32 -9.217 -0.259 5.029
260 HD3 ARG 32 HD3 ARG 32 -10.155 -0.906 6.374
261 HE ARG 32 HE ARG 32 -9.199 -2.587 4.148
262 HH11 ARG 32 HH11 ARG 32 -9.773 -2.057 7.561
263 HH12 ARG 32 HH12 ARG 32 -9.007 -3.542 8.052
264 HH21 ARG 32 HH21 ARG 32 -8.223 -4.526 4.756
265 HH22 ARG 32 HH22 ARG 32 -8.186 -4.987 6.440
266 H SER 33 H SER 33 -11.679 2.511 1.617
267 HA SER 33 HA SER 33 -11.726 0.443 -0.264
268 HB2 SER 33 HB2 SER 33 -11.829 3.435 -0.698
269 HB3 SER 33 HB3 SER 33 -12.222 2.228 -1.923
270 HG SER 33 HG SER 33 -13.527 2.482 0.597
271 H ARG 34 H ARG 34 -9.336 2.948 0.376
272 HA ARG 34 HA ARG 34 -7.686 2.404 -1.869
273 HB2 ARG 34 HB2 ARG 34 -7.262 3.778 0.761
274 HB3 ARG 34 HB3 ARG 34 -5.873 3.383 -0.237
275 HG2 ARG 34 HG2 ARG 34 -6.432 5.615 -0.717
276 HG3 ARG 34 HG3 ARG 34 -6.977 4.662 -2.095
277 HD2 ARG 34 HD2 ARG 34 -9.254 4.786 -1.359
278 HD3 ARG 34 HD3 ARG 34 -8.771 5.526 0.168
279 HE ARG 34 HE ARG 34 -7.807 7.196 -1.798
280 HH11 ARG 34 HH11 ARG 34 -10.967 6.027 -0.808
281 HH12 ARG 34 HH12 ARG 34 -11.808 7.432 -1.388
282 HH21 ARG 34 HH21 ARG 34 -8.905 9.066 -2.504
283 HH22 ARG 34 HH22 ARG 34 -10.633 9.176 -2.328
284 H ILE 35 H ILE 35 -7.895 1.127 1.388
285 HA ILE 35 HA ILE 35 -5.427 -0.278 1.280
286 HB ILE 35 HB ILE 35 -7.755 -0.525 3.181
287 HG12 ILE 35 HG12 ILE 35 -5.080 0.879 3.386
288 HG13 ILE 35 HG13 ILE 35 -6.647 1.658 3.197
289 HG21 ILE 35 HG21 ILE 35 -4.979 -1.691 3.398
290 HG22 ILE 35 HG22 ILE 35 -6.474 -2.596 3.164
291 HG23 ILE 35 HG23 ILE 35 -6.206 -1.712 4.667
292 HD11 ILE 35 HD11 ILE 35 -5.814 1.764 5.492
293 HD12 ILE 35 HD12 ILE 35 -5.809 0.001 5.560
294 HD13 ILE 35 HD13 ILE 35 -7.331 0.871 5.373
295 H GLU 36 H GLU 36 -8.782 -1.186 0.634
296 HA GLU 36 HA GLU 36 -7.976 -3.962 0.331
297 HB2 GLU 36 HB2 GLU 36 -10.684 -2.657 0.103
298 HB3 GLU 36 HB3 GLU 36 -10.392 -4.381 -0.091
299 HG2 GLU 36 HG2 GLU 36 -9.993 -2.724 2.384
300 HG3 GLU 36 HG3 GLU 36 -11.176 -4.003 2.121
301 H LYS 37 H LYS 37 -8.294 -1.239 -1.701
302 HA LYS 37 HA LYS 37 -8.586 -2.971 -4.054
303 HB2 LYS 37 HB2 LYS 37 -10.166 -1.010 -3.700
304 HB3 LYS 37 HB3 LYS 37 -8.790 0.037 -4.005
305 HG2 LYS 37 HG2 LYS 37 -9.732 -2.042 -5.960
306 HG3 LYS 37 HG3 LYS 37 -10.324 -0.382 -5.951
307 HD2 LYS 37 HD2 LYS 37 -7.424 -0.523 -5.896
308 HD3 LYS 37 HD3 LYS 37 -8.110 -1.336 -7.299
309 HE2 LYS 37 HE2 LYS 37 -7.711 0.923 -7.912
310 HE3 LYS 37 HE3 LYS 37 -9.451 0.728 -7.734
311 HZ1 LYS 37 HZ1 LYS 37 -9.106 1.630 -5.405
312 HZ2 LYS 37 HZ2 LYS 37 -8.946 2.729 -6.681
313 HZ3 LYS 37 HZ3 LYS 37 -7.560 2.110 -5.916
314 H ASP 38 H ASP 38 -6.762 -0.099 -3.001
315 HA ASP 38 HA ASP 38 -4.924 -0.385 -5.199
316 HB2 ASP 38 HB2 ASP 38 -4.807 1.530 -2.861
317 HB3 ASP 38 HB3 ASP 38 -3.949 1.682 -4.393
318 H ILE 39 H ILE 39 -4.854 -0.854 -1.707
319 HA ILE 39 HA ILE 39 -2.082 -1.573 -1.655
320 HB ILE 39 HB ILE 39 -4.194 -2.251 0.400
321 HG12 ILE 39 HG12 ILE 39 -4.192 0.152 0.009
322 HG13 ILE 39 HG13 ILE 39 -3.462 -0.202 1.571
323 HG21 ILE 39 HG21 ILE 39 -2.129 -3.510 0.670
324 HG22 ILE 39 HG22 ILE 39 -2.313 -2.330 1.966
325 HG23 ILE 39 HG23 ILE 39 -1.196 -2.013 0.639
326 HD11 ILE 39 HD11 ILE 39 -1.247 0.099 0.598
327 HD12 ILE 39 HD12 ILE 39 -2.250 1.537 0.405
328 HD13 ILE 39 HD13 ILE 39 -1.985 0.457 -0.964
329 H LYS 40 H LYS 40 -4.944 -3.159 -2.587
330 HA LYS 40 HA LYS 40 -3.557 -5.761 -2.538
331 HB2 LYS 40 HB2 LYS 40 -6.553 -5.470 -2.619
332 HB3 LYS 40 HB3 LYS 40 -5.604 -6.886 -2.196
333 HG2 LYS 40 HG2 LYS 40 -5.774 -4.374 -0.546
334 HG3 LYS 40 HG3 LYS 40 -6.715 -5.839 -0.266
335 HD2 LYS 40 HD2 LYS 40 -4.775 -7.087 0.272
336 HD3 LYS 40 HD3 LYS 40 -3.707 -5.815 -0.325
337 HE2 LYS 40 HE2 LYS 40 -3.799 -5.876 2.127
338 HE3 LYS 40 HE3 LYS 40 -4.388 -4.351 1.480
339 HZ1 LYS 40 HZ1 LYS 40 -5.712 -5.508 3.335
340 HZ2 LYS 40 HZ2 LYS 40 -6.283 -6.527 2.107
341 HZ3 LYS 40 HZ3 LYS 40 -6.561 -4.858 2.025
342 HA PRO 41 HA PRO 41 -4.295 -4.537 -7.004
343 HB2 PRO 41 HB2 PRO 41 -1.912 -5.564 -7.879
344 HB3 PRO 41 HB3 PRO 41 -2.118 -3.896 -7.337
345 HG2 PRO 41 HG2 PRO 41 -1.038 -6.253 -5.842
346 HG3 PRO 41 HG3 PRO 41 -0.443 -4.583 -5.881
347 HD2 PRO 41 HD2 PRO 41 -1.901 -5.520 -3.825
348 HD3 PRO 41 HD3 PRO 41 -2.049 -3.841 -4.387
349 H ALA 42 H ALA 42 -3.072 -7.397 -5.451
350 HA ALA 42 HA ALA 42 -4.859 -9.207 -6.594
351 HB1 ALA 42 HB1 ALA 42 -3.618 -8.813 -8.676
352 HB2 ALA 42 HB2 ALA 42 -3.395 -10.466 -8.101
353 HB3 ALA 42 HB3 ALA 42 -2.119 -9.272 -7.866
354 H ILE 43 H ILE 43 -1.802 -8.501 -5.142
355 HA ILE 43 HA ILE 43 -0.986 -10.951 -4.194
356 HB ILE 43 HB ILE 43 0.084 -9.634 -2.307
357 HG12 ILE 43 HG12 ILE 43 -1.047 -7.280 -3.840
358 HG13 ILE 43 HG13 ILE 43 -1.648 -7.823 -2.278
359 HG21 ILE 43 HG21 ILE 43 1.663 -8.516 -3.824
360 HG22 ILE 43 HG22 ILE 43 0.515 -8.715 -5.149
361 HG23 ILE 43 HG23 ILE 43 1.240 -10.133 -4.388
362 HD11 ILE 43 HD11 ILE 43 1.129 -6.802 -2.844
363 HD12 ILE 43 HD12 ILE 43 0.521 -7.332 -1.274
364 HD13 ILE 43 HD13 ILE 43 -0.168 -5.907 -2.052
365 H GLY 44 H GLY 44 -2.972 -8.582 -2.379
366 HA2 GLY 44 HA2 GLY 44 -4.449 -8.860 -0.646
367 HA3 GLY 44 HA3 GLY 44 -4.878 -10.358 -1.453
368 H SER 45 H SER 45 -4.515 -12.194 -0.393
369 HA SER 45 HA SER 45 -3.158 -12.121 2.146
370 HB2 SER 45 HB2 SER 45 -4.264 -14.543 0.718
371 HB3 SER 45 HB3 SER 45 -3.980 -14.346 2.449
372 HG SER 45 HG SER 45 -5.652 -12.840 2.526
373 H LEU 46 H LEU 46 -1.092 -11.506 1.187
374 HA LEU 46 HA LEU 46 0.456 -13.881 0.397
375 HB2 LEU 46 HB2 LEU 46 0.035 -12.392 -1.561
376 HB3 LEU 46 HB3 LEU 46 0.822 -11.085 -0.700
377 HG LEU 46 HG LEU 46 2.900 -12.541 -0.640
378 HD11 LEU 46 HD11 LEU 46 1.824 -14.673 -1.104
379 HD12 LEU 46 HD12 LEU 46 3.049 -14.304 -2.318
380 HD13 LEU 46 HD13 LEU 46 1.339 -14.093 -2.697
381 HD21 LEU 46 HD21 LEU 46 2.697 -10.649 -2.135
382 HD22 LEU 46 HD22 LEU 46 1.819 -11.634 -3.302
383 HD23 LEU 46 HD23 LEU 46 3.514 -11.982 -2.954
384 H LYS 47 H LYS 47 2.578 -13.944 1.251
385 HA LYS 47 HA LYS 47 2.957 -12.790 3.751
386 HB2 LYS 47 HB2 LYS 47 4.852 -14.104 1.828
387 HB3 LYS 47 HB3 LYS 47 5.413 -13.460 3.367
388 HG2 LYS 47 HG2 LYS 47 3.298 -15.565 2.987
389 HG3 LYS 47 HG3 LYS 47 4.951 -15.828 3.555
390 HD2 LYS 47 HD2 LYS 47 4.541 -14.559 5.539
391 HD3 LYS 47 HD3 LYS 47 2.966 -14.033 4.939
392 HE2 LYS 47 HE2 LYS 47 2.608 -15.764 6.535
393 HE3 LYS 47 HE3 LYS 47 2.250 -16.406 4.939
394 HZ1 LYS 47 HZ1 LYS 47 4.463 -17.434 4.917
395 HZ2 LYS 47 HZ2 LYS 47 3.525 -18.000 6.210
396 HZ3 LYS 47 HZ3 LYS 47 4.751 -16.859 6.486
397 H VAL 48 H VAL 48 4.259 -11.208 4.537
398 HA VAL 48 HA VAL 48 4.291 -8.807 3.018
399 HB VAL 48 HB VAL 48 5.671 -9.351 5.654
400 HG11 VAL 48 HG11 VAL 48 5.431 -6.951 6.025
401 HG12 VAL 48 HG12 VAL 48 4.688 -6.772 4.437
402 HG13 VAL 48 HG13 VAL 48 6.374 -7.273 4.569
403 HG21 VAL 48 HG21 VAL 48 3.616 -8.460 6.694
404 HG22 VAL 48 HG22 VAL 48 3.343 -9.977 5.837
405 HG23 VAL 48 HG23 VAL 48 2.845 -8.450 5.108
406 H GLU 49 H GLU 49 6.579 -11.320 3.587
407 HA GLU 49 HA GLU 49 8.942 -9.819 3.030
408 HB2 GLU 49 HB2 GLU 49 8.889 -11.891 4.380
409 HB3 GLU 49 HB3 GLU 49 8.457 -12.803 2.944
410 HG2 GLU 49 HG2 GLU 49 10.593 -12.235 1.930
411 HG3 GLU 49 HG3 GLU 49 11.025 -11.292 3.357
412 H ASP 50 H ASP 50 6.475 -11.111 1.052
413 HA ASP 50 HA ASP 50 8.246 -11.624 -1.214
414 HB2 ASP 50 HB2 ASP 50 6.406 -13.220 -0.579
415 HB3 ASP 50 HB3 ASP 50 5.248 -11.991 -1.076
416 H VAL 51 H VAL 51 6.695 -8.945 -0.012
417 HA VAL 51 HA VAL 51 5.554 -8.000 -2.463
418 HB VAL 51 HB VAL 51 4.559 -7.273 -0.381
419 HG11 VAL 51 HG11 VAL 51 7.129 -5.799 0.156
420 HG12 VAL 51 HG12 VAL 51 6.511 -7.187 1.053
421 HG13 VAL 51 HG13 VAL 51 5.639 -5.655 1.091
422 HG21 VAL 51 HG21 VAL 51 4.320 -5.851 -2.336
423 HG22 VAL 51 HG22 VAL 51 5.790 -4.982 -1.902
424 HG23 VAL 51 HG23 VAL 51 4.369 -4.886 -0.861
425 H LYS 52 H LYS 52 7.231 -8.179 -3.902
426 HA LYS 52 HA LYS 52 9.609 -6.659 -3.836
427 HB2 LYS 52 HB2 LYS 52 7.988 -7.498 -6.244
428 HB3 LYS 52 HB3 LYS 52 9.685 -7.050 -6.240
429 HG2 LYS 52 HG2 LYS 52 8.611 -9.407 -4.718
430 HG3 LYS 52 HG3 LYS 52 9.186 -9.508 -6.383
431 HD2 LYS 52 HD2 LYS 52 11.370 -8.658 -5.659
432 HD3 LYS 52 HD3 LYS 52 10.788 -8.616 -3.993
433 HE2 LYS 52 HE2 LYS 52 10.484 -11.007 -3.993
434 HE3 LYS 52 HE3 LYS 52 10.899 -11.094 -5.704
435 HZ1 LYS 52 HZ1 LYS 52 12.717 -10.287 -3.497
436 HZ2 LYS 52 HZ2 LYS 52 13.119 -10.273 -5.145
437 HZ3 LYS 52 HZ3 LYS 52 12.773 -11.741 -4.373
438 HA PRO 53 HA PRO 53 8.313 -2.471 -4.620
439 HB2 PRO 53 HB2 PRO 53 10.393 -2.498 -6.757
440 HB3 PRO 53 HB3 PRO 53 10.156 -1.354 -5.429
441 HG2 PRO 53 HG2 PRO 53 12.104 -3.154 -5.312
442 HG3 PRO 53 HG3 PRO 53 11.155 -2.759 -3.867
443 HD2 PRO 53 HD2 PRO 53 10.991 -5.153 -5.650
444 HD3 PRO 53 HD3 PRO 53 10.820 -5.047 -3.886
445 H ARG 54 H ARG 54 8.787 -4.672 -7.353
446 HA ARG 54 HA ARG 54 7.398 -3.129 -9.260
447 HB2 ARG 54 HB2 ARG 54 7.228 -5.174 -10.589
448 HB3 ARG 54 HB3 ARG 54 8.850 -4.941 -9.956
449 HG2 ARG 54 HG2 ARG 54 8.698 -6.732 -8.527
450 HG3 ARG 54 HG3 ARG 54 6.936 -6.659 -8.454
451 HD2 ARG 54 HD2 ARG 54 7.883 -8.594 -9.751
452 HD3 ARG 54 HD3 ARG 54 6.717 -7.597 -10.620
453 HE ARG 54 HE ARG 54 9.593 -7.101 -10.973
454 HH11 ARG 54 HH11 ARG 54 6.518 -8.145 -12.279
455 HH12 ARG 54 HH12 ARG 54 7.041 -8.078 -13.931
456 HH21 ARG 54 HH21 ARG 54 10.313 -7.044 -13.153
457 HH22 ARG 54 HH22 ARG 54 9.207 -7.475 -14.431
458 H HIS 55 H HIS 55 6.207 -5.056 -6.637
459 HA HIS 55 HA HIS 55 3.602 -5.526 -7.735
460 HB2 HIS 55 HB2 HIS 55 4.551 -5.450 -4.863
461 HB3 HIS 55 HB3 HIS 55 2.912 -5.873 -5.336
462 HD1 HIS 55 HD1 HIS 55 3.510 -7.777 -7.680
463 HD2 HIS 55 HD2 HIS 55 5.503 -7.844 -4.029
464 HE1 HIS 55 HE1 HIS 55 4.511 -10.081 -7.480
465 HE2 HIS 55 HE2 HIS 55 5.777 -10.076 -5.310
466 H ILE 56 H ILE 56 5.085 -3.027 -5.792
467 HA ILE 56 HA ILE 56 2.752 -1.445 -5.427
468 HB ILE 56 HB ILE 56 5.681 -0.690 -5.350
469 HG12 ILE 56 HG12 ILE 56 5.079 -2.362 -3.672
470 HG13 ILE 56 HG13 ILE 56 5.414 -0.813 -2.905
471 HG21 ILE 56 HG21 ILE 56 4.313 1.273 -5.750
472 HG22 ILE 56 HG22 ILE 56 4.979 1.302 -4.118
473 HG23 ILE 56 HG23 ILE 56 3.290 0.863 -4.372
474 HD11 ILE 56 HD11 ILE 56 3.486 -1.914 -1.912
475 HD12 ILE 56 HD12 ILE 56 2.681 -1.931 -3.481
476 HD13 ILE 56 HD13 ILE 56 3.029 -0.396 -2.684
477 H ASP 57 H ASP 57 5.428 -1.438 -7.710
478 HA ASP 57 HA ASP 57 4.729 0.804 -9.230
479 HB2 ASP 57 HB2 ASP 57 6.907 -0.164 -9.461
480 HB3 ASP 57 HB3 ASP 57 6.234 -1.725 -9.910
481 H ASP 58 H ASP 58 3.774 -2.568 -9.461
482 HA ASP 58 HA ASP 58 2.460 -2.428 -11.953
483 HB2 ASP 58 HB2 ASP 58 3.149 -4.557 -11.025
484 HB3 ASP 58 HB3 ASP 58 2.095 -4.335 -9.633
485 H VAL 59 H VAL 59 1.129 -2.281 -8.630
486 HA VAL 59 HA VAL 59 -1.537 -1.969 -9.543
487 HB VAL 59 HB VAL 59 -1.071 -2.807 -7.292
488 HG11 VAL 59 HG11 VAL 59 0.851 -1.465 -6.695
489 HG12 VAL 59 HG12 VAL 59 -0.421 -1.269 -5.488
490 HG13 VAL 59 HG13 VAL 59 -0.140 -0.006 -6.686
491 HG21 VAL 59 HG21 VAL 59 -2.665 -0.252 -7.358
492 HG22 VAL 59 HG22 VAL 59 -2.757 -1.471 -6.087
493 HG23 VAL 59 HG23 VAL 59 -3.249 -1.873 -7.731
494 H LEU 60 H LEU 60 0.984 0.342 -8.645
495 HA LEU 60 HA LEU 60 -0.710 2.609 -8.668
496 HB2 LEU 60 HB2 LEU 60 2.272 2.393 -9.067
497 HB3 LEU 60 HB3 LEU 60 1.409 3.910 -8.904
498 HG LEU 60 HG LEU 60 1.646 1.751 -6.811
499 HD11 LEU 60 HD11 LEU 60 2.744 4.551 -6.947
500 HD12 LEU 60 HD12 LEU 60 3.667 3.055 -7.088
501 HD13 LEU 60 HD13 LEU 60 2.873 3.462 -5.567
502 HD21 LEU 60 HD21 LEU 60 0.196 4.394 -6.690
503 HD22 LEU 60 HD22 LEU 60 0.442 3.287 -5.340
504 HD23 LEU 60 HD23 LEU 60 -0.554 2.795 -6.707
505 H LYS 61 H LYS 61 1.372 1.192 -11.206
506 HA LYS 61 HA LYS 61 0.822 3.215 -13.088
507 HB2 LYS 61 HB2 LYS 61 1.649 1.661 -14.795
508 HB3 LYS 61 HB3 LYS 61 2.710 1.733 -13.405
509 HG2 LYS 61 HG2 LYS 61 2.705 -0.501 -13.824
510 HG3 LYS 61 HG3 LYS 61 1.375 -0.398 -12.672
511 HD2 LYS 61 HD2 LYS 61 -0.245 -0.501 -14.418
512 HD3 LYS 61 HD3 LYS 61 0.997 -0.319 -15.659
513 HE2 LYS 61 HE2 LYS 61 1.965 -2.473 -14.976
514 HE3 LYS 61 HE3 LYS 61 0.682 -2.655 -13.780
515 HZ1 LYS 61 HZ1 LYS 61 0.335 -3.847 -15.936
516 HZ2 LYS 61 HZ2 LYS 61 0.141 -2.331 -16.676
517 HZ3 LYS 61 HZ3 LYS 61 -0.932 -2.829 -15.464
518 H ALA 62 H ALA 62 -0.942 0.363 -12.139
519 HA ALA 62 HA ALA 62 -2.845 0.435 -14.258
520 HB1 ALA 62 HB1 ALA 62 -4.136 -1.110 -12.889
521 HB2 ALA 62 HB2 ALA 62 -3.102 -0.769 -11.502
522 HB3 ALA 62 HB3 ALA 62 -2.439 -1.581 -12.921
523 H VAL 63 H VAL 63 -2.834 1.701 -10.922
524 HA VAL 63 HA VAL 63 -5.483 2.752 -11.142
525 HB VAL 63 HB VAL 63 -5.089 3.849 -8.999
526 HG11 VAL 63 HG11 VAL 63 -5.755 1.514 -9.020
527 HG12 VAL 63 HG12 VAL 63 -4.691 1.849 -7.653
528 HG13 VAL 63 HG13 VAL 63 -4.064 1.020 -9.077
529 HG21 VAL 63 HG21 VAL 63 -2.260 2.855 -9.261
530 HG22 VAL 63 HG22 VAL 63 -2.966 3.564 -7.809
531 HG23 VAL 63 HG23 VAL 63 -2.785 4.538 -9.267
532 H MET 64 H MET 64 -2.358 3.935 -12.009
533 HA MET 64 HA MET 64 -2.926 6.697 -12.094
534 HB2 MET 64 HB2 MET 64 -1.038 4.991 -13.715
535 HB3 MET 64 HB3 MET 64 -1.147 6.732 -13.916
536 HG2 MET 64 HG2 MET 64 -0.459 7.076 -11.627
537 HG3 MET 64 HG3 MET 64 -0.448 5.337 -11.342
538 HE1 MET 64 HE1 MET 64 2.038 5.452 -10.399
539 HE2 MET 64 HE2 MET 64 2.024 7.200 -10.637
540 HE3 MET 64 HE3 MET 64 3.366 6.237 -11.254
541 H LYS 65 H LYS 65 -3.657 4.063 -14.280
542 HA LYS 65 HA LYS 65 -4.515 5.824 -16.385
543 HB2 LYS 65 HB2 LYS 65 -3.350 3.694 -16.845
544 HB3 LYS 65 HB3 LYS 65 -4.671 2.813 -16.099
545 HG2 LYS 65 HG2 LYS 65 -5.101 4.590 -18.473
546 HG3 LYS 65 HG3 LYS 65 -4.588 2.910 -18.640
547 HD2 LYS 65 HD2 LYS 65 -7.038 3.766 -17.113
548 HD3 LYS 65 HD3 LYS 65 -7.055 3.306 -18.807
549 HE2 LYS 65 HE2 LYS 65 -5.955 1.519 -16.666
550 HE3 LYS 65 HE3 LYS 65 -7.662 1.512 -17.106
551 HZ1 LYS 65 HZ1 LYS 65 -6.936 1.036 -19.423
552 HZ2 LYS 65 HZ2 LYS 65 -6.580 -0.198 -18.316
553 HZ3 LYS 65 HZ3 LYS 65 -5.354 0.841 -18.849
554 H ARG 66 H ARG 66 -6.021 3.448 -14.192
555 HA ARG 66 HA ARG 66 -8.632 3.914 -15.254
556 HB2 ARG 66 HB2 ARG 66 -9.422 2.379 -13.562
557 HB3 ARG 66 HB3 ARG 66 -7.962 1.745 -14.307
558 HG2 ARG 66 HG2 ARG 66 -6.656 2.479 -12.381
559 HG3 ARG 66 HG3 ARG 66 -8.119 3.128 -11.638
560 HD2 ARG 66 HD2 ARG 66 -7.646 0.975 -10.686
561 HD3 ARG 66 HD3 ARG 66 -9.098 0.860 -11.679
562 HE ARG 66 HE ARG 66 -6.605 0.124 -12.977
563 HH11 ARG 66 HH11 ARG 66 -9.552 -0.909 -11.408
564 HH12 ARG 66 HH12 ARG 66 -9.365 -2.578 -11.859
565 HH21 ARG 66 HH21 ARG 66 -6.374 -2.051 -13.627
566 HH22 ARG 66 HH22 ARG 66 -7.552 -3.229 -13.117
567 H GLY 67 H GLY 67 -6.817 5.273 -12.622
568 HA2 GLY 67 HA2 GLY 67 -9.233 6.766 -11.808
569 HA3 GLY 67 HA3 GLY 67 -7.950 6.316 -10.692
570 H ALA 68 H ALA 68 -5.842 7.263 -11.017
571 HA ALA 68 HA ALA 68 -5.311 9.369 -12.806
572 HB1 ALA 68 HB1 ALA 68 -5.388 11.291 -11.301
573 HB2 ALA 68 HB2 ALA 68 -6.056 10.278 -10.021
574 HB3 ALA 68 HB3 ALA 68 -6.994 10.583 -11.482
575 HA PRO 69 HA PRO 69 -1.257 8.384 -11.210
576 HB2 PRO 69 HB2 PRO 69 0.015 10.709 -11.951
577 HB3 PRO 69 HB3 PRO 69 -0.277 9.347 -13.036
578 HG2 PRO 69 HG2 PRO 69 -1.810 11.895 -12.737
579 HG3 PRO 69 HG3 PRO 69 -1.382 11.009 -14.213
580 HD2 PRO 69 HD2 PRO 69 -3.850 10.881 -13.145
581 HD3 PRO 69 HD3 PRO 69 -3.100 9.481 -13.943
582 H SER 70 H SER 70 -2.886 11.405 -10.531
583 HA SER 70 HA SER 70 -1.327 12.388 -8.441
584 HB2 SER 70 HB2 SER 70 -4.326 12.625 -8.464
585 HB3 SER 70 HB3 SER 70 -3.121 13.839 -8.031
586 HG SER 70 HG SER 70 -2.740 14.251 -10.120
587 H ILE 71 H ILE 71 -3.911 9.991 -8.482
588 HA ILE 71 HA ILE 71 -4.182 9.693 -5.680
589 HB ILE 71 HB ILE 71 -4.751 7.658 -7.851
590 HG12 ILE 71 HG12 ILE 71 -6.604 9.666 -6.542
591 HG13 ILE 71 HG13 ILE 71 -5.951 9.804 -8.172
592 HG21 ILE 71 HG21 ILE 71 -6.284 6.660 -6.221
593 HG22 ILE 71 HG22 ILE 71 -5.771 7.842 -5.016
594 HG23 ILE 71 HG23 ILE 71 -4.621 6.655 -5.632
595 HD11 ILE 71 HD11 ILE 71 -8.246 8.994 -8.183
596 HD12 ILE 71 HD12 ILE 71 -7.771 7.618 -7.189
597 HD13 ILE 71 HD13 ILE 71 -7.138 7.783 -8.827
598 H ALA 72 H ALA 72 -2.174 8.134 -8.110
599 HA ALA 72 HA ALA 72 -1.082 6.126 -6.467
600 HB1 ALA 72 HB1 ALA 72 0.640 5.912 -8.178
601 HB2 ALA 72 HB2 ALA 72 0.132 7.441 -8.895
602 HB3 ALA 72 HB3 ALA 72 -0.959 6.055 -8.906
603 H ASN 73 H ASN 73 0.026 9.404 -7.260
604 HA ASN 73 HA ASN 73 2.424 9.322 -5.799
605 HB2 ASN 73 HB2 ASN 73 2.147 11.075 -7.378
606 HB3 ASN 73 HB3 ASN 73 0.624 11.587 -6.659
607 HD21 ASN 73 HD21 ASN 73 0.634 12.932 -4.908
608 HD22 ASN 73 HD22 ASN 73 2.066 13.687 -4.314
609 H ASP 74 H ASP 74 -0.855 10.251 -4.893
610 HA ASP 74 HA ASP 74 -0.273 11.139 -2.280
611 HB2 ASP 74 HB2 ASP 74 -2.381 11.702 -3.326
612 HB3 ASP 74 HB3 ASP 74 -2.817 10.000 -3.458
613 H THR 75 H THR 75 -1.164 7.982 -3.566
614 HA THR 75 HA THR 75 -1.388 6.725 -1.022
615 HB THR 75 HB THR 75 -0.983 5.411 -3.717
616 HG1 THR 75 HG1 THR 75 -2.811 6.599 -3.953
617 HG21 THR 75 HG21 THR 75 -2.202 3.531 -2.679
618 HG22 THR 75 HG22 THR 75 -2.209 4.401 -1.144
619 HG23 THR 75 HG23 THR 75 -0.682 3.872 -1.851
620 H LEU 76 H LEU 76 1.239 7.216 -3.289
621 HA LEU 76 HA LEU 76 2.978 5.201 -2.587
622 HB2 LEU 76 HB2 LEU 76 3.197 7.810 -3.849
623 HB3 LEU 76 HB3 LEU 76 4.650 7.368 -2.971
624 HG LEU 76 HG LEU 76 3.333 5.758 -5.152
625 HD11 LEU 76 HD11 LEU 76 5.417 6.241 -6.382
626 HD12 LEU 76 HD12 LEU 76 5.910 7.318 -5.075
627 HD13 LEU 76 HD13 LEU 76 4.475 7.692 -6.032
628 HD21 LEU 76 HD21 LEU 76 5.286 4.287 -4.949
629 HD22 LEU 76 HD22 LEU 76 4.321 4.305 -3.473
630 HD23 LEU 76 HD23 LEU 76 5.831 5.214 -3.552
631 H ARG 77 H ARG 77 2.813 8.439 -1.107
632 HA ARG 77 HA ARG 77 4.853 8.035 0.762
633 HB2 ARG 77 HB2 ARG 77 3.759 9.884 2.060
634 HB3 ARG 77 HB3 ARG 77 4.110 10.258 0.380
635 HG2 ARG 77 HG2 ARG 77 1.767 9.825 -0.193
636 HG3 ARG 77 HG3 ARG 77 1.425 9.493 1.506
637 HD2 ARG 77 HD2 ARG 77 1.912 11.729 2.129
638 HD3 ARG 77 HD3 ARG 77 2.605 12.088 0.549
639 HE ARG 77 HE ARG 77 -0.229 11.363 0.676
640 HH11 ARG 77 HH11 ARG 77 2.234 13.807 0.281
641 HH12 ARG 77 HH12 ARG 77 1.168 14.970 -0.445
642 HH21 ARG 77 HH21 ARG 77 -1.655 12.882 -0.304
643 HH22 ARG 77 HH22 ARG 77 -1.045 14.454 -0.744
644 H TRP 78 H TRP 78 1.453 7.181 0.907
645 HA TRP 78 HA TRP 78 1.381 6.499 3.663
646 HB2 TRP 78 HB2 TRP 78 -0.635 6.950 2.296
647 HB3 TRP 78 HB3 TRP 78 -0.321 5.492 1.365
648 HD1 TRP 78 HD1 TRP 78 -0.985 3.166 2.466
649 HE1 TRP 78 HE1 TRP 78 -2.461 2.558 4.486
650 HE3 TRP 78 HE3 TRP 78 -1.289 7.772 4.667
651 HZ2 TRP 78 HZ2 TRP 78 -3.606 3.860 6.716
652 HZ3 TRP 78 HZ3 TRP 78 -2.598 8.006 6.736
653 HH2 TRP 78 HH2 TRP 78 -3.731 6.091 7.740
654 H LEU 79 H LEU 79 2.277 4.826 0.738
655 HA LEU 79 HA LEU 79 2.167 2.183 1.650
656 HB2 LEU 79 HB2 LEU 79 3.901 3.412 -0.484
657 HB3 LEU 79 HB3 LEU 79 3.666 1.689 -0.254
658 HG LEU 79 HG LEU 79 1.446 3.625 -0.893
659 HD11 LEU 79 HD11 LEU 79 2.936 1.744 -2.716
660 HD12 LEU 79 HD12 LEU 79 3.016 3.505 -2.747
661 HD13 LEU 79 HD13 LEU 79 1.507 2.684 -3.146
662 HD21 LEU 79 HD21 LEU 79 1.560 0.614 -0.872
663 HD22 LEU 79 HD22 LEU 79 0.192 1.583 -1.416
664 HD23 LEU 79 HD23 LEU 79 0.694 1.637 0.274
665 H LYS 80 H LYS 80 4.979 4.412 1.539
666 HA LYS 80 HA LYS 80 6.873 2.562 2.502
667 HB2 LYS 80 HB2 LYS 80 6.940 5.493 3.205
668 HB3 LYS 80 HB3 LYS 80 8.295 4.388 3.081
669 HG2 LYS 80 HG2 LYS 80 8.571 5.482 1.134
670 HG3 LYS 80 HG3 LYS 80 7.427 4.260 0.565
671 HD2 LYS 80 HD2 LYS 80 5.660 5.738 0.540
672 HD3 LYS 80 HD3 LYS 80 6.409 6.810 1.723
673 HE2 LYS 80 HE2 LYS 80 6.440 7.892 -0.396
674 HE3 LYS 80 HE3 LYS 80 8.083 7.427 0.026
675 HZ1 LYS 80 HZ1 LYS 80 7.612 6.955 -2.301
676 HZ2 LYS 80 HZ2 LYS 80 6.305 5.976 -1.859
677 HZ3 LYS 80 HZ3 LYS 80 7.879 5.510 -1.452
678 H ARG 81 H ARG 81 5.072 5.055 4.218
679 HA ARG 81 HA ARG 81 5.800 4.505 6.828
680 HB2 ARG 81 HB2 ARG 81 3.008 5.239 5.958
681 HB3 ARG 81 HB3 ARG 81 3.761 5.585 7.507
682 HG2 ARG 81 HG2 ARG 81 5.253 7.153 6.506
683 HG3 ARG 81 HG3 ARG 81 4.716 6.698 4.886
684 HD2 ARG 81 HD2 ARG 81 3.631 8.730 5.466
685 HD3 ARG 81 HD3 ARG 81 2.429 7.453 5.512
686 HE ARG 81 HE ARG 81 3.499 7.761 8.088
687 HH11 ARG 81 HH11 ARG 81 1.510 9.521 5.803
688 HH12 ARG 81 HH12 ARG 81 0.613 10.362 7.028
689 HH21 ARG 81 HH21 ARG 81 2.320 8.876 9.700
690 HH22 ARG 81 HH22 ARG 81 1.072 9.998 9.236
691 H MET 82 H MET 82 3.090 3.105 5.018
692 HA MET 82 HA MET 82 2.063 1.450 7.005
693 HB2 MET 82 HB2 MET 82 0.912 1.863 4.891
694 HB3 MET 82 HB3 MET 82 2.142 0.955 4.024
695 HG2 MET 82 HG2 MET 82 1.491 -1.073 5.231
696 HG3 MET 82 HG3 MET 82 0.248 -0.161 6.082
697 HE1 MET 82 HE1 MET 82 1.373 0.176 2.348
698 HE2 MET 82 HE2 MET 82 0.225 -0.882 1.527
699 HE3 MET 82 HE3 MET 82 1.440 -1.568 2.607
700 H PHE 83 H PHE 83 4.480 0.605 4.511
701 HA PHE 83 HA PHE 83 4.881 -2.035 5.500
702 HB2 PHE 83 HB2 PHE 83 6.542 -0.302 3.668
703 HB3 PHE 83 HB3 PHE 83 6.986 -1.952 4.086
704 HD1 PHE 83 HD1 PHE 83 4.837 -3.613 3.831
705 HD2 PHE 83 HD2 PHE 83 5.565 -0.055 1.623
706 HE1 PHE 83 HE1 PHE 83 3.426 -4.464 2.007
707 HE2 PHE 83 HE2 PHE 83 4.151 -0.897 -0.207
708 HZ PHE 83 HZ PHE 83 3.080 -3.107 -0.016
709 H ASN 84 H ASN 84 6.183 1.057 6.318
710 HA ASN 84 HA ASN 84 8.612 0.342 7.487
711 HB2 ASN 84 HB2 ASN 84 7.885 2.667 7.010
712 HB3 ASN 84 HB3 ASN 84 6.745 2.565 8.348
713 HD21 ASN 84 HD21 ASN 84 7.494 2.696 10.440
714 HD22 ASN 84 HD22 ASN 84 9.112 3.170 10.831
715 H TYR 85 H TYR 85 5.362 -0.063 8.646
716 HA TYR 85 HA TYR 85 5.858 -0.434 11.388
717 HB2 TYR 85 HB2 TYR 85 3.585 -0.257 10.418
718 HB3 TYR 85 HB3 TYR 85 3.802 -1.804 9.617
719 HD1 TYR 85 HD1 TYR 85 3.989 -3.891 11.033
720 HD2 TYR 85 HD2 TYR 85 2.816 -0.133 12.654
721 HE1 TYR 85 HE1 TYR 85 3.021 -5.040 12.978
722 HE2 TYR 85 HE2 TYR 85 1.846 -1.274 14.605
723 HH TYR 85 HH TYR 85 0.884 -3.670 15.059
724 H ALA 86 H ALA 86 6.152 -2.615 8.632
725 HA ALA 86 HA ALA 86 6.758 -4.912 10.245
726 HB1 ALA 86 HB1 ALA 86 7.174 -4.470 7.292
727 HB2 ALA 86 HB2 ALA 86 5.721 -5.132 8.040
728 HB3 ALA 86 HB3 ALA 86 7.243 -6.019 8.133
729 H ILE 87 H ILE 87 8.577 -2.406 8.606
730 HA ILE 87 HA ILE 87 11.133 -3.621 8.951
731 HB ILE 87 HB ILE 87 10.283 -0.805 8.302
732 HG12 ILE 87 HG12 ILE 87 11.644 -1.305 6.229
733 HG13 ILE 87 HG13 ILE 87 11.783 -2.960 6.803
734 HG21 ILE 87 HG21 ILE 87 12.628 -0.170 8.050
735 HG22 ILE 87 HG22 ILE 87 13.126 -1.734 8.697
736 HG23 ILE 87 HG23 ILE 87 12.254 -0.594 9.721
737 HD11 ILE 87 HD11 ILE 87 10.048 -2.719 5.120
738 HD12 ILE 87 HD12 ILE 87 9.213 -1.546 6.139
739 HD13 ILE 87 HD13 ILE 87 9.374 -3.220 6.670
740 H LYS 88 H LYS 88 9.229 -1.283 10.834
741 HA LYS 88 HA LYS 88 11.311 -0.834 12.720
742 HB2 LYS 88 HB2 LYS 88 9.760 0.469 13.972
743 HB3 LYS 88 HB3 LYS 88 9.492 0.796 12.271
744 HG2 LYS 88 HG2 LYS 88 7.557 -0.756 12.330
745 HG3 LYS 88 HG3 LYS 88 7.798 -0.913 14.073
746 HD2 LYS 88 HD2 LYS 88 7.574 1.564 14.255
747 HD3 LYS 88 HD3 LYS 88 7.157 1.606 12.542
748 HE2 LYS 88 HE2 LYS 88 5.263 0.060 13.043
749 HE3 LYS 88 HE3 LYS 88 5.638 0.241 14.757
750 HZ1 LYS 88 HZ1 LYS 88 4.746 2.353 12.871
751 HZ2 LYS 88 HZ2 LYS 88 5.333 2.682 14.429
752 HZ3 LYS 88 HZ3 LYS 88 3.917 1.766 14.235
753 H ARG 89 H ARG 89 8.939 -3.287 12.363
754 HA ARG 89 HA ARG 89 9.406 -4.288 15.073
755 HB2 ARG 89 HB2 ARG 89 7.130 -4.343 13.884
756 HB3 ARG 89 HB3 ARG 89 7.806 -5.623 12.888
757 HG2 ARG 89 HG2 ARG 89 6.496 -6.568 14.674
758 HG3 ARG 89 HG3 ARG 89 8.199 -6.968 14.901
759 HD2 ARG 89 HD2 ARG 89 8.439 -5.302 16.599
760 HD3 ARG 89 HD3 ARG 89 6.829 -4.660 16.270
761 HE ARG 89 HE ARG 89 6.091 -7.014 17.013
762 HH11 ARG 89 HH11 ARG 89 8.814 -5.242 18.341
763 HH12 ARG 89 HH12 ARG 89 8.727 -6.019 19.888
764 HH21 ARG 89 HH21 ARG 89 5.965 -8.026 19.056
765 HH22 ARG 89 HH22 ARG 89 7.106 -7.595 20.304
766 H HIS 90 H HIS 90 10.856 -4.292 12.163
767 HA HIS 90 HA HIS 90 12.500 -5.399 11.118
768 HB2 HIS 90 HB2 HIS 90 13.359 -5.235 13.603
769 HB3 HIS 90 HB3 HIS 90 13.173 -6.988 13.552
770 HD1 HIS 90 HD1 HIS 90 15.230 -8.178 12.788
771 HD2 HIS 90 HD2 HIS 90 14.945 -4.351 11.184
772 HE1 HIS 90 HE1 HIS 90 17.325 -7.855 11.427
773 HE2 HIS 90 HE2 HIS 90 17.065 -5.585 10.354
774 H ILE 91 H ILE 91 9.841 -6.583 11.188
775 HA ILE 91 HA ILE 91 10.153 -9.425 11.087
776 HB ILE 91 HB ILE 91 8.077 -7.703 9.703
777 HG12 ILE 91 HG12 ILE 91 7.941 -9.151 12.362
778 HG13 ILE 91 HG13 ILE 91 8.079 -7.409 12.156
779 HG21 ILE 91 HG21 ILE 91 8.261 -9.929 8.724
780 HG22 ILE 91 HG22 ILE 91 6.745 -9.757 9.606
781 HG23 ILE 91 HG23 ILE 91 8.081 -10.657 10.321
782 HD11 ILE 91 HD11 ILE 91 5.764 -9.109 11.254
783 HD12 ILE 91 HD12 ILE 91 5.897 -7.360 11.072
784 HD13 ILE 91 HD13 ILE 91 5.800 -8.074 12.681
785 H ILE 92 H ILE 92 10.053 -6.823 8.714
786 HA ILE 92 HA ILE 92 11.794 -8.435 6.978
787 HB ILE 92 HB ILE 92 10.818 -7.407 4.998
788 HG12 ILE 92 HG12 ILE 92 8.801 -6.122 6.850
789 HG13 ILE 92 HG13 ILE 92 10.138 -5.275 6.080
790 HG21 ILE 92 HG21 ILE 92 8.718 -8.645 6.767
791 HG22 ILE 92 HG22 ILE 92 9.848 -9.504 5.719
792 HG23 ILE 92 HG23 ILE 92 8.603 -8.469 5.017
793 HD11 ILE 92 HD11 ILE 92 9.197 -5.779 3.888
794 HD12 ILE 92 HD12 ILE 92 8.052 -4.898 4.900
795 HD13 ILE 92 HD13 ILE 92 7.862 -6.635 4.659
796 H GLU 93 H GLU 93 13.344 -7.171 5.793
797 HA GLU 93 HA GLU 93 13.694 -4.439 6.832
798 HB2 GLU 93 HB2 GLU 93 15.366 -6.228 7.603
799 HB3 GLU 93 HB3 GLU 93 15.958 -6.225 5.948
800 HG2 GLU 93 HG2 GLU 93 16.580 -3.914 6.117
801 HG3 GLU 93 HG3 GLU 93 15.837 -3.791 7.710
802 H TYR 94 H TYR 94 12.207 -5.302 4.581
803 HA TYR 94 HA TYR 94 13.721 -4.047 2.388
804 HB2 TYR 94 HB2 TYR 94 11.539 -6.088 1.950
805 HB3 TYR 94 HB3 TYR 94 12.750 -5.526 0.805
806 HD1 TYR 94 HD1 TYR 94 15.053 -6.389 0.908
807 HD2 TYR 94 HD2 TYR 94 12.027 -7.824 3.534
808 HE1 TYR 94 HE1 TYR 94 16.464 -8.322 1.476
809 HE2 TYR 94 HE2 TYR 94 13.430 -9.758 4.106
810 HH TYR 94 HH TYR 94 15.257 -11.015 3.301
811 H ASN 95 H ASN 95 12.814 -2.104 1.975
812 HA ASN 95 HA ASN 95 9.936 -1.790 2.429
813 HB2 ASN 95 HB2 ASN 95 11.736 -0.391 3.728
814 HB3 ASN 95 HB3 ASN 95 11.852 0.517 2.226
815 HD21 ASN 95 HD21 ASN 95 9.037 0.135 1.591
816 HD22 ASN 95 HD22 ASN 95 8.170 1.170 2.650
817 HA PRO 96 HA PRO 96 10.559 -1.935 -2.140
818 HB2 PRO 96 HB2 PRO 96 7.851 -2.284 -2.633
819 HB3 PRO 96 HB3 PRO 96 9.017 -3.592 -2.407
820 HG2 PRO 96 HG2 PRO 96 7.100 -2.395 -0.456
821 HG3 PRO 96 HG3 PRO 96 7.581 -4.089 -0.667
822 HD2 PRO 96 HD2 PRO 96 8.552 -2.597 1.338
823 HD3 PRO 96 HD3 PRO 96 9.558 -3.805 0.512
824 H ALA 97 H ALA 97 7.967 -0.204 -0.454
825 HA ALA 97 HA ALA 97 7.480 1.580 -2.633
826 HB1 ALA 97 HB1 ALA 97 5.910 2.663 -1.136
827 HB2 ALA 97 HB2 ALA 97 6.554 1.745 0.225
828 HB3 ALA 97 HB3 ALA 97 5.716 0.911 -1.084
829 H ALA 98 H ALA 98 9.853 1.511 -0.231
830 HA ALA 98 HA ALA 98 10.117 4.353 0.122
831 HB1 ALA 98 HB1 ALA 98 12.150 3.832 1.339
832 HB2 ALA 98 HB2 ALA 98 12.080 2.162 0.779
833 HB3 ALA 98 HB3 ALA 98 10.836 2.779 1.865
834 H ALA 99 H ALA 99 11.408 1.904 -1.987
835 HA ALA 99 HA ALA 99 13.444 3.602 -3.106
836 HB1 ALA 99 HB1 ALA 99 13.776 1.192 -3.035
837 HB2 ALA 99 HB2 ALA 99 13.785 1.770 -4.702
838 HB3 ALA 99 HB3 ALA 99 12.361 0.954 -4.058
839 H PHE 100 H PHE 100 10.163 2.630 -3.909
840 HA PHE 100 HA PHE 100 10.233 3.868 -6.507
841 HB2 PHE 100 HB2 PHE 100 8.767 1.875 -5.839
842 HB3 PHE 100 HB3 PHE 100 7.740 3.046 -5.022
843 HD1 PHE 100 HD1 PHE 100 9.065 1.993 -8.286
844 HD2 PHE 100 HD2 PHE 100 6.258 4.445 -6.238
845 HE1 PHE 100 HE1 PHE 100 7.922 2.453 -10.414
846 HE2 PHE 100 HE2 PHE 100 5.107 4.910 -8.364
847 HZ PHE 100 HZ PHE 100 5.938 3.911 -10.456
848 H ASP 101 H ASP 101 10.750 5.961 -6.203
849 HA ASP 101 HA ASP 101 10.554 8.165 -5.728
850 HB2 ASP 101 HB2 ASP 101 8.786 7.828 -7.424
851 HB3 ASP 101 HB3 ASP 101 7.617 7.602 -6.127
852 HA PRO 102 HA PRO 102 9.466 7.940 -1.295
853 HB2 PRO 102 HB2 PRO 102 11.617 9.381 -0.480
854 HB3 PRO 102 HB3 PRO 102 11.677 7.635 -0.743
855 HG2 PRO 102 HG2 PRO 102 12.595 9.852 -2.526
856 HG3 PRO 102 HG3 PRO 102 13.372 8.296 -2.179
857 HD2 PRO 102 HD2 PRO 102 11.944 8.771 -4.447
858 HD3 PRO 102 HD3 PRO 102 12.076 7.165 -3.702
859 H GLY 103 H GLY 103 10.091 10.438 -3.593
860 HA2 GLY 103 HA2 GLY 103 9.311 12.587 -3.791
861 HA3 GLY 103 HA3 GLY 103 8.181 12.218 -2.494
862 H ASP 104 H ASP 104 8.590 12.926 -0.470
863 HA ASP 104 HA ASP 104 11.257 13.797 0.264
864 HB2 ASP 104 HB2 ASP 104 10.277 15.844 -0.677
865 HB3 ASP 104 HB3 ASP 104 8.890 15.679 0.396
866 H ALA 105 H ALA 105 11.604 12.778 2.092
867 HA ALA 105 HA ALA 105 9.438 12.667 4.079
868 HB1 ALA 105 HB1 ALA 105 9.602 10.482 3.016
869 HB2 ALA 105 HB2 ALA 105 10.147 10.397 4.692
870 HB3 ALA 105 HB3 ALA 105 11.325 10.419 3.379
871 H GLY 106 H GLY 106 10.125 14.034 5.597
872 HA2 GLY 106 HA2 GLY 106 12.948 14.020 6.387
873 HA3 GLY 106 HA3 GLY 106 11.734 15.196 6.883
874 H GLY 107 H GLY 107 9.914 12.774 7.318
875 HA2 GLY 107 HA2 GLY 107 9.459 11.220 8.973
876 HA3 GLY 107 HA3 GLY 107 11.115 11.391 9.541
877 H LYS 108 H LYS 108 9.064 14.167 9.097
878 HA LYS 108 HA LYS 108 9.363 14.973 11.775
879 HB2 LYS 108 HB2 LYS 108 9.102 16.602 9.970
880 HB3 LYS 108 HB3 LYS 108 7.477 16.001 9.648
881 HG2 LYS 108 HG2 LYS 108 7.549 18.097 10.982
882 HG3 LYS 108 HG3 LYS 108 6.698 16.765 11.772
883 HD2 LYS 108 HD2 LYS 108 8.051 17.666 13.448
884 HD3 LYS 108 HD3 LYS 108 8.931 16.248 12.898
885 HE2 LYS 108 HE2 LYS 108 10.588 17.849 12.999
886 HE3 LYS 108 HE3 LYS 108 10.113 17.898 11.305
887 HZ1 LYS 108 HZ1 LYS 108 10.201 20.117 11.950
888 HZ2 LYS 108 HZ2 LYS 108 9.462 19.826 13.449
889 HZ3 LYS 108 HZ3 LYS 108 8.549 19.755 12.027
890 H LEU 109 H LEU 109 8.487 13.806 13.312
891 HA LEU 109 HA LEU 109 5.563 13.605 13.311
892 HB2 LEU 109 HB2 LEU 109 6.965 11.387 12.989
893 HB3 LEU 109 HB3 LEU 109 7.241 11.549 14.710
894 HG LEU 109 HG LEU 109 4.493 11.405 13.463
895 HD11 LEU 109 HD11 LEU 109 5.717 9.346 13.033
896 HD12 LEU 109 HD12 LEU 109 4.443 9.088 14.226
897 HD13 LEU 109 HD13 LEU 109 6.125 9.218 14.744
898 HD21 LEU 109 HD21 LEU 109 3.766 10.887 15.737
899 HD22 LEU 109 HD22 LEU 109 4.542 12.469 15.657
900 HD23 LEU 109 HD23 LEU 109 5.421 11.090 16.317
901 H GLU 110 H GLU 110 4.869 14.922 14.858
902 HA GLU 110 HA GLU 110 6.399 16.268 16.701
903 HB2 GLU 110 HB2 GLU 110 3.482 15.528 16.741
904 HB3 GLU 110 HB3 GLU 110 4.205 16.512 18.007
905 HG2 GLU 110 HG2 GLU 110 3.120 17.911 16.369
906 HG3 GLU 110 HG3 GLU 110 4.859 18.175 16.337
907 H HIS 111 H HIS 111 6.700 16.079 18.964
908 HA HIS 111 HA HIS 111 7.681 13.504 19.577
909 HB2 HIS 111 HB2 HIS 111 7.397 15.961 21.306
910 HB3 HIS 111 HB3 HIS 111 8.227 14.492 21.814
911 HD1 HIS 111 HD1 HIS 111 9.099 17.658 20.739
912 HD2 HIS 111 HD2 HIS 111 10.204 13.863 19.442
913 HE1 HIS 111 HE1 HIS 111 11.281 17.965 19.516
914 HE2 HIS 111 HE2 HIS 111 12.004 15.633 18.868
915 H HIS 112 H HIS 112 6.077 12.053 19.565
916 HA HIS 112 HA HIS 112 4.038 12.238 21.682
917 HB2 HIS 112 HB2 HIS 112 3.303 11.938 19.265
918 HB3 HIS 112 HB3 HIS 112 4.079 10.361 19.302
919 HD1 HIS 112 HD1 HIS 112 2.655 8.463 20.026
920 HD2 HIS 112 HD2 HIS 112 1.122 12.134 21.258
921 HE1 HIS 112 HE1 HIS 112 0.405 7.959 21.031
922 HE2 HIS 112 HE2 HIS 112 -0.566 10.199 21.645
923 H HIS 113 H HIS 113 6.512 11.728 22.533
924 HA HIS 113 HA HIS 113 7.184 8.940 22.574
925 HB2 HIS 113 HB2 HIS 113 8.980 9.598 24.113
926 HB3 HIS 113 HB3 HIS 113 8.939 10.647 22.703
927 HD1 HIS 113 HD1 HIS 113 9.078 10.745 26.315
928 HD2 HIS 113 HD2 HIS 113 7.625 13.231 23.313
929 HE1 HIS 113 HE1 HIS 113 8.818 13.013 27.373
930 HE2 HIS 113 HE2 HIS 113 7.773 14.454 25.581
931 H HIS 114 H HIS 114 4.566 9.892 23.657
932 HA HIS 114 HA HIS 114 4.535 8.148 25.946
933 HB2 HIS 114 HB2 HIS 114 5.032 10.553 26.774
934 HB3 HIS 114 HB3 HIS 114 3.370 10.909 26.312
935 HD1 HIS 114 HD1 HIS 114 5.324 8.642 28.623
936 HD2 HIS 114 HD2 HIS 114 1.500 10.217 28.193
937 HE1 HIS 114 HE1 HIS 114 4.085 7.995 30.714
938 HE2 HIS 114 HE2 HIS 114 1.737 8.851 30.379
939 H HIS 115 H HIS 115 2.391 7.430 26.400
940 HA HIS 115 HA HIS 115 0.299 6.748 25.858
941 HB2 HIS 115 HB2 HIS 115 0.296 9.146 24.019
942 HB3 HIS 115 HB3 HIS 115 -1.057 8.028 24.138
943 HD1 HIS 115 HD1 HIS 115 -2.441 8.063 26.333
944 HD2 HIS 115 HD2 HIS 115 0.541 10.958 26.129
945 HE1 HIS 115 HE1 HIS 115 -2.943 9.684 28.186
946 HE2 HIS 115 HE2 HIS 115 -1.067 11.363 28.123
947 H HIS 116 H HIS 116 -0.304 5.068 24.661
948 HA HIS 116 HA HIS 116 1.016 4.679 22.056
949 HB2 HIS 116 HB2 HIS 116 1.391 2.286 22.661
950 HB3 HIS 116 HB3 HIS 116 2.324 3.403 23.646
951 HD1 HIS 116 HD1 HIS 116 1.787 3.509 26.161
952 HD2 HIS 116 HD2 HIS 116 -0.624 0.869 24.030
953 HE1 HIS 116 HE1 HIS 116 0.569 2.148 27.888
954 HE2 HIS 116 HE2 HIS 116 -0.946 0.620 26.583
Start of MODEL 20
1 H1 MET 1 H1 MET 1 -0.797 -14.771 18.765
2 H2 MET 1 H2 MET 1 0.731 -14.683 18.046
3 H3 MET 1 H3 MET 1 -0.646 -14.270 17.150
4 HA MET 1 HA MET 1 -1.071 -12.432 18.700
5 HB2 MET 1 HB2 MET 1 0.721 -11.727 20.200
6 HB3 MET 1 HB3 MET 1 0.181 -13.349 20.604
7 HG2 MET 1 HG2 MET 1 2.117 -14.288 19.454
8 HG3 MET 1 HG3 MET 1 2.657 -12.664 19.034
9 HE1 MET 1 HE1 MET 1 5.238 -13.898 21.750
10 HE2 MET 1 HE2 MET 1 5.055 -13.267 20.114
11 HE3 MET 1 HE3 MET 1 4.439 -14.871 20.514
12 H ALA 2 H ALA 2 1.288 -13.621 16.552
13 HA ALA 2 HA ALA 2 2.487 -12.738 14.853
14 HB1 ALA 2 HB1 ALA 2 0.268 -11.956 14.161
15 HB2 ALA 2 HB2 ALA 2 1.549 -10.850 13.665
16 HB3 ALA 2 HB3 ALA 2 0.529 -10.453 15.047
17 H GLU 3 H GLU 3 4.431 -12.454 15.944
18 HA GLU 3 HA GLU 3 5.054 -9.643 16.484
19 HB2 GLU 3 HB2 GLU 3 4.530 -10.731 18.643
20 HB3 GLU 3 HB3 GLU 3 5.812 -11.897 18.347
21 HG2 GLU 3 HG2 GLU 3 7.470 -10.409 18.799
22 HG3 GLU 3 HG3 GLU 3 6.528 -9.022 18.257
23 H LYS 4 H LYS 4 6.260 -12.908 15.840
24 HA LYS 4 HA LYS 4 8.853 -11.800 15.094
25 HB2 LYS 4 HB2 LYS 4 9.517 -14.162 14.697
26 HB3 LYS 4 HB3 LYS 4 8.957 -13.865 16.336
27 HG2 LYS 4 HG2 LYS 4 6.975 -15.028 16.005
28 HG3 LYS 4 HG3 LYS 4 7.098 -14.922 14.247
29 HD2 LYS 4 HD2 LYS 4 9.070 -16.407 14.331
30 HD3 LYS 4 HD3 LYS 4 8.844 -16.565 16.073
31 HE2 LYS 4 HE2 LYS 4 6.793 -17.690 15.812
32 HE3 LYS 4 HE3 LYS 4 6.673 -17.237 14.113
33 HZ1 LYS 4 HZ1 LYS 4 7.315 -19.546 14.375
34 HZ2 LYS 4 HZ2 LYS 4 8.689 -19.093 15.263
35 HZ3 LYS 4 HZ3 LYS 4 8.552 -18.660 13.627
36 H ASN 5 H ASN 5 6.291 -13.761 13.582
37 HA ASN 5 HA ASN 5 6.298 -12.266 11.191
38 HB2 ASN 5 HB2 ASN 5 8.465 -13.529 10.891
39 HB3 ASN 5 HB3 ASN 5 7.524 -15.016 10.883
40 HD21 ASN 5 HD21 ASN 5 9.184 -14.020 8.787
41 HD22 ASN 5 HD22 ASN 5 8.168 -13.773 7.404
42 H ALA 6 H ALA 6 4.134 -12.309 11.487
43 HA ALA 6 HA ALA 6 2.823 -14.687 10.436
44 HB1 ALA 6 HB1 ALA 6 1.051 -14.615 12.126
45 HB2 ALA 6 HB2 ALA 6 1.899 -13.318 12.967
46 HB3 ALA 6 HB3 ALA 6 2.618 -14.926 12.874
47 H TYR 7 H TYR 7 3.609 -12.088 9.486
48 HA TYR 7 HA TYR 7 1.134 -10.540 9.437
49 HB2 TYR 7 HB2 TYR 7 4.010 -9.817 8.921
50 HB3 TYR 7 HB3 TYR 7 2.688 -8.749 8.466
51 HD1 TYR 7 HD1 TYR 7 4.091 -10.559 11.421
52 HD2 TYR 7 HD2 TYR 7 1.872 -7.222 9.993
53 HE1 TYR 7 HE1 TYR 7 4.070 -9.607 13.691
54 HE2 TYR 7 HE2 TYR 7 1.844 -6.263 12.253
55 HH TYR 7 HH TYR 7 3.752 -7.551 14.829
56 H THR 8 H THR 8 -0.067 -11.455 7.832
57 HA THR 8 HA THR 8 0.873 -11.682 5.140
58 HB THR 8 HB THR 8 -1.982 -11.167 5.999
59 HG1 THR 8 HG1 THR 8 -1.904 -12.984 7.064
60 HG21 THR 8 HG21 THR 8 -0.787 -12.746 3.719
61 HG22 THR 8 HG22 THR 8 -1.592 -11.182 3.599
62 HG23 THR 8 HG23 THR 8 -2.509 -12.612 4.074
63 H VAL 9 H VAL 9 0.486 -10.086 3.426
64 HA VAL 9 HA VAL 9 1.011 -7.448 4.225
65 HB VAL 9 HB VAL 9 1.568 -8.311 1.981
66 HG11 VAL 9 HG11 VAL 9 -0.149 -8.353 0.228
67 HG12 VAL 9 HG12 VAL 9 -1.388 -8.072 1.452
68 HG13 VAL 9 HG13 VAL 9 -0.439 -9.559 1.482
69 HG21 VAL 9 HG21 VAL 9 -0.143 -5.828 2.008
70 HG22 VAL 9 HG22 VAL 9 0.968 -6.275 0.715
71 HG23 VAL 9 HG23 VAL 9 1.589 -5.923 2.327
72 H ALA 10 H ALA 10 -2.016 -9.059 3.458
73 HA ALA 10 HA ALA 10 -3.658 -6.744 3.622
74 HB1 ALA 10 HB1 ALA 10 -5.521 -8.299 3.714
75 HB2 ALA 10 HB2 ALA 10 -4.413 -9.634 4.032
76 HB3 ALA 10 HB3 ALA 10 -4.365 -8.800 2.479
77 H GLN 11 H GLN 11 -2.554 -9.148 5.924
78 HA GLN 11 HA GLN 11 -4.184 -8.422 8.105
79 HB2 GLN 11 HB2 GLN 11 -2.799 -10.525 7.874
80 HB3 GLN 11 HB3 GLN 11 -1.380 -9.550 8.225
81 HG2 GLN 11 HG2 GLN 11 -2.082 -10.691 10.211
82 HG3 GLN 11 HG3 GLN 11 -2.353 -8.960 10.405
83 HE21 GLN 11 HE21 GLN 11 -3.852 -12.066 9.950
84 HE22 GLN 11 HE22 GLN 11 -5.455 -11.580 10.396
85 H LEU 12 H LEU 12 -0.976 -7.410 7.051
86 HA LEU 12 HA LEU 12 -0.419 -5.630 9.159
87 HB2 LEU 12 HB2 LEU 12 1.287 -6.478 7.621
88 HB3 LEU 12 HB3 LEU 12 0.536 -5.616 6.294
89 HG LEU 12 HG LEU 12 1.072 -3.470 7.429
90 HD11 LEU 12 HD11 LEU 12 1.161 -4.298 9.722
91 HD12 LEU 12 HD12 LEU 12 2.661 -3.481 9.281
92 HD13 LEU 12 HD13 LEU 12 2.599 -5.242 9.329
93 HD21 LEU 12 HD21 LEU 12 3.418 -5.295 6.921
94 HD22 LEU 12 HD22 LEU 12 3.468 -3.533 6.943
95 HD23 LEU 12 HD23 LEU 12 2.539 -4.373 5.701
96 H ALA 13 H ALA 13 -2.047 -5.216 6.055
97 HA ALA 13 HA ALA 13 -2.307 -2.413 6.149
98 HB1 ALA 13 HB1 ALA 13 -4.096 -4.406 4.765
99 HB2 ALA 13 HB2 ALA 13 -2.611 -3.722 4.101
100 HB3 ALA 13 HB3 ALA 13 -3.996 -2.679 4.422
101 H ASP 14 H ASP 14 -4.320 -5.010 7.426
102 HA ASP 14 HA ASP 14 -6.478 -3.285 8.188
103 HB2 ASP 14 HB2 ASP 14 -6.664 -5.775 7.751
104 HB3 ASP 14 HB3 ASP 14 -5.877 -6.027 9.306
105 H GLU 15 H GLU 15 -3.690 -4.697 9.820
106 HA GLU 15 HA GLU 15 -4.128 -3.679 12.401
107 HB2 GLU 15 HB2 GLU 15 -2.407 -5.342 11.944
108 HB3 GLU 15 HB3 GLU 15 -1.552 -4.217 10.902
109 HG2 GLU 15 HG2 GLU 15 -0.411 -4.391 13.003
110 HG3 GLU 15 HG3 GLU 15 -1.109 -2.782 12.851
111 H TYR 16 H TYR 16 -2.411 -2.340 9.615
112 HA TYR 16 HA TYR 16 -1.591 0.091 10.672
113 HB2 TYR 16 HB2 TYR 16 -0.887 -0.799 8.481
114 HB3 TYR 16 HB3 TYR 16 -2.502 -0.516 7.848
115 HD1 TYR 16 HD2 TYR 16 0.594 1.101 9.008
116 HD2 TYR 16 HD1 TYR 16 -3.187 1.665 7.149
117 HE1 TYR 16 HE2 TYR 16 1.273 3.365 8.325
118 HE2 TYR 16 HE1 TYR 16 -2.520 3.925 6.463
119 HH TYR 16 HH TYR 16 -0.976 5.635 7.047
120 H PHE 17 H PHE 17 -4.682 -0.816 9.210
121 HA PHE 17 HA PHE 17 -5.916 1.687 9.162
122 HB2 PHE 17 HB2 PHE 17 -6.816 -0.347 8.073
123 HB3 PHE 17 HB3 PHE 17 -7.203 -1.011 9.654
124 HD1 PHE 17 HD1 PHE 17 -9.048 -0.099 10.966
125 HD2 PHE 17 HD2 PHE 17 -8.153 1.368 7.073
126 HE1 PHE 17 HE1 PHE 17 -11.263 0.961 10.863
127 HE2 PHE 17 HE2 PHE 17 -10.365 2.440 6.968
128 HZ PHE 17 HZ PHE 17 -11.924 2.238 8.862
129 H GLU 18 H GLU 18 -5.783 -0.746 11.719
130 HA GLU 18 HA GLU 18 -7.502 0.590 13.527
131 HB2 GLU 18 HB2 GLU 18 -7.012 -1.817 13.628
132 HB3 GLU 18 HB3 GLU 18 -5.341 -1.466 14.037
133 HG2 GLU 18 HG2 GLU 18 -6.622 -2.134 15.990
134 HG3 GLU 18 HG3 GLU 18 -6.035 -0.480 16.139
135 H ARG 19 H ARG 19 -4.187 1.079 12.700
136 HA ARG 19 HA ARG 19 -3.621 2.364 15.270
137 HB2 ARG 19 HB2 ARG 19 -1.753 1.606 13.021
138 HB3 ARG 19 HB3 ARG 19 -1.265 2.287 14.568
139 HG2 ARG 19 HG2 ARG 19 -2.542 -0.389 14.074
140 HG3 ARG 19 HG3 ARG 19 -0.906 -0.063 14.658
141 HD2 ARG 19 HD2 ARG 19 -1.824 0.941 16.674
142 HD3 ARG 19 HD3 ARG 19 -3.458 0.646 16.093
143 HE ARG 19 HE ARG 19 -2.162 -1.813 16.090
144 HH11 ARG 19 HH11 ARG 19 -3.105 0.627 18.428
145 HH12 ARG 19 HH12 ARG 19 -3.320 -0.515 19.722
146 HH21 ARG 19 HH21 ARG 19 -2.440 -3.312 17.797
147 HH22 ARG 19 HH22 ARG 19 -2.914 -2.741 19.372
148 H MET 20 H MET 20 -3.682 3.082 11.813
149 HA MET 20 HA MET 20 -2.861 5.840 12.441
150 HB2 MET 20 HB2 MET 20 -2.781 4.401 9.788
151 HB3 MET 20 HB3 MET 20 -2.202 6.034 10.091
152 HG2 MET 20 HG2 MET 20 -1.104 3.515 11.314
153 HG3 MET 20 HG3 MET 20 -0.372 4.440 10.004
154 HE1 MET 20 HE1 MET 20 1.231 3.612 12.565
155 HE2 MET 20 HE2 MET 20 2.067 5.109 12.977
156 HE3 MET 20 HE3 MET 20 1.930 4.611 11.290
157 H ILE 21 H ILE 21 -5.565 4.031 11.447
158 HA ILE 21 HA ILE 21 -6.829 6.399 10.232
159 HB ILE 21 HB ILE 21 -7.569 3.472 10.065
160 HG12 ILE 21 HG12 ILE 21 -7.396 4.013 7.573
161 HG13 ILE 21 HG13 ILE 21 -6.631 5.523 8.056
162 HG21 ILE 21 HG21 ILE 21 -9.464 4.152 8.668
163 HG22 ILE 21 HG22 ILE 21 -9.112 5.843 9.027
164 HG23 ILE 21 HG23 ILE 21 -9.610 4.752 10.321
165 HD11 ILE 21 HD11 ILE 21 -4.853 4.263 9.151
166 HD12 ILE 21 HD12 ILE 21 -4.985 3.855 7.441
167 HD13 ILE 21 HD13 ILE 21 -5.621 2.753 8.664
168 H ALA 22 H ALA 22 -7.526 3.752 12.505
169 HA ALA 22 HA ALA 22 -9.923 4.756 13.523
170 HB1 ALA 22 HB1 ALA 22 -9.549 3.271 15.426
171 HB2 ALA 22 HB2 ALA 22 -7.869 3.056 14.934
172 HB3 ALA 22 HB3 ALA 22 -9.171 2.466 13.901
173 H GLY 23 H GLY 23 -10.211 6.675 14.377
174 HA2 GLY 23 HA2 GLY 23 -9.530 7.735 16.692
175 HA3 GLY 23 HA3 GLY 23 -8.050 8.037 15.787
176 H ARG 24 H ARG 24 -8.145 9.385 13.919
177 HA ARG 24 HA ARG 24 -10.649 10.844 13.480
178 HB2 ARG 24 HB2 ARG 24 -9.138 12.155 15.029
179 HB3 ARG 24 HB3 ARG 24 -7.969 12.237 13.721
180 HG2 ARG 24 HG2 ARG 24 -10.765 13.237 13.347
181 HG3 ARG 24 HG3 ARG 24 -9.537 14.233 14.125
182 HD2 ARG 24 HD2 ARG 24 -8.134 14.086 12.152
183 HD3 ARG 24 HD3 ARG 24 -9.292 13.006 11.382
184 HE ARG 24 HE ARG 24 -10.413 15.543 12.148
185 HH11 ARG 24 HH11 ARG 24 -8.653 13.836 9.657
186 HH12 ARG 24 HH12 ARG 24 -9.170 14.892 8.377
187 HH21 ARG 24 HH21 ARG 24 -11.105 16.933 10.497
188 HH22 ARG 24 HH22 ARG 24 -10.578 16.669 8.857
189 H TRP 25 H TRP 25 -11.012 9.939 11.518
190 HA TRP 25 HA TRP 25 -8.902 10.257 9.495
191 HB2 TRP 25 HB2 TRP 25 -9.532 8.120 8.513
192 HB3 TRP 25 HB3 TRP 25 -9.107 7.893 10.201
193 HD1 TRP 25 HD1 TRP 25 -11.761 7.169 7.755
194 HE1 TRP 25 HE1 TRP 25 -13.836 6.182 8.909
195 HE3 TRP 25 HE3 TRP 25 -10.545 8.152 12.618
196 HZ2 TRP 25 HZ2 TRP 25 -14.830 5.858 11.518
197 HZ3 TRP 25 HZ3 TRP 25 -12.113 7.468 14.384
198 HH2 TRP 25 HH2 TRP 25 -14.210 6.346 13.847
199 H LYS 26 H LYS 26 -12.392 9.873 10.021
200 HA LYS 26 HA LYS 26 -14.223 10.652 8.950
201 HB2 LYS 26 HB2 LYS 26 -12.288 12.525 7.577
202 HB3 LYS 26 HB3 LYS 26 -14.041 12.643 7.488
203 HG2 LYS 26 HG2 LYS 26 -12.387 12.893 9.996
204 HG3 LYS 26 HG3 LYS 26 -13.110 14.225 9.095
205 HD2 LYS 26 HD2 LYS 26 -14.633 11.978 10.413
206 HD3 LYS 26 HD3 LYS 26 -14.443 13.605 11.068
207 HE2 LYS 26 HE2 LYS 26 -15.755 12.929 8.437
208 HE3 LYS 26 HE3 LYS 26 -16.610 13.278 9.938
209 HZ1 LYS 26 HZ1 LYS 26 -15.765 15.499 9.929
210 HZ2 LYS 26 HZ2 LYS 26 -16.439 15.193 8.404
211 HZ3 LYS 26 HZ3 LYS 26 -14.757 15.179 8.603
212 H HIS 27 H HIS 27 -15.371 9.682 7.436
213 HA HIS 27 HA HIS 27 -15.954 8.443 5.633
214 HB2 HIS 27 HB2 HIS 27 -13.672 9.925 4.311
215 HB3 HIS 27 HB3 HIS 27 -14.799 8.880 3.456
216 HD1 HIS 27 HD1 HIS 27 -17.262 9.729 3.218
217 HD2 HIS 27 HD2 HIS 27 -14.620 12.463 4.908
218 HE1 HIS 27 HE1 HIS 27 -18.419 11.957 3.098
219 HE2 HIS 27 HE2 HIS 27 -16.734 13.623 3.958
220 HA PRO 28 HA PRO 28 -12.715 5.353 6.736
221 HB2 PRO 28 HB2 PRO 28 -14.490 3.343 7.254
222 HB3 PRO 28 HB3 PRO 28 -13.983 4.533 8.456
223 HG2 PRO 28 HG2 PRO 28 -16.483 4.430 6.824
224 HG3 PRO 28 HG3 PRO 28 -16.268 4.891 8.522
225 HD2 PRO 28 HD2 PRO 28 -16.576 6.704 6.521
226 HD3 PRO 28 HD3 PRO 28 -15.634 7.034 7.990
227 H ASN 29 H ASN 29 -15.652 4.828 4.806
228 HA ASN 29 HA ASN 29 -14.757 2.547 3.440
229 HB2 ASN 29 HB2 ASN 29 -16.583 3.231 1.750
230 HB3 ASN 29 HB3 ASN 29 -17.068 2.845 3.394
231 HD21 ASN 29 HD21 ASN 29 -18.977 4.022 3.129
232 HD22 ASN 29 HD22 ASN 29 -18.992 5.752 3.137
233 H ILE 30 H ILE 30 -14.535 5.968 2.615
234 HA ILE 30 HA ILE 30 -13.645 5.658 -0.026
235 HB ILE 30 HB ILE 30 -13.019 7.905 1.899
236 HG12 ILE 30 HG12 ILE 30 -15.424 7.575 1.624
237 HG13 ILE 30 HG13 ILE 30 -14.915 9.055 0.819
238 HG21 ILE 30 HG21 ILE 30 -11.505 7.915 -0.002
239 HG22 ILE 30 HG22 ILE 30 -12.642 9.259 -0.112
240 HG23 ILE 30 HG23 ILE 30 -12.873 7.825 -1.112
241 HD11 ILE 30 HD11 ILE 30 -14.945 7.873 -1.330
242 HD12 ILE 30 HD12 ILE 30 -16.517 7.864 -0.535
243 HD13 ILE 30 HD13 ILE 30 -15.508 6.418 -0.509
244 H VAL 31 H VAL 31 -11.774 6.120 2.975
245 HA VAL 31 HA VAL 31 -9.272 5.915 1.635
246 HB VAL 31 HB VAL 31 -9.536 7.145 3.758
247 HG11 VAL 31 HG11 VAL 31 -11.059 5.691 4.937
248 HG12 VAL 31 HG12 VAL 31 -9.586 5.905 5.884
249 HG13 VAL 31 HG13 VAL 31 -9.847 4.411 4.985
250 HG21 VAL 31 HG21 VAL 31 -7.453 6.402 4.784
251 HG22 VAL 31 HG22 VAL 31 -7.331 6.406 3.024
252 HG23 VAL 31 HG23 VAL 31 -7.547 4.885 3.892
253 H ARG 32 H ARG 32 -11.411 3.610 3.197
254 HA ARG 32 HA ARG 32 -9.509 1.492 3.337
255 HB2 ARG 32 HB2 ARG 32 -11.679 1.650 4.659
256 HB3 ARG 32 HB3 ARG 32 -12.507 1.159 3.185
257 HG2 ARG 32 HG2 ARG 32 -12.179 -0.772 4.563
258 HG3 ARG 32 HG3 ARG 32 -11.117 -0.900 3.157
259 HD2 ARG 32 HD2 ARG 32 -9.304 0.109 4.593
260 HD3 ARG 32 HD3 ARG 32 -10.382 -0.115 5.967
261 HE ARG 32 HE ARG 32 -9.331 -2.328 4.305
262 HH11 ARG 32 HH11 ARG 32 -10.560 -1.097 7.342
263 HH12 ARG 32 HH12 ARG 32 -10.050 -2.481 8.261
264 HH21 ARG 32 HH21 ARG 32 -8.674 -4.147 5.486
265 HH22 ARG 32 HH22 ARG 32 -8.960 -4.222 7.207
266 H SER 33 H SER 33 -11.703 2.672 0.894
267 HA SER 33 HA SER 33 -11.731 0.484 -0.844
268 HB2 SER 33 HB2 SER 33 -13.180 2.489 -1.077
269 HB3 SER 33 HB3 SER 33 -11.773 3.429 -1.566
270 HG SER 33 HG SER 33 -11.742 2.443 -3.474
271 H ARG 34 H ARG 34 -9.399 3.090 -0.424
272 HA ARG 34 HA ARG 34 -7.711 2.455 -2.598
273 HB2 ARG 34 HB2 ARG 34 -6.845 3.638 0.048
274 HB3 ARG 34 HB3 ARG 34 -6.060 3.828 -1.513
275 HG2 ARG 34 HG2 ARG 34 -7.929 5.138 -2.325
276 HG3 ARG 34 HG3 ARG 34 -8.781 4.900 -0.799
277 HD2 ARG 34 HD2 ARG 34 -6.796 5.994 0.325
278 HD3 ARG 34 HD3 ARG 34 -6.245 6.439 -1.288
279 HE ARG 34 HE ARG 34 -8.853 7.311 -1.136
280 HH11 ARG 34 HH11 ARG 34 -5.813 8.007 0.481
281 HH12 ARG 34 HH12 ARG 34 -6.347 9.551 1.078
282 HH21 ARG 34 HH21 ARG 34 -9.522 9.370 -0.382
283 HH22 ARG 34 HH22 ARG 34 -8.437 10.327 0.572
284 H ILE 35 H ILE 35 -7.692 1.514 0.805
285 HA ILE 35 HA ILE 35 -5.366 -0.055 0.751
286 HB ILE 35 HB ILE 35 -7.778 -0.346 2.552
287 HG12 ILE 35 HG12 ILE 35 -5.202 1.195 2.960
288 HG13 ILE 35 HG13 ILE 35 -6.765 1.913 2.585
289 HG21 ILE 35 HG21 ILE 35 -6.360 -2.328 2.595
290 HG22 ILE 35 HG22 ILE 35 -6.238 -1.435 4.112
291 HG23 ILE 35 HG23 ILE 35 -4.947 -1.322 2.916
292 HD11 ILE 35 HD11 ILE 35 -7.654 1.044 4.696
293 HD12 ILE 35 HD12 ILE 35 -6.277 2.119 4.939
294 HD13 ILE 35 HD13 ILE 35 -6.068 0.372 5.074
295 H GLU 36 H GLU 36 -8.788 -1.055 0.527
296 HA GLU 36 HA GLU 36 -8.134 -3.814 0.414
297 HB2 GLU 36 HB2 GLU 36 -10.705 -2.380 -0.239
298 HB3 GLU 36 HB3 GLU 36 -10.534 -4.129 -0.161
299 HG2 GLU 36 HG2 GLU 36 -10.248 -2.147 2.074
300 HG3 GLU 36 HG3 GLU 36 -11.445 -3.431 1.903
301 H LYS 37 H LYS 37 -8.669 -1.415 -2.104
302 HA LYS 37 HA LYS 37 -8.875 -3.544 -4.081
303 HB2 LYS 37 HB2 LYS 37 -10.573 -1.897 -4.278
304 HB3 LYS 37 HB3 LYS 37 -9.413 -0.583 -4.193
305 HG2 LYS 37 HG2 LYS 37 -9.038 -2.455 -6.429
306 HG3 LYS 37 HG3 LYS 37 -10.516 -1.489 -6.473
307 HD2 LYS 37 HD2 LYS 37 -7.759 -0.347 -6.058
308 HD3 LYS 37 HD3 LYS 37 -8.565 -0.439 -7.621
309 HE2 LYS 37 HE2 LYS 37 -10.337 0.990 -6.853
310 HE3 LYS 37 HE3 LYS 37 -9.692 0.974 -5.212
311 HZ1 LYS 37 HZ1 LYS 37 -8.213 2.054 -7.547
312 HZ2 LYS 37 HZ2 LYS 37 -7.798 2.196 -5.907
313 HZ3 LYS 37 HZ3 LYS 37 -9.164 3.006 -6.513
314 H ASP 38 H ASP 38 -6.805 -0.750 -3.322
315 HA ASP 38 HA ASP 38 -5.188 -1.251 -5.671
316 HB2 ASP 38 HB2 ASP 38 -4.860 0.776 -3.453
317 HB3 ASP 38 HB3 ASP 38 -3.850 0.691 -4.892
318 H ILE 39 H ILE 39 -4.836 -1.552 -2.159
319 HA ILE 39 HA ILE 39 -2.074 -2.304 -2.341
320 HB ILE 39 HB ILE 39 -3.961 -2.523 0.007
321 HG12 ILE 39 HG12 ILE 39 -1.910 -0.413 -0.707
322 HG13 ILE 39 HG13 ILE 39 -3.657 -0.219 -0.802
323 HG21 ILE 39 HG21 ILE 39 -0.952 -2.707 -0.103
324 HG22 ILE 39 HG22 ILE 39 -2.066 -4.028 0.252
325 HG23 ILE 39 HG23 ILE 39 -1.923 -2.669 1.369
326 HD11 ILE 39 HD11 ILE 39 -2.067 -0.692 1.709
327 HD12 ILE 39 HD12 ILE 39 -3.817 -0.491 1.616
328 HD13 ILE 39 HD13 ILE 39 -2.752 0.846 1.180
329 H LYS 40 H LYS 40 -5.130 -4.059 -2.069
330 HA LYS 40 HA LYS 40 -3.579 -6.550 -2.369
331 HB2 LYS 40 HB2 LYS 40 -6.263 -6.166 -1.037
332 HB3 LYS 40 HB3 LYS 40 -5.579 -7.736 -1.419
333 HG2 LYS 40 HG2 LYS 40 -4.994 -7.537 0.779
334 HG3 LYS 40 HG3 LYS 40 -3.559 -6.869 0.005
335 HD2 LYS 40 HD2 LYS 40 -4.323 -5.513 1.915
336 HD3 LYS 40 HD3 LYS 40 -4.349 -4.616 0.395
337 HE2 LYS 40 HE2 LYS 40 -6.355 -4.164 1.691
338 HE3 LYS 40 HE3 LYS 40 -6.753 -5.013 0.200
339 HZ1 LYS 40 HZ1 LYS 40 -6.597 -6.207 2.920
340 HZ2 LYS 40 HZ2 LYS 40 -6.901 -7.082 1.497
341 HZ3 LYS 40 HZ3 LYS 40 -8.006 -5.908 2.025
342 HA PRO 41 HA PRO 41 -6.152 -6.341 -6.170
343 HB2 PRO 41 HB2 PRO 41 -3.778 -6.775 -7.724
344 HB3 PRO 41 HB3 PRO 41 -4.806 -5.342 -7.682
345 HG2 PRO 41 HG2 PRO 41 -2.215 -5.431 -6.750
346 HG3 PRO 41 HG3 PRO 41 -3.433 -4.256 -6.227
347 HD2 PRO 41 HD2 PRO 41 -2.505 -6.759 -4.876
348 HD3 PRO 41 HD3 PRO 41 -2.927 -5.183 -4.170
349 H ALA 42 H ALA 42 -3.171 -8.294 -6.012
350 HA ALA 42 HA ALA 42 -4.746 -10.744 -6.093
351 HB1 ALA 42 HB1 ALA 42 -2.584 -10.148 -8.114
352 HB2 ALA 42 HB2 ALA 42 -4.315 -10.212 -8.449
353 HB3 ALA 42 HB3 ALA 42 -3.458 -11.671 -7.949
354 H ILE 43 H ILE 43 -3.020 -9.304 -4.206
355 HA ILE 43 HA ILE 43 -1.106 -11.458 -3.634
356 HB ILE 43 HB ILE 43 0.466 -9.660 -2.771
357 HG12 ILE 43 HG12 ILE 43 -1.161 -7.887 -4.600
358 HG13 ILE 43 HG13 ILE 43 -1.266 -7.843 -2.847
359 HG21 ILE 43 HG21 ILE 43 0.938 -10.924 -4.792
360 HG22 ILE 43 HG22 ILE 43 1.451 -9.247 -4.983
361 HG23 ILE 43 HG23 ILE 43 -0.040 -9.806 -5.741
362 HD11 ILE 43 HD11 ILE 43 0.151 -6.061 -3.676
363 HD12 ILE 43 HD12 ILE 43 1.178 -7.234 -4.500
364 HD13 ILE 43 HD13 ILE 43 1.102 -7.212 -2.739
365 H GLY 44 H GLY 44 -3.807 -10.619 -2.619
366 HA2 GLY 44 HA2 GLY 44 -3.469 -9.301 -0.112
367 HA3 GLY 44 HA3 GLY 44 -4.898 -10.174 -0.640
368 H SER 45 H SER 45 -3.164 -12.596 -1.104
369 HA SER 45 HA SER 45 -3.213 -13.542 1.664
370 HB2 SER 45 HB2 SER 45 -2.899 -15.136 -0.894
371 HB3 SER 45 HB3 SER 45 -3.242 -15.773 0.715
372 HG SER 45 HG SER 45 -5.215 -14.559 0.660
373 H LEU 46 H LEU 46 -1.073 -12.041 -0.146
374 HA LEU 46 HA LEU 46 1.213 -13.803 0.128
375 HB2 LEU 46 HB2 LEU 46 0.861 -12.354 -1.867
376 HB3 LEU 46 HB3 LEU 46 1.033 -10.945 -0.841
377 HG LEU 46 HG LEU 46 3.350 -11.726 -0.300
378 HD11 LEU 46 HD11 LEU 46 2.794 -13.651 -2.552
379 HD12 LEU 46 HD12 LEU 46 3.088 -14.072 -0.866
380 HD13 LEU 46 HD13 LEU 46 4.374 -13.347 -1.829
381 HD21 LEU 46 HD21 LEU 46 2.748 -11.172 -3.202
382 HD22 LEU 46 HD22 LEU 46 4.294 -10.919 -2.390
383 HD23 LEU 46 HD23 LEU 46 2.888 -9.958 -1.930
384 H LYS 47 H LYS 47 3.082 -13.261 1.389
385 HA LYS 47 HA LYS 47 2.377 -11.745 3.774
386 HB2 LYS 47 HB2 LYS 47 4.701 -13.579 3.208
387 HB3 LYS 47 HB3 LYS 47 4.548 -12.643 4.686
388 HG2 LYS 47 HG2 LYS 47 3.694 -14.652 5.347
389 HG3 LYS 47 HG3 LYS 47 2.221 -13.820 4.837
390 HD2 LYS 47 HD2 LYS 47 2.244 -16.056 3.961
391 HD3 LYS 47 HD3 LYS 47 2.412 -14.911 2.634
392 HE2 LYS 47 HE2 LYS 47 4.855 -15.268 2.691
393 HE3 LYS 47 HE3 LYS 47 4.626 -16.480 3.947
394 HZ1 LYS 47 HZ1 LYS 47 4.876 -17.452 1.734
395 HZ2 LYS 47 HZ2 LYS 47 3.489 -16.629 1.205
396 HZ3 LYS 47 HZ3 LYS 47 3.364 -17.821 2.406
397 H VAL 48 H VAL 48 4.748 -10.977 4.707
398 HA VAL 48 HA VAL 48 5.056 -8.518 3.221
399 HB VAL 48 HB VAL 48 6.406 -9.358 5.796
400 HG11 VAL 48 HG11 VAL 48 6.703 -6.958 6.156
401 HG12 VAL 48 HG12 VAL 48 6.003 -6.637 4.569
402 HG13 VAL 48 HG13 VAL 48 7.533 -7.506 4.699
403 HG21 VAL 48 HG21 VAL 48 3.994 -9.418 6.046
404 HG22 VAL 48 HG22 VAL 48 3.863 -7.800 5.354
405 HG23 VAL 48 HG23 VAL 48 4.664 -8.032 6.909
406 H GLU 49 H GLU 49 6.802 -11.470 3.543
407 HA GLU 49 HA GLU 49 9.373 -10.338 2.945
408 HB2 GLU 49 HB2 GLU 49 8.444 -13.198 3.103
409 HB3 GLU 49 HB3 GLU 49 10.111 -12.713 2.829
410 HG2 GLU 49 HG2 GLU 49 10.126 -11.562 4.983
411 HG3 GLU 49 HG3 GLU 49 8.461 -12.074 5.260
412 H ASP 50 H ASP 50 6.749 -10.927 0.987
413 HA ASP 50 HA ASP 50 8.540 -11.360 -1.317
414 HB2 ASP 50 HB2 ASP 50 6.999 -13.289 -0.892
415 HB3 ASP 50 HB3 ASP 50 5.639 -12.211 -1.181
416 H VAL 51 H VAL 51 6.784 -9.034 0.180
417 HA VAL 51 HA VAL 51 5.501 -7.939 -2.144
418 HB VAL 51 HB VAL 51 4.511 -7.478 0.021
419 HG11 VAL 51 HG11 VAL 51 6.472 -7.414 1.430
420 HG12 VAL 51 HG12 VAL 51 5.543 -5.926 1.618
421 HG13 VAL 51 HG13 VAL 51 7.018 -5.929 0.649
422 HG21 VAL 51 HG21 VAL 51 4.238 -5.027 -0.200
423 HG22 VAL 51 HG22 VAL 51 4.071 -5.893 -1.726
424 HG23 VAL 51 HG23 VAL 51 5.559 -5.016 -1.368
425 H LYS 52 H LYS 52 7.295 -8.040 -3.513
426 HA LYS 52 HA LYS 52 9.551 -6.305 -3.119
427 HB2 LYS 52 HB2 LYS 52 8.615 -7.946 -5.475
428 HB3 LYS 52 HB3 LYS 52 10.125 -7.045 -5.446
429 HG2 LYS 52 HG2 LYS 52 11.155 -8.671 -4.358
430 HG3 LYS 52 HG3 LYS 52 9.894 -8.739 -3.128
431 HD2 LYS 52 HD2 LYS 52 8.568 -10.205 -4.537
432 HD3 LYS 52 HD3 LYS 52 9.760 -10.076 -5.832
433 HE2 LYS 52 HE2 LYS 52 11.438 -11.117 -4.395
434 HE3 LYS 52 HE3 LYS 52 10.258 -11.236 -3.094
435 HZ1 LYS 52 HZ1 LYS 52 9.920 -12.536 -5.738
436 HZ2 LYS 52 HZ2 LYS 52 8.980 -12.779 -4.344
437 HZ3 LYS 52 HZ3 LYS 52 10.589 -13.310 -4.386
438 HA PRO 53 HA PRO 53 8.092 -2.543 -4.901
439 HB2 PRO 53 HB2 PRO 53 10.493 -2.539 -6.647
440 HB3 PRO 53 HB3 PRO 53 9.942 -1.323 -5.489
441 HG2 PRO 53 HG2 PRO 53 12.026 -2.899 -4.945
442 HG3 PRO 53 HG3 PRO 53 10.873 -2.431 -3.682
443 HD2 PRO 53 HD2 PRO 53 11.137 -5.021 -5.146
444 HD3 PRO 53 HD3 PRO 53 10.727 -4.723 -3.445
445 H ARG 54 H ARG 54 9.121 -5.131 -6.997
446 HA ARG 54 HA ARG 54 8.192 -4.287 -9.473
447 HB2 ARG 54 HB2 ARG 54 8.177 -7.043 -8.238
448 HB3 ARG 54 HB3 ARG 54 7.813 -6.733 -9.927
449 HG2 ARG 54 HG2 ARG 54 10.421 -6.131 -8.553
450 HG3 ARG 54 HG3 ARG 54 10.100 -7.503 -9.614
451 HD2 ARG 54 HD2 ARG 54 9.357 -5.579 -11.269
452 HD3 ARG 54 HD3 ARG 54 10.456 -4.624 -10.271
453 HE ARG 54 HE ARG 54 11.162 -6.904 -11.978
454 HH11 ARG 54 HH11 ARG 54 12.187 -4.351 -9.804
455 HH12 ARG 54 HH12 ARG 54 13.861 -4.461 -10.273
456 HH21 ARG 54 HH21 ARG 54 13.353 -7.031 -12.595
457 HH22 ARG 54 HH22 ARG 54 14.514 -5.960 -11.878
458 H HIS 55 H HIS 55 6.431 -5.548 -6.707
459 HA HIS 55 HA HIS 55 3.974 -5.989 -8.128
460 HB2 HIS 55 HB2 HIS 55 4.361 -5.690 -5.138
461 HB3 HIS 55 HB3 HIS 55 2.975 -6.397 -5.946
462 HD1 HIS 55 HD1 HIS 55 5.491 -7.872 -7.830
463 HD2 HIS 55 HD2 HIS 55 4.305 -8.321 -3.862
464 HE1 HIS 55 HE1 HIS 55 6.476 -10.059 -7.062
465 HE2 HIS 55 HE2 HIS 55 5.734 -10.325 -4.666
466 H ILE 56 H ILE 56 5.341 -3.457 -6.128
467 HA ILE 56 HA ILE 56 2.979 -1.895 -5.885
468 HB ILE 56 HB ILE 56 5.859 -1.004 -5.615
469 HG12 ILE 56 HG12 ILE 56 5.408 -2.883 -4.129
470 HG13 ILE 56 HG13 ILE 56 5.551 -1.398 -3.196
471 HG21 ILE 56 HG21 ILE 56 3.317 0.209 -4.543
472 HG22 ILE 56 HG22 ILE 56 4.324 0.864 -5.833
473 HG23 ILE 56 HG23 ILE 56 4.950 0.770 -4.186
474 HD11 ILE 56 HD11 ILE 56 3.743 -2.794 -2.374
475 HD12 ILE 56 HD12 ILE 56 2.976 -2.755 -3.962
476 HD13 ILE 56 HD13 ILE 56 3.124 -1.273 -3.017
477 H ASP 57 H ASP 57 5.611 -2.014 -8.202
478 HA ASP 57 HA ASP 57 5.158 0.421 -9.514
479 HB2 ASP 57 HB2 ASP 57 7.172 -0.831 -9.956
480 HB3 ASP 57 HB3 ASP 57 6.245 -2.208 -10.540
481 H ASP 58 H ASP 58 3.768 -2.775 -9.957
482 HA ASP 58 HA ASP 58 2.314 -2.205 -12.323
483 HB2 ASP 58 HB2 ASP 58 2.873 -4.496 -11.503
484 HB3 ASP 58 HB3 ASP 58 1.700 -4.287 -10.209
485 H VAL 59 H VAL 59 1.428 -2.067 -8.887
486 HA VAL 59 HA VAL 59 -1.320 -1.532 -9.422
487 HB VAL 59 HB VAL 59 -1.585 -1.104 -7.061
488 HG11 VAL 59 HG11 VAL 59 -1.431 -3.424 -7.782
489 HG12 VAL 59 HG12 VAL 59 -0.762 -3.219 -6.162
490 HG13 VAL 59 HG13 VAL 59 0.317 -3.388 -7.544
491 HG21 VAL 59 HG21 VAL 59 0.391 0.244 -6.646
492 HG22 VAL 59 HG22 VAL 59 1.422 -1.167 -6.885
493 HG23 VAL 59 HG23 VAL 59 0.313 -1.107 -5.516
494 H LEU 60 H LEU 60 1.512 0.460 -9.197
495 HA LEU 60 HA LEU 60 0.242 2.935 -8.720
496 HB2 LEU 60 HB2 LEU 60 2.786 2.281 -10.203
497 HB3 LEU 60 HB3 LEU 60 2.262 3.915 -9.841
498 HG LEU 60 HG LEU 60 2.958 1.788 -7.815
499 HD11 LEU 60 HD11 LEU 60 4.373 4.320 -8.631
500 HD12 LEU 60 HD12 LEU 60 4.911 2.669 -8.939
501 HD13 LEU 60 HD13 LEU 60 4.837 3.276 -7.286
502 HD21 LEU 60 HD21 LEU 60 2.139 4.664 -7.406
503 HD22 LEU 60 HD22 LEU 60 2.677 3.549 -6.149
504 HD23 LEU 60 HD23 LEU 60 1.169 3.245 -7.011
505 H LYS 61 H LYS 61 1.165 1.329 -11.763
506 HA LYS 61 HA LYS 61 0.015 3.229 -13.494
507 HB2 LYS 61 HB2 LYS 61 0.508 0.270 -13.824
508 HB3 LYS 61 HB3 LYS 61 -0.102 1.280 -15.121
509 HG2 LYS 61 HG2 LYS 61 2.000 1.682 -15.667
510 HG3 LYS 61 HG3 LYS 61 2.135 2.623 -14.178
511 HD2 LYS 61 HD2 LYS 61 3.897 0.987 -14.257
512 HD3 LYS 61 HD3 LYS 61 2.769 0.565 -12.980
513 HE2 LYS 61 HE2 LYS 61 1.885 -1.222 -14.172
514 HE3 LYS 61 HE3 LYS 61 2.478 -0.610 -15.718
515 HZ1 LYS 61 HZ1 LYS 61 4.307 -1.513 -13.566
516 HZ2 LYS 61 HZ2 LYS 61 4.656 -1.254 -15.204
517 HZ3 LYS 61 HZ3 LYS 61 3.697 -2.571 -14.744
518 H ALA 62 H ALA 62 -1.256 0.382 -11.919
519 HA ALA 62 HA ALA 62 -3.733 0.210 -13.191
520 HB1 ALA 62 HB1 ALA 62 -3.101 -0.514 -10.334
521 HB2 ALA 62 HB2 ALA 62 -2.803 -1.535 -11.738
522 HB3 ALA 62 HB3 ALA 62 -4.457 -1.111 -11.292
523 H VAL 63 H VAL 63 -2.822 2.155 -10.338
524 HA VAL 63 HA VAL 63 -5.533 3.080 -10.024
525 HB VAL 63 HB VAL 63 -4.021 2.850 -8.075
526 HG11 VAL 63 HG11 VAL 63 -1.944 3.618 -9.066
527 HG12 VAL 63 HG12 VAL 63 -2.332 4.559 -7.626
528 HG13 VAL 63 HG13 VAL 63 -2.605 5.244 -9.227
529 HG21 VAL 63 HG21 VAL 63 -4.634 4.977 -6.989
530 HG22 VAL 63 HG22 VAL 63 -5.973 4.253 -7.878
531 HG23 VAL 63 HG23 VAL 63 -5.098 5.623 -8.562
532 H MET 64 H MET 64 -2.652 4.187 -11.656
533 HA MET 64 HA MET 64 -3.478 6.883 -12.041
534 HB2 MET 64 HB2 MET 64 -1.492 5.179 -13.549
535 HB3 MET 64 HB3 MET 64 -1.748 6.890 -13.861
536 HG2 MET 64 HG2 MET 64 -1.040 7.423 -11.598
537 HG3 MET 64 HG3 MET 64 -0.820 5.710 -11.252
538 HE1 MET 64 HE1 MET 64 1.492 7.816 -10.719
539 HE2 MET 64 HE2 MET 64 2.878 6.945 -11.379
540 HE3 MET 64 HE3 MET 64 1.659 6.079 -10.448
541 H LYS 65 H LYS 65 -3.874 3.917 -13.904
542 HA LYS 65 HA LYS 65 -4.818 5.156 -16.265
543 HB2 LYS 65 HB2 LYS 65 -5.481 2.947 -16.976
544 HB3 LYS 65 HB3 LYS 65 -3.926 2.852 -16.173
545 HG2 LYS 65 HG2 LYS 65 -4.953 1.974 -14.186
546 HG3 LYS 65 HG3 LYS 65 -6.557 2.176 -14.892
547 HD2 LYS 65 HD2 LYS 65 -4.386 0.397 -15.982
548 HD3 LYS 65 HD3 LYS 65 -5.746 -0.152 -15.007
549 HE2 LYS 65 HE2 LYS 65 -7.290 0.687 -16.731
550 HE3 LYS 65 HE3 LYS 65 -5.908 1.171 -17.713
551 HZ1 LYS 65 HZ1 LYS 65 -6.603 -1.603 -16.900
552 HZ2 LYS 65 HZ2 LYS 65 -5.209 -1.167 -17.761
553 HZ3 LYS 65 HZ3 LYS 65 -6.739 -0.944 -18.459
554 H ARG 66 H ARG 66 -6.445 3.889 -13.421
555 HA ARG 66 HA ARG 66 -9.087 4.217 -14.500
556 HB2 ARG 66 HB2 ARG 66 -8.281 3.910 -11.604
557 HB3 ARG 66 HB3 ARG 66 -9.864 3.596 -12.299
558 HG2 ARG 66 HG2 ARG 66 -9.005 1.712 -13.521
559 HG3 ARG 66 HG3 ARG 66 -7.365 2.070 -12.976
560 HD2 ARG 66 HD2 ARG 66 -8.168 1.773 -10.634
561 HD3 ARG 66 HD3 ARG 66 -9.706 1.226 -11.293
562 HE ARG 66 HE ARG 66 -7.350 -0.177 -12.233
563 HH11 ARG 66 HH11 ARG 66 -10.037 -0.133 -9.989
564 HH12 ARG 66 HH12 ARG 66 -9.909 -1.821 -9.615
565 HH21 ARG 66 HH21 ARG 66 -7.160 -2.375 -11.730
566 HH22 ARG 66 HH22 ARG 66 -8.265 -3.102 -10.590
567 H GLY 67 H GLY 67 -7.006 6.038 -12.318
568 HA2 GLY 67 HA2 GLY 67 -8.947 8.258 -12.485
569 HA3 GLY 67 HA3 GLY 67 -8.088 7.877 -11.000
570 H ALA 68 H ALA 68 -5.947 8.468 -10.774
571 HA ALA 68 HA ALA 68 -4.487 9.746 -12.880
572 HB1 ALA 68 HB1 ALA 68 -4.464 11.996 -11.929
573 HB2 ALA 68 HB2 ALA 68 -5.601 11.490 -10.678
574 HB3 ALA 68 HB3 ALA 68 -6.104 11.518 -12.369
575 HA PRO 69 HA PRO 69 -1.046 8.724 -10.272
576 HB2 PRO 69 HB2 PRO 69 0.560 10.937 -10.697
577 HB3 PRO 69 HB3 PRO 69 0.471 9.528 -11.761
578 HG2 PRO 69 HG2 PRO 69 -0.883 12.183 -12.007
579 HG3 PRO 69 HG3 PRO 69 -0.159 11.168 -13.267
580 HD2 PRO 69 HD2 PRO 69 -2.812 11.277 -12.912
581 HD3 PRO 69 HD3 PRO 69 -2.000 9.765 -13.372
582 H SER 70 H SER 70 -2.710 11.749 -9.899
583 HA SER 70 HA SER 70 -1.499 12.806 -7.634
584 HB2 SER 70 HB2 SER 70 -4.455 12.866 -8.281
585 HB3 SER 70 HB3 SER 70 -3.564 14.028 -7.296
586 HG SER 70 HG SER 70 -2.487 14.732 -9.098
587 H ILE 71 H ILE 71 -3.865 10.212 -7.927
588 HA ILE 71 HA ILE 71 -4.320 9.997 -5.102
589 HB ILE 71 HB ILE 71 -4.941 8.068 -7.353
590 HG12 ILE 71 HG12 ILE 71 -7.329 8.761 -6.721
591 HG13 ILE 71 HG13 ILE 71 -6.593 10.094 -5.843
592 HG21 ILE 71 HG21 ILE 71 -4.665 6.829 -5.288
593 HG22 ILE 71 HG22 ILE 71 -6.368 6.882 -5.743
594 HG23 ILE 71 HG23 ILE 71 -5.767 7.927 -4.455
595 HD11 ILE 71 HD11 ILE 71 -7.370 10.757 -8.059
596 HD12 ILE 71 HD12 ILE 71 -6.298 9.563 -8.789
597 HD13 ILE 71 HD13 ILE 71 -5.620 10.930 -7.906
598 H ALA 72 H ALA 72 -2.146 8.578 -7.438
599 HA ALA 72 HA ALA 72 -1.201 6.422 -5.887
600 HB1 ALA 72 HB1 ALA 72 0.655 6.336 -7.451
601 HB2 ALA 72 HB2 ALA 72 0.241 7.939 -8.058
602 HB3 ALA 72 HB3 ALA 72 -0.864 6.588 -8.313
603 H ASN 73 H ASN 73 -0.340 9.819 -6.015
604 HA ASN 73 HA ASN 73 2.083 9.738 -4.590
605 HB2 ASN 73 HB2 ASN 73 0.005 11.931 -4.390
606 HB3 ASN 73 HB3 ASN 73 1.735 12.076 -4.097
607 HD21 ASN 73 HD21 ASN 73 2.464 10.436 -6.370
608 HD22 ASN 73 HD22 ASN 73 2.153 11.377 -7.777
609 H ASP 74 H ASP 74 -1.250 10.002 -3.526
610 HA ASP 74 HA ASP 74 -0.752 10.144 -0.749
611 HB2 ASP 74 HB2 ASP 74 -2.931 10.727 -1.762
612 HB3 ASP 74 HB3 ASP 74 -3.175 9.041 -2.196
613 H THR 75 H THR 75 -1.313 7.457 -2.962
614 HA THR 75 HA THR 75 -1.386 5.397 -1.049
615 HB THR 75 HB THR 75 -0.434 5.164 -3.908
616 HG1 THR 75 HG1 THR 75 -2.796 5.987 -2.973
617 HG21 THR 75 HG21 THR 75 -1.296 2.894 -3.760
618 HG22 THR 75 HG22 THR 75 -1.822 3.178 -2.102
619 HG23 THR 75 HG23 THR 75 -0.102 3.165 -2.489
620 H LEU 76 H LEU 76 1.310 6.820 -2.874
621 HA LEU 76 HA LEU 76 3.328 5.082 -1.989
622 HB2 LEU 76 HB2 LEU 76 3.492 8.002 -2.733
623 HB3 LEU 76 HB3 LEU 76 4.884 6.961 -2.494
624 HG LEU 76 HG LEU 76 2.770 6.599 -4.619
625 HD11 LEU 76 HD11 LEU 76 4.206 8.533 -5.025
626 HD12 LEU 76 HD12 LEU 76 4.528 7.237 -6.177
627 HD13 LEU 76 HD13 LEU 76 5.634 7.515 -4.832
628 HD21 LEU 76 HD21 LEU 76 4.269 4.876 -5.499
629 HD22 LEU 76 HD22 LEU 76 3.700 4.472 -3.880
630 HD23 LEU 76 HD23 LEU 76 5.334 5.094 -4.111
631 H ARG 77 H ARG 77 2.142 8.127 -0.633
632 HA ARG 77 HA ARG 77 3.846 8.249 1.606
633 HB2 ARG 77 HB2 ARG 77 2.490 10.141 0.832
634 HB3 ARG 77 HB3 ARG 77 1.019 9.270 1.237
635 HG2 ARG 77 HG2 ARG 77 1.706 9.310 3.617
636 HG3 ARG 77 HG3 ARG 77 3.098 10.298 3.161
637 HD2 ARG 77 HD2 ARG 77 1.582 11.997 2.251
638 HD3 ARG 77 HD3 ARG 77 0.200 11.014 2.726
639 HE ARG 77 HE ARG 77 2.054 11.822 4.835
640 HH11 ARG 77 HH11 ARG 77 -1.015 12.311 3.202
641 HH12 ARG 77 HH12 ARG 77 -1.702 13.235 4.512
642 HH21 ARG 77 HH21 ARG 77 1.176 13.048 6.527
643 HH22 ARG 77 HH22 ARG 77 -0.430 13.701 6.386
644 H TRP 78 H TRP 78 0.769 6.693 1.035
645 HA TRP 78 HA TRP 78 0.175 5.867 3.658
646 HB2 TRP 78 HB2 TRP 78 -1.282 5.955 1.523
647 HB3 TRP 78 HB3 TRP 78 -0.610 4.371 1.166
648 HD1 TRP 78 HD1 TRP 78 -1.734 2.333 2.307
649 HE1 TRP 78 HE1 TRP 78 -3.665 2.058 3.989
650 HE3 TRP 78 HE3 TRP 78 -2.326 7.219 3.668
651 HZ2 TRP 78 HZ2 TRP 78 -5.233 3.703 5.664
652 HZ3 TRP 78 HZ3 TRP 78 -4.061 7.786 5.315
653 HH2 TRP 78 HH2 TRP 78 -5.483 6.064 6.292
654 H LEU 79 H LEU 79 1.655 4.098 0.945
655 HA LEU 79 HA LEU 79 2.103 1.710 2.402
656 HB2 LEU 79 HB2 LEU 79 3.426 2.730 -0.112
657 HB3 LEU 79 HB3 LEU 79 3.562 1.093 0.499
658 HG LEU 79 HG LEU 79 1.014 2.411 -0.431
659 HD11 LEU 79 HD11 LEU 79 1.146 0.866 -2.309
660 HD12 LEU 79 HD12 LEU 79 2.686 0.254 -1.708
661 HD13 LEU 79 HD13 LEU 79 2.557 1.924 -2.259
662 HD21 LEU 79 HD21 LEU 79 1.541 -0.416 0.480
663 HD22 LEU 79 HD22 LEU 79 0.028 0.183 -0.200
664 HD23 LEU 79 HD23 LEU 79 0.605 0.799 1.350
665 H LYS 80 H LYS 80 4.032 4.570 1.828
666 HA LYS 80 HA LYS 80 6.542 3.794 2.626
667 HB2 LYS 80 HB2 LYS 80 5.909 6.036 1.773
668 HB3 LYS 80 HB3 LYS 80 5.136 6.385 3.310
669 HG2 LYS 80 HG2 LYS 80 7.337 7.429 3.105
670 HG3 LYS 80 HG3 LYS 80 7.265 6.283 4.446
671 HD2 LYS 80 HD2 LYS 80 8.141 5.192 1.852
672 HD3 LYS 80 HD3 LYS 80 9.236 6.331 2.626
673 HE2 LYS 80 HE2 LYS 80 8.062 4.162 4.277
674 HE3 LYS 80 HE3 LYS 80 9.333 3.743 3.141
675 HZ1 LYS 80 HZ1 LYS 80 10.246 4.253 5.314
676 HZ2 LYS 80 HZ2 LYS 80 9.522 5.783 5.296
677 HZ3 LYS 80 HZ3 LYS 80 10.756 5.414 4.190
678 H ARG 81 H ARG 81 4.130 5.263 4.723
679 HA ARG 81 HA ARG 81 5.337 4.784 7.182
680 HB2 ARG 81 HB2 ARG 81 2.360 4.756 6.697
681 HB3 ARG 81 HB3 ARG 81 3.196 5.218 8.170
682 HG2 ARG 81 HG2 ARG 81 4.063 7.196 7.120
683 HG3 ARG 81 HG3 ARG 81 3.385 6.704 5.565
684 HD2 ARG 81 HD2 ARG 81 1.912 8.318 6.491
685 HD3 ARG 81 HD3 ARG 81 1.125 6.753 6.636
686 HE ARG 81 HE ARG 81 2.578 7.365 9.001
687 HH11 ARG 81 HH11 ARG 81 -0.375 8.178 7.294
688 HH12 ARG 81 HH12 ARG 81 -1.243 8.615 8.735
689 HH21 ARG 81 HH21 ARG 81 1.426 7.948 10.905
690 HH22 ARG 81 HH22 ARG 81 -0.220 8.478 10.775
691 H MET 82 H MET 82 2.931 2.873 5.440
692 HA MET 82 HA MET 82 2.459 0.905 7.339
693 HB2 MET 82 HB2 MET 82 1.087 1.199 5.346
694 HB3 MET 82 HB3 MET 82 2.413 0.649 4.331
695 HG2 MET 82 HG2 MET 82 2.308 -1.552 5.400
696 HG3 MET 82 HG3 MET 82 0.964 -0.996 6.397
697 HE1 MET 82 HE1 MET 82 -1.375 -0.232 5.400
698 HE2 MET 82 HE2 MET 82 -1.811 -0.351 3.695
699 HE3 MET 82 HE3 MET 82 -0.616 0.836 4.219
700 H PHE 83 H PHE 83 4.824 0.780 4.658
701 HA PHE 83 HA PHE 83 5.722 -1.830 5.418
702 HB2 PHE 83 HB2 PHE 83 6.827 0.197 3.476
703 HB3 PHE 83 HB3 PHE 83 7.560 -1.384 3.738
704 HD1 PHE 83 HD1 PHE 83 5.491 -3.270 3.817
705 HD2 PHE 83 HD2 PHE 83 5.692 0.285 1.493
706 HE1 PHE 83 HE1 PHE 83 3.953 -4.265 2.173
707 HE2 PHE 83 HE2 PHE 83 4.150 -0.698 -0.153
708 HZ PHE 83 HZ PHE 83 3.280 -2.976 0.185
709 H ASN 84 H ASN 84 6.612 1.392 6.303
710 HA ASN 84 HA ASN 84 9.227 0.842 7.238
711 HB2 ASN 84 HB2 ASN 84 8.344 3.141 6.846
712 HB3 ASN 84 HB3 ASN 84 7.308 2.952 8.258
713 HD21 ASN 84 HD21 ASN 84 8.186 3.097 10.290
714 HD22 ASN 84 HD22 ASN 84 9.819 3.595 10.589
715 H TYR 85 H TYR 85 6.049 0.388 8.592
716 HA TYR 85 HA TYR 85 6.752 -0.049 11.285
717 HB2 TYR 85 HB2 TYR 85 4.430 0.255 10.608
718 HB3 TYR 85 HB3 TYR 85 4.487 -1.212 9.640
719 HD1 TYR 85 HD1 TYR 85 4.402 0.118 13.079
720 HD2 TYR 85 HD2 TYR 85 4.246 -3.374 10.653
721 HE1 TYR 85 HE1 TYR 85 3.626 -1.188 15.015
722 HE2 TYR 85 HE2 TYR 85 3.469 -4.688 12.578
723 HH TYR 85 HH TYR 85 2.285 -3.328 15.382
724 H ALA 86 H ALA 86 6.793 -2.121 8.452
725 HA ALA 86 HA ALA 86 7.241 -4.568 9.815
726 HB1 ALA 86 HB1 ALA 86 7.860 -5.460 7.631
727 HB2 ALA 86 HB2 ALA 86 7.943 -3.823 6.976
728 HB3 ALA 86 HB3 ALA 86 6.399 -4.477 7.517
729 H ILE 87 H ILE 87 9.310 -1.965 8.801
730 HA ILE 87 HA ILE 87 11.781 -3.374 9.017
731 HB ILE 87 HB ILE 87 11.310 -0.395 9.263
732 HG12 ILE 87 HG12 ILE 87 11.970 -2.046 6.812
733 HG13 ILE 87 HG13 ILE 87 10.406 -1.312 7.155
734 HG21 ILE 87 HG21 ILE 87 13.788 -1.982 8.600
735 HG22 ILE 87 HG22 ILE 87 13.494 -1.054 10.072
736 HG23 ILE 87 HG23 ILE 87 13.659 -0.224 8.524
737 HD11 ILE 87 HD11 ILE 87 11.666 -0.000 5.550
738 HD12 ILE 87 HD12 ILE 87 12.990 0.164 6.705
739 HD13 ILE 87 HD13 ILE 87 11.424 0.902 7.046
740 H LYS 88 H LYS 88 9.888 -1.332 11.200
741 HA LYS 88 HA LYS 88 11.723 -1.291 13.346
742 HB2 LYS 88 HB2 LYS 88 8.737 -1.225 13.693
743 HB3 LYS 88 HB3 LYS 88 9.969 -0.406 14.646
744 HG2 LYS 88 HG2 LYS 88 10.492 0.983 12.654
745 HG3 LYS 88 HG3 LYS 88 9.117 0.239 11.837
746 HD2 LYS 88 HD2 LYS 88 9.049 1.894 14.349
747 HD3 LYS 88 HD3 LYS 88 8.475 2.353 12.752
748 HE2 LYS 88 HE2 LYS 88 6.763 0.640 12.835
749 HE3 LYS 88 HE3 LYS 88 7.359 0.105 14.408
750 HZ1 LYS 88 HZ1 LYS 88 5.400 1.576 14.555
751 HZ2 LYS 88 HZ2 LYS 88 6.305 2.828 13.855
752 HZ3 LYS 88 HZ3 LYS 88 6.753 2.199 15.365
753 H ARG 89 H ARG 89 8.988 -3.367 12.590
754 HA ARG 89 HA ARG 89 9.330 -5.188 14.753
755 HB2 ARG 89 HB2 ARG 89 8.017 -5.433 12.053
756 HB3 ARG 89 HB3 ARG 89 8.067 -6.776 13.181
757 HG2 ARG 89 HG2 ARG 89 6.882 -4.098 13.851
758 HG3 ARG 89 HG3 ARG 89 5.953 -5.439 13.178
759 HD2 ARG 89 HD2 ARG 89 6.846 -6.811 15.140
760 HD3 ARG 89 HD3 ARG 89 7.343 -5.269 15.837
761 HE ARG 89 HE ARG 89 4.679 -4.974 15.154
762 HH11 ARG 89 HH11 ARG 89 6.569 -6.956 17.349
763 HH12 ARG 89 HH12 ARG 89 5.243 -7.221 18.438
764 HH21 ARG 89 HH21 ARG 89 2.950 -5.334 16.578
765 HH22 ARG 89 HH22 ARG 89 3.192 -6.307 18.005
766 H HIS 90 H HIS 90 11.129 -4.624 11.964
767 HA HIS 90 HA HIS 90 12.985 -5.513 11.056
768 HB2 HIS 90 HB2 HIS 90 13.515 -5.849 13.570
769 HB3 HIS 90 HB3 HIS 90 13.157 -7.547 13.262
770 HD1 HIS 90 HD1 HIS 90 15.180 -8.868 12.709
771 HD2 HIS 90 HD2 HIS 90 15.526 -4.906 11.510
772 HE1 HIS 90 HE1 HIS 90 17.486 -8.655 11.726
773 HE2 HIS 90 HE2 HIS 90 17.755 -6.194 11.264
774 H ILE 91 H ILE 91 10.320 -6.567 10.497
775 HA ILE 91 HA ILE 91 10.607 -9.362 9.901
776 HB ILE 91 HB ILE 91 8.672 -7.358 8.710
777 HG12 ILE 91 HG12 ILE 91 8.277 -9.275 11.023
778 HG13 ILE 91 HG13 ILE 91 8.518 -7.538 11.187
779 HG21 ILE 91 HG21 ILE 91 7.327 -9.314 8.129
780 HG22 ILE 91 HG22 ILE 91 8.569 -10.375 8.794
781 HG23 ILE 91 HG23 ILE 91 8.919 -9.393 7.372
782 HD11 ILE 91 HD11 ILE 91 6.207 -8.885 9.809
783 HD12 ILE 91 HD12 ILE 91 6.444 -7.144 9.955
784 HD13 ILE 91 HD13 ILE 91 6.177 -8.122 11.399
785 H ILE 92 H ILE 92 10.414 -6.457 7.866
786 HA ILE 92 HA ILE 92 12.546 -7.587 6.192
787 HB ILE 92 HB ILE 92 11.584 -6.583 4.186
788 HG12 ILE 92 HG12 ILE 92 9.131 -5.941 5.836
789 HG13 ILE 92 HG13 ILE 92 10.347 -4.750 5.388
790 HG21 ILE 92 HG21 ILE 92 9.678 -8.087 3.872
791 HG22 ILE 92 HG22 ILE 92 9.624 -8.369 5.611
792 HG23 ILE 92 HG23 ILE 92 11.025 -8.893 4.678
793 HD11 ILE 92 HD11 ILE 92 9.856 -5.135 3.033
794 HD12 ILE 92 HD12 ILE 92 8.415 -4.646 3.924
795 HD13 ILE 92 HD13 ILE 92 8.647 -6.338 3.481
796 H GLU 93 H GLU 93 14.187 -6.197 5.787
797 HA GLU 93 HA GLU 93 13.857 -3.453 6.799
798 HB2 GLU 93 HB2 GLU 93 15.569 -5.117 7.830
799 HB3 GLU 93 HB3 GLU 93 16.502 -4.825 6.370
800 HG2 GLU 93 HG2 GLU 93 16.671 -2.485 6.881
801 HG3 GLU 93 HG3 GLU 93 15.594 -2.671 8.264
802 H TYR 94 H TYR 94 13.018 -4.343 4.234
803 HA TYR 94 HA TYR 94 15.005 -3.187 2.408
804 HB2 TYR 94 HB2 TYR 94 12.628 -4.960 1.807
805 HB3 TYR 94 HB3 TYR 94 13.760 -4.338 0.611
806 HD1 TYR 94 HD1 TYR 94 16.036 -5.224 0.476
807 HD2 TYR 94 HD2 TYR 94 13.240 -6.780 3.281
808 HE1 TYR 94 HE1 TYR 94 17.485 -7.178 0.831
809 HE2 TYR 94 HE2 TYR 94 14.682 -8.738 3.645
810 HH TYR 94 HH TYR 94 17.904 -8.874 2.526
811 H ASN 95 H ASN 95 11.513 -3.153 3.104
812 HA ASN 95 HA ASN 95 9.880 -1.691 2.764
813 HB2 ASN 95 HB2 ASN 95 11.442 -0.294 4.136
814 HB3 ASN 95 HB3 ASN 95 12.071 0.382 2.633
815 HD21 ASN 95 HD21 ASN 95 10.674 1.546 1.309
816 HD22 ASN 95 HD22 ASN 95 9.273 2.285 1.954
817 HA PRO 96 HA PRO 96 10.439 -2.080 -1.785
818 HB2 PRO 96 HB2 PRO 96 7.725 -2.374 -2.204
819 HB3 PRO 96 HB3 PRO 96 8.852 -3.705 -1.913
820 HG2 PRO 96 HG2 PRO 96 7.024 -2.309 0.001
821 HG3 PRO 96 HG3 PRO 96 7.403 -4.037 -0.132
822 HD2 PRO 96 HD2 PRO 96 8.505 -2.517 1.774
823 HD3 PRO 96 HD3 PRO 96 9.433 -3.804 0.973
824 H ALA 97 H ALA 97 8.389 0.026 0.098
825 HA ALA 97 HA ALA 97 7.546 1.647 -2.111
826 HB1 ALA 97 HB1 ALA 97 6.536 3.079 -0.435
827 HB2 ALA 97 HB2 ALA 97 7.413 2.237 0.842
828 HB3 ALA 97 HB3 ALA 97 6.179 1.385 -0.087
829 H ALA 98 H ALA 98 10.511 1.312 -0.837
830 HA ALA 98 HA ALA 98 11.278 4.073 -0.582
831 HB1 ALA 98 HB1 ALA 98 13.013 1.621 -0.868
832 HB2 ALA 98 HB2 ALA 98 12.453 2.311 0.656
833 HB3 ALA 98 HB3 ALA 98 13.550 3.227 -0.375
834 H ALA 99 H ALA 99 10.681 2.002 -3.172
835 HA ALA 99 HA ALA 99 12.654 3.026 -4.986
836 HB1 ALA 99 HB1 ALA 99 11.721 0.761 -5.211
837 HB2 ALA 99 HB2 ALA 99 11.506 1.721 -6.674
838 HB3 ALA 99 HB3 ALA 99 10.145 1.462 -5.583
839 H PHE 100 H PHE 100 9.259 3.683 -4.310
840 HA PHE 100 HA PHE 100 9.397 5.939 -6.188
841 HB2 PHE 100 HB2 PHE 100 7.055 4.130 -5.580
842 HB3 PHE 100 HB3 PHE 100 6.907 5.648 -6.457
843 HD1 PHE 100 HD1 PHE 100 7.952 5.899 -8.674
844 HD2 PHE 100 HD2 PHE 100 7.895 2.171 -6.625
845 HE1 PHE 100 HE1 PHE 100 8.469 4.736 -10.781
846 HE2 PHE 100 HE2 PHE 100 8.414 1.002 -8.725
847 HZ PHE 100 HZ PHE 100 8.703 2.282 -10.806
848 H ASP 101 H ASP 101 9.575 7.724 -5.028
849 HA ASP 101 HA ASP 101 8.195 7.916 -2.459
850 HB2 ASP 101 HB2 ASP 101 9.608 9.892 -2.066
851 HB3 ASP 101 HB3 ASP 101 10.579 8.476 -2.456
852 HA PRO 102 HA PRO 102 5.062 10.524 -4.146
853 HB2 PRO 102 HB2 PRO 102 4.337 11.870 -1.898
854 HB3 PRO 102 HB3 PRO 102 3.891 10.188 -2.198
855 HG2 PRO 102 HG2 PRO 102 6.103 11.291 -0.512
856 HG3 PRO 102 HG3 PRO 102 4.998 9.946 -0.169
857 HD2 PRO 102 HD2 PRO 102 7.537 9.576 -1.040
858 HD3 PRO 102 HD3 PRO 102 6.216 8.460 -1.434
859 H GLY 103 H GLY 103 4.943 12.464 -5.051
860 HA2 GLY 103 HA2 GLY 103 7.089 14.135 -5.375
861 HA3 GLY 103 HA3 GLY 103 5.424 14.617 -5.655
862 H ASP 104 H ASP 104 8.068 15.611 -4.233
863 HA ASP 104 HA ASP 104 7.303 16.265 -1.583
864 HB2 ASP 104 HB2 ASP 104 9.636 16.268 -2.182
865 HB3 ASP 104 HB3 ASP 104 9.366 17.467 -3.441
866 H ALA 105 H ALA 105 5.507 17.391 -1.222
867 HA ALA 105 HA ALA 105 5.251 20.009 -2.520
868 HB1 ALA 105 HB1 ALA 105 3.697 18.492 -3.636
869 HB2 ALA 105 HB2 ALA 105 2.835 19.716 -2.706
870 HB3 ALA 105 HB3 ALA 105 2.978 18.072 -2.081
871 H GLY 106 H GLY 106 5.688 21.325 -0.874
872 HA2 GLY 106 HA2 GLY 106 4.062 21.018 1.570
873 HA3 GLY 106 HA3 GLY 106 5.784 21.356 1.671
874 H GLY 107 H GLY 107 4.145 23.071 2.907
875 HA2 GLY 107 HA2 GLY 107 4.710 25.565 2.383
876 HA3 GLY 107 HA3 GLY 107 3.583 25.282 1.064
877 H LYS 108 H LYS 108 3.525 24.134 4.403
878 HA LYS 108 HA LYS 108 2.019 24.251 6.055
879 HB2 LYS 108 HB2 LYS 108 2.405 26.753 5.632
880 HB3 LYS 108 HB3 LYS 108 0.847 26.725 4.819
881 HG2 LYS 108 HG2 LYS 108 0.379 27.428 6.994
882 HG3 LYS 108 HG3 LYS 108 -0.079 25.723 6.964
883 HD2 LYS 108 HD2 LYS 108 2.580 26.736 7.964
884 HD3 LYS 108 HD3 LYS 108 1.196 26.437 9.000
885 HE2 LYS 108 HE2 LYS 108 1.198 24.074 8.213
886 HE3 LYS 108 HE3 LYS 108 2.690 24.420 7.341
887 HZ1 LYS 108 HZ1 LYS 108 3.625 25.118 9.557
888 HZ2 LYS 108 HZ2 LYS 108 3.319 23.461 9.369
889 HZ3 LYS 108 HZ3 LYS 108 2.250 24.420 10.270
890 H LEU 109 H LEU 109 0.683 22.609 5.937
891 HA LEU 109 HA LEU 109 -1.505 22.691 3.962
892 HB2 LEU 109 HB2 LEU 109 0.126 20.892 3.590
893 HB3 LEU 109 HB3 LEU 109 -0.138 20.311 5.222
894 HG LEU 109 HG LEU 109 -2.503 19.821 4.614
895 HD11 LEU 109 HD11 LEU 109 -2.756 21.389 2.777
896 HD12 LEU 109 HD12 LEU 109 -3.106 19.745 2.243
897 HD13 LEU 109 HD13 LEU 109 -1.565 20.498 1.831
898 HD21 LEU 109 HD21 LEU 109 -1.994 17.820 3.319
899 HD22 LEU 109 HD22 LEU 109 -0.790 18.080 4.581
900 HD23 LEU 109 HD23 LEU 109 -0.411 18.481 2.905
901 H GLU 110 H GLU 110 -3.524 22.665 4.679
902 HA GLU 110 HA GLU 110 -5.371 22.453 5.971
903 HB2 GLU 110 HB2 GLU 110 -3.658 20.450 7.440
904 HB3 GLU 110 HB3 GLU 110 -5.378 20.677 7.721
905 HG2 GLU 110 HG2 GLU 110 -5.835 20.040 5.407
906 HG3 GLU 110 HG3 GLU 110 -4.109 19.805 5.136
907 H HIS 111 H HIS 111 -3.158 24.366 6.730
908 HA HIS 111 HA HIS 111 -3.936 24.746 9.536
909 HB2 HIS 111 HB2 HIS 111 -1.487 24.379 9.102
910 HB3 HIS 111 HB3 HIS 111 -1.485 25.871 8.166
911 HD1 HIS 111 HD1 HIS 111 -2.023 24.640 11.710
912 HD2 HIS 111 HD2 HIS 111 -1.204 28.154 9.639
913 HE1 HIS 111 HE1 HIS 111 -1.556 26.375 13.471
914 HE2 HIS 111 HE2 HIS 111 -1.226 28.531 12.200
915 H HIS 112 H HIS 112 -5.442 26.159 9.721
916 HA HIS 112 HA HIS 112 -6.968 27.732 9.267
917 HB2 HIS 112 HB2 HIS 112 -6.273 29.965 9.475
918 HB3 HIS 112 HB3 HIS 112 -5.098 29.024 10.367
919 HD1 HIS 112 HD1 HIS 112 -5.453 31.414 7.565
920 HD2 HIS 112 HD2 HIS 112 -2.495 28.980 9.183
921 HE1 HIS 112 HE1 HIS 112 -3.284 32.246 6.600
922 HE2 HIS 112 HE2 HIS 112 -1.560 30.590 7.392
923 H HIS 113 H HIS 113 -7.996 26.941 7.527
924 HA HIS 113 HA HIS 113 -7.285 28.181 4.942
925 HB2 HIS 113 HB2 HIS 113 -7.106 25.626 5.150
926 HB3 HIS 113 HB3 HIS 113 -8.859 25.621 5.279
927 HD1 HIS 113 HD1 HIS 113 -10.040 25.315 3.128
928 HD2 HIS 113 HD2 HIS 113 -6.255 26.948 2.602
929 HE1 HIS 113 HE1 HIS 113 -9.698 25.447 0.641
930 HE2 HIS 113 HE2 HIS 113 -7.321 26.232 0.357
931 H HIS 114 H HIS 114 -8.996 29.024 7.267
932 HA HIS 114 HA HIS 114 -11.731 28.785 6.695
933 HB2 HIS 114 HB2 HIS 114 -10.729 29.560 8.861
934 HB3 HIS 114 HB3 HIS 114 -10.350 31.092 8.086
935 HD1 HIS 114 HD1 HIS 114 -13.087 29.195 9.675
936 HD2 HIS 114 HD2 HIS 114 -12.624 32.728 7.532
937 HE1 HIS 114 HE1 HIS 114 -15.225 30.475 10.010
938 HE2 HIS 114 HE2 HIS 114 -14.972 32.563 8.619
939 H HIS 115 H HIS 115 -9.349 31.195 5.705
940 HA HIS 115 HA HIS 115 -10.986 32.014 3.477
941 HB2 HIS 115 HB2 HIS 115 -11.822 33.308 5.514
942 HB3 HIS 115 HB3 HIS 115 -10.249 34.090 5.550
943 HD1 HIS 115 HD1 HIS 115 -13.118 33.636 3.074
944 HD2 HIS 115 HD2 HIS 115 -10.190 36.397 4.144
945 HE1 HIS 115 HE1 HIS 115 -13.588 35.697 1.708
946 HE2 HIS 115 HE2 HIS 115 -11.875 37.388 2.441
947 H HIS 116 H HIS 116 -9.732 33.213 1.916
948 HA HIS 116 HA HIS 116 -6.922 32.619 2.089
949 HB2 HIS 116 HB2 HIS 116 -8.498 34.139 0.000
950 HB3 HIS 116 HB3 HIS 116 -6.794 33.730 -0.143
951 HD1 HIS 116 HD1 HIS 116 -9.773 32.659 -1.519
952 HD2 HIS 116 HD2 HIS 116 -6.687 30.632 0.406
953 HE1 HIS 116 HE1 HIS 116 -9.952 30.263 -2.277
954 HE2 HIS 116 HE2 HIS 116 -8.052 29.058 -1.133
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