Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
650839 | 6scw RC | 34420 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 H MET 1 0.390 0.859 0.325
2 HA MET 1 HA MET 1 2.864 -0.493 -0.426
3 HB2 MET 1 HB2 MET 1 0.752 0.961 -2.013
4 HB3 MET 1 HB3 MET 1 2.260 0.406 -2.728
5 HG2 MET 1 HG2 MET 1 1.284 -1.819 -1.404
6 HG3 MET 1 HG3 MET 1 -0.148 -1.064 -2.102
7 HE1 MET 1 HE1 MET 1 -0.172 -2.276 -5.560
8 HE2 MET 1 HE2 MET 1 -0.851 -2.723 -3.995
9 HE3 MET 1 HE3 MET 1 -0.778 -1.027 -4.473
10 H ASP 2 H ASP 2 1.624 2.688 -1.404
11 HA ASP 2 HA ASP 2 2.562 4.767 -1.371
12 HB2 ASP 2 HB2 ASP 2 4.804 3.756 0.358
13 HB3 ASP 2 HB3 ASP 2 4.085 5.363 0.311
14 H GLU 3 H GLU 3 5.406 2.631 -1.102
15 HA GLU 3 HA GLU 3 7.171 2.267 -2.492
16 HB2 GLU 3 HB2 GLU 3 5.125 1.965 -4.115
17 HB3 GLU 3 HB3 GLU 3 5.703 3.477 -4.801
18 HG2 GLU 3 HG2 GLU 3 8.006 2.084 -4.707
19 HG3 GLU 3 HG3 GLU 3 6.849 0.774 -4.937
20 H THR 4 H THR 4 8.154 4.014 -1.226
21 HA THR 4 HA THR 4 9.127 6.084 -0.940
22 HB THR 4 HB THR 4 10.742 4.893 -2.347
23 HG1 THR 4 HG1 THR 4 10.708 7.487 -3.427
24 HG21 THR 4 HG21 THR 4 9.102 6.045 -4.594
25 HG22 THR 4 HG22 THR 4 10.766 5.506 -4.816
26 HG23 THR 4 HG23 THR 4 9.528 4.359 -4.304
27 H GLY 5 H GLY 5 6.435 6.447 -1.540
28 HA2 GLY 5 HA2 GLY 5 6.551 8.879 -3.214
29 HA3 GLY 5 HA3 GLY 5 5.186 7.774 -3.271
30 H LYS 6 H LYS 6 7.062 9.573 -0.828
31 HA LYS 6 HA LYS 6 4.646 9.930 0.757
32 HB2 LYS 6 HB2 LYS 6 7.436 9.780 1.314
33 HB3 LYS 6 HB3 LYS 6 6.862 11.353 1.851
34 HG2 LYS 6 HG2 LYS 6 6.440 10.177 3.735
35 HG3 LYS 6 HG3 LYS 6 4.926 9.855 2.887
36 HD2 LYS 6 HD2 LYS 6 5.351 7.675 2.935
37 HD3 LYS 6 HD3 LYS 6 6.850 7.937 2.042
38 HE2 LYS 6 HE2 LYS 6 7.547 6.881 4.000
39 HE3 LYS 6 HE3 LYS 6 7.853 8.589 4.313
40 HZ1 LYS 6 HZ1 LYS 6 6.788 7.456 6.191
41 HZ2 LYS 6 HZ2 LYS 6 5.831 8.714 5.586
42 HZ3 LYS 6 HZ3 LYS 6 5.445 7.107 5.222
43 H GLU 7 H GLU 7 3.518 11.779 0.925
44 HA GLU 7 HA GLU 7 4.500 14.366 0.533
45 HB2 GLU 7 HB2 GLU 7 3.991 12.971 -1.906
46 HB3 GLU 7 HB3 GLU 7 2.788 14.242 -1.734
47 HG2 GLU 7 HG2 GLU 7 4.259 15.817 -2.245
48 HG3 GLU 7 HG3 GLU 7 5.423 15.207 -1.071
49 H LEU 8 H LEU 8 2.701 15.993 0.319
50 HA LEU 8 HA LEU 8 0.134 14.932 1.275
51 HB2 LEU 8 HB2 LEU 8 2.019 16.478 2.769
52 HB3 LEU 8 HB3 LEU 8 0.555 17.428 2.523
53 HG LEU 8 HG LEU 8 -0.780 15.809 3.650
54 HD11 LEU 8 HD11 LEU 8 0.329 13.756 4.624
55 HD12 LEU 8 HD12 LEU 8 0.073 13.750 2.879
56 HD13 LEU 8 HD13 LEU 8 1.677 14.080 3.533
57 HD21 LEU 8 HD21 LEU 8 -0.132 16.703 5.573
58 HD22 LEU 8 HD22 LEU 8 1.191 15.541 5.667
59 HD23 LEU 8 HD23 LEU 8 1.440 17.097 4.876
60 H VAL 9 H VAL 9 -1.688 16.243 0.840
61 HA VAL 9 HA VAL 9 -1.302 18.611 -0.817
62 HB VAL 9 HB VAL 9 -2.753 17.840 -2.597
63 HG11 VAL 9 HG11 VAL 9 -0.392 17.444 -2.900
64 HG12 VAL 9 HG12 VAL 9 -0.501 15.920 -2.019
65 HG13 VAL 9 HG13 VAL 9 -1.301 16.095 -3.581
66 HG21 VAL 9 HG21 VAL 9 -4.216 16.357 -1.418
67 HG22 VAL 9 HG22 VAL 9 -3.421 15.436 -2.694
68 HG23 VAL 9 HG23 VAL 9 -2.882 15.273 -1.023
69 H LEU 10 H LEU 10 -3.463 19.638 -1.343
70 HA LEU 10 HA LEU 10 -5.318 19.244 0.913
71 HB2 LEU 10 HB2 LEU 10 -4.240 21.708 -0.369
72 HB3 LEU 10 HB3 LEU 10 -5.862 21.746 0.319
73 HG LEU 10 HG LEU 10 -4.057 22.611 1.817
74 HD11 LEU 10 HD11 LEU 10 -6.287 21.585 2.540
75 HD12 LEU 10 HD12 LEU 10 -5.337 20.174 3.006
76 HD13 LEU 10 HD13 LEU 10 -5.019 21.739 3.756
77 HD21 LEU 10 HD21 LEU 10 -3.257 19.717 2.057
78 HD22 LEU 10 HD22 LEU 10 -2.366 20.907 1.107
79 HD23 LEU 10 HD23 LEU 10 -2.523 21.109 2.852
80 H ALA 11 H ALA 11 -7.505 19.265 0.513
81 HA ALA 11 HA ALA 11 -8.353 18.478 -2.075
82 HB1 ALA 11 HB1 ALA 11 -9.752 19.074 0.498
83 HB2 ALA 11 HB2 ALA 11 -10.682 18.838 -0.982
84 HB3 ALA 11 HB3 ALA 11 -9.630 17.554 -0.387
85 H LEU 12 H LEU 12 -8.410 19.847 -3.738
86 HA LEU 12 HA LEU 12 -8.896 22.664 -3.377
87 HB2 LEU 12 HB2 LEU 12 -7.323 21.603 -5.069
88 HB3 LEU 12 HB3 LEU 12 -8.765 21.181 -5.989
89 HG LEU 12 HG LEU 12 -8.247 24.029 -5.227
90 HD11 LEU 12 HD11 LEU 12 -6.186 23.480 -6.236
91 HD12 LEU 12 HD12 LEU 12 -6.966 22.488 -7.468
92 HD13 LEU 12 HD13 LEU 12 -7.156 24.241 -7.497
93 HD21 LEU 12 HD21 LEU 12 -9.291 23.704 -7.822
94 HD22 LEU 12 HD22 LEU 12 -10.166 22.583 -6.778
95 HD23 LEU 12 HD23 LEU 12 -10.120 24.302 -6.384
96 H TYR 13 H TYR 13 -10.724 19.857 -4.298
97 HA TYR 13 HA TYR 13 -13.129 21.520 -4.452
98 HB2 TYR 13 HB2 TYR 13 -12.620 21.209 -6.760
99 HB3 TYR 13 HB3 TYR 13 -12.249 19.506 -6.520
100 HD1 TYR 13 HD1 TYR 13 -13.788 18.150 -7.562
101 HD2 TYR 13 HD2 TYR 13 -15.158 21.691 -5.642
102 HE1 TYR 13 HE1 TYR 13 -16.105 17.559 -8.139
103 HE2 TYR 13 HE2 TYR 13 -17.479 21.110 -6.213
104 HH TYR 13 HH TYR 13 -18.577 19.617 -8.155
105 H ASP 14 H ASP 14 -14.863 20.659 -3.455
106 HA ASP 14 HA ASP 14 -14.559 18.469 -1.723
107 HB2 ASP 14 HB2 ASP 14 -17.140 19.700 -2.711
108 HB3 ASP 14 HB3 ASP 14 -16.941 18.717 -1.263
109 H TYR 15 H TYR 15 -14.054 16.539 -2.624
110 HA TYR 15 HA TYR 15 -15.772 15.517 -4.776
111 HB2 TYR 15 HB2 TYR 15 -13.028 15.505 -4.532
112 HB3 TYR 15 HB3 TYR 15 -13.464 13.879 -4.018
113 HD1 TYR 15 HD1 TYR 15 -14.820 12.436 -5.580
114 HD2 TYR 15 HD2 TYR 15 -13.059 16.107 -6.813
115 HE1 TYR 15 HE1 TYR 15 -15.045 11.747 -7.931
116 HE2 TYR 15 HE2 TYR 15 -13.281 15.430 -9.167
117 HH TYR 15 HH TYR 15 -14.646 12.271 -10.049
118 H GLN 16 H GLN 16 -17.222 13.983 -4.376
119 HA GLN 16 HA GLN 16 -17.259 12.752 -1.724
120 HB2 GLN 16 HB2 GLN 16 -19.267 13.621 -3.611
121 HB3 GLN 16 HB3 GLN 16 -19.532 11.943 -3.157
122 HG2 GLN 16 HG2 GLN 16 -20.581 12.715 -1.367
123 HG3 GLN 16 HG3 GLN 16 -18.997 13.189 -0.755
124 HE21 GLN 16 HE21 GLN 16 -19.676 14.981 0.336
125 HE22 GLN 16 HE22 GLN 16 -20.289 16.396 -0.442
126 H GLU 17 H GLU 17 -16.616 12.006 -5.017
127 HA GLU 17 HA GLU 17 -15.917 10.108 -6.057
128 HB2 GLU 17 HB2 GLU 17 -15.720 8.894 -3.299
129 HB3 GLU 17 HB3 GLU 17 -14.887 8.366 -4.754
130 HG2 GLU 17 HG2 GLU 17 -14.462 11.004 -3.370
131 HG3 GLU 17 HG3 GLU 17 -13.422 9.589 -3.217
132 H LYS 18 H LYS 18 -16.347 7.405 -5.448
133 HA LYS 18 HA LYS 18 -18.996 6.796 -4.718
134 HB2 LYS 18 HB2 LYS 18 -18.623 7.750 -7.434
135 HB3 LYS 18 HB3 LYS 18 -19.261 6.111 -7.412
136 HG2 LYS 18 HG2 LYS 18 -21.279 6.823 -6.837
137 HG3 LYS 18 HG3 LYS 18 -20.632 7.777 -5.500
138 HD2 LYS 18 HD2 LYS 18 -20.533 9.690 -6.735
139 HD3 LYS 18 HD3 LYS 18 -20.230 8.828 -8.245
140 HE2 LYS 18 HE2 LYS 18 -22.612 8.051 -8.169
141 HE3 LYS 18 HE3 LYS 18 -22.857 9.134 -6.800
142 HZ1 LYS 18 HZ1 LYS 18 -23.521 10.411 -8.578
143 HZ2 LYS 18 HZ2 LYS 18 -21.912 10.902 -8.401
144 HZ3 LYS 18 HZ3 LYS 18 -22.333 9.804 -9.618
145 H SER 19 H SER 19 -16.175 5.970 -6.642
146 HA SER 19 HA SER 19 -16.734 3.122 -6.432
147 HB2 SER 19 HB2 SER 19 -15.137 4.799 -8.155
148 HB3 SER 19 HB3 SER 19 -14.150 3.499 -7.486
149 HG SER 19 HG SER 19 -16.695 2.999 -8.603
150 HA PRO 20 HA PRO 20 -14.220 2.264 -2.942
151 HB2 PRO 20 HB2 PRO 20 -13.063 -0.092 -3.635
152 HB3 PRO 20 HB3 PRO 20 -14.774 0.050 -3.214
153 HG2 PRO 20 HG2 PRO 20 -13.492 -0.074 -5.917
154 HG3 PRO 20 HG3 PRO 20 -14.954 -0.889 -5.334
155 HD2 PRO 20 HD2 PRO 20 -15.042 1.351 -6.852
156 HD3 PRO 20 HD3 PRO 20 -16.265 0.986 -5.618
157 H ARG 21 H ARG 21 -12.710 2.410 -6.079
158 HA ARG 21 HA ARG 21 -10.031 2.517 -4.940
159 HB2 ARG 21 HB2 ARG 21 -9.237 2.522 -7.217
160 HB3 ARG 21 HB3 ARG 21 -10.465 1.274 -7.050
161 HG2 ARG 21 HG2 ARG 21 -11.493 3.878 -7.910
162 HG3 ARG 21 HG3 ARG 21 -10.376 3.112 -9.042
163 HD2 ARG 21 HD2 ARG 21 -12.934 1.977 -7.929
164 HD3 ARG 21 HD3 ARG 21 -12.592 2.415 -9.602
165 HE ARG 21 HE ARG 21 -10.722 0.538 -9.057
166 HH11 ARG 21 HH11 ARG 21 -14.184 0.640 -8.712
167 HH12 ARG 21 HH12 ARG 21 -14.390 -1.063 -8.955
168 HH21 ARG 21 HH21 ARG 21 -10.979 -1.706 -9.378
169 HH22 ARG 21 HH22 ARG 21 -12.566 -2.397 -9.332
170 H GLU 22 H GLU 22 -12.253 4.627 -4.675
171 HA GLU 22 HA GLU 22 -10.695 6.921 -5.668
172 HB2 GLU 22 HB2 GLU 22 -13.639 6.522 -5.243
173 HB3 GLU 22 HB3 GLU 22 -12.952 8.140 -5.231
174 HG2 GLU 22 HG2 GLU 22 -12.043 7.743 -7.484
175 HG3 GLU 22 HG3 GLU 22 -12.818 6.160 -7.493
176 H VAL 23 H VAL 23 -10.763 8.872 -4.297
177 HA VAL 23 HA VAL 23 -10.907 8.189 -1.432
178 HB VAL 23 HB VAL 23 -8.811 9.728 -2.929
179 HG11 VAL 23 HG11 VAL 23 -8.943 11.315 -1.340
180 HG12 VAL 23 HG12 VAL 23 -9.856 10.283 -0.239
181 HG13 VAL 23 HG13 VAL 23 -8.103 10.126 -0.346
182 HG21 VAL 23 HG21 VAL 23 -7.424 8.086 -2.288
183 HG22 VAL 23 HG22 VAL 23 -8.094 8.026 -0.657
184 HG23 VAL 23 HG23 VAL 23 -8.900 7.173 -1.973
185 H THR 24 H THR 24 -12.571 9.232 -0.567
186 HA THR 24 HA THR 24 -13.686 11.605 -1.702
187 HB THR 24 HB THR 24 -14.251 10.311 0.973
188 HG1 THR 24 HG1 THR 24 -16.221 9.740 -0.433
189 HG21 THR 24 HG21 THR 24 -16.440 11.772 -0.189
190 HG22 THR 24 HG22 THR 24 -15.686 11.964 1.394
191 HG23 THR 24 HG23 THR 24 -15.036 12.823 -0.003
192 H MET 25 H MET 25 -13.054 13.630 -1.385
193 HA MET 25 HA MET 25 -11.693 14.310 1.134
194 HB2 MET 25 HB2 MET 25 -10.082 15.645 0.002
195 HB3 MET 25 HB3 MET 25 -10.106 14.089 -0.816
196 HG2 MET 25 HG2 MET 25 -11.970 15.957 -2.000
197 HG3 MET 25 HG3 MET 25 -10.323 16.583 -1.985
198 HE1 MET 25 HE1 MET 25 -8.677 15.052 -4.817
199 HE2 MET 25 HE2 MET 25 -9.799 16.413 -4.796
200 HE3 MET 25 HE3 MET 25 -8.686 16.167 -3.450
201 H LYS 26 H LYS 26 -11.942 16.482 1.841
202 HA LYS 26 HA LYS 26 -14.281 17.830 0.661
203 HB2 LYS 26 HB2 LYS 26 -13.390 17.445 3.489
204 HB3 LYS 26 HB3 LYS 26 -14.302 18.891 3.078
205 HG2 LYS 26 HG2 LYS 26 -15.542 16.524 1.984
206 HG3 LYS 26 HG3 LYS 26 -15.325 16.397 3.731
207 HD2 LYS 26 HD2 LYS 26 -16.647 18.261 4.157
208 HD3 LYS 26 HD3 LYS 26 -16.456 18.891 2.519
209 HE2 LYS 26 HE2 LYS 26 -17.887 16.309 3.075
210 HE3 LYS 26 HE3 LYS 26 -18.714 17.864 3.142
211 HZ1 LYS 26 HZ1 LYS 26 -17.863 16.341 0.859
212 HZ2 LYS 26 HZ2 LYS 26 -19.034 17.556 0.971
213 HZ3 LYS 26 HZ3 LYS 26 -17.405 17.967 0.776
214 H LYS 27 H LYS 27 -13.995 19.801 -0.149
215 HA LYS 27 HA LYS 27 -11.641 21.027 -0.657
216 HB2 LYS 27 HB2 LYS 27 -13.931 21.716 -1.469
217 HB3 LYS 27 HB3 LYS 27 -14.134 22.580 0.049
218 HG2 LYS 27 HG2 LYS 27 -12.148 23.938 -0.494
219 HG3 LYS 27 HG3 LYS 27 -12.041 23.111 -2.050
220 HD2 LYS 27 HD2 LYS 27 -13.196 25.058 -2.572
221 HD3 LYS 27 HD3 LYS 27 -14.491 23.877 -2.361
222 HE2 LYS 27 HE2 LYS 27 -15.278 25.671 -1.141
223 HE3 LYS 27 HE3 LYS 27 -14.484 24.706 0.103
224 HZ1 LYS 27 HZ1 LYS 27 -12.594 26.131 0.037
225 HZ2 LYS 27 HZ2 LYS 27 -13.188 26.975 -1.304
226 HZ3 LYS 27 HZ3 LYS 27 -13.963 27.114 0.194
227 H GLY 28 H GLY 28 -10.046 21.294 0.795
228 HA2 GLY 28 HA2 GLY 28 -9.092 22.901 2.334
229 HA3 GLY 28 HA3 GLY 28 -10.651 22.974 3.142
230 H ASP 29 H ASP 29 -9.185 19.967 2.123
231 HA ASP 29 HA ASP 29 -8.573 19.349 4.936
232 HB2 ASP 29 HB2 ASP 29 -9.804 17.447 4.922
233 HB3 ASP 29 HB3 ASP 29 -10.676 18.251 3.619
234 H ILE 30 H ILE 30 -6.998 17.603 5.221
235 HA ILE 30 HA ILE 30 -5.014 17.627 3.049
236 HB ILE 30 HB ILE 30 -4.787 17.949 5.912
237 HG12 ILE 30 HG12 ILE 30 -3.810 19.289 3.927
238 HG13 ILE 30 HG13 ILE 30 -2.799 19.054 5.349
239 HG21 ILE 30 HG21 ILE 30 -2.774 16.532 6.208
240 HG22 ILE 30 HG22 ILE 30 -4.258 15.604 5.988
241 HG23 ILE 30 HG23 ILE 30 -3.120 15.778 4.651
242 HD11 ILE 30 HD11 ILE 30 -1.826 18.701 2.966
243 HD12 ILE 30 HD12 ILE 30 -1.392 17.599 4.272
244 HD13 ILE 30 HD13 ILE 30 -2.610 17.126 3.088
245 H LEU 31 H LEU 31 -4.098 15.742 2.316
246 HA LEU 31 HA LEU 31 -5.112 13.224 3.443
247 HB2 LEU 31 HB2 LEU 31 -4.839 12.665 0.774
248 HB3 LEU 31 HB3 LEU 31 -6.357 12.966 1.617
249 HG LEU 31 HG LEU 31 -4.850 15.260 0.435
250 HD11 LEU 31 HD11 LEU 31 -5.655 14.923 -1.709
251 HD12 LEU 31 HD12 LEU 31 -5.143 13.305 -1.230
252 HD13 LEU 31 HD13 LEU 31 -6.852 13.739 -1.185
253 HD21 LEU 31 HD21 LEU 31 -7.432 15.749 -0.004
254 HD22 LEU 31 HD22 LEU 31 -7.596 14.649 1.365
255 HD23 LEU 31 HD23 LEU 31 -6.643 16.124 1.528
256 H THR 32 H THR 32 -3.810 11.333 2.852
257 HA THR 32 HA THR 32 -0.972 12.054 2.717
258 HB THR 32 HB THR 32 -1.971 9.294 3.345
259 HG1 THR 32 HG1 THR 32 -3.088 10.477 4.834
260 HG21 THR 32 HG21 THR 32 0.353 10.731 4.581
261 HG22 THR 32 HG22 THR 32 0.092 8.998 4.384
262 HG23 THR 32 HG23 THR 32 0.498 9.992 2.986
263 H LEU 33 H LEU 33 -0.093 11.980 0.759
264 HA LEU 33 HA LEU 33 -1.205 10.604 -1.442
265 HB2 LEU 33 HB2 LEU 33 1.303 12.092 -0.897
266 HB3 LEU 33 HB3 LEU 33 1.283 11.018 -2.295
267 HG LEU 33 HG LEU 33 0.757 13.451 -2.734
268 HD11 LEU 33 HD11 LEU 33 -0.021 11.242 -4.016
269 HD12 LEU 33 HD12 LEU 33 -1.605 11.899 -3.603
270 HD13 LEU 33 HD13 LEU 33 -0.468 12.864 -4.544
271 HD21 LEU 33 HD21 LEU 33 -1.588 14.124 -2.291
272 HD22 LEU 33 HD22 LEU 33 -1.779 12.682 -1.294
273 HD23 LEU 33 HD23 LEU 33 -0.626 13.932 -0.826
274 H LEU 34 H LEU 34 -0.594 8.720 -2.478
275 HA LEU 34 HA LEU 34 1.180 6.940 -0.939
276 HB2 LEU 34 HB2 LEU 34 -1.512 6.559 -2.022
277 HB3 LEU 34 HB3 LEU 34 -0.390 5.258 -2.417
278 HG LEU 34 HG LEU 34 -0.439 6.070 0.415
279 HD11 LEU 34 HD11 LEU 34 -2.689 6.135 0.491
280 HD12 LEU 34 HD12 LEU 34 -2.875 5.256 -1.027
281 HD13 LEU 34 HD13 LEU 34 -2.531 4.378 0.463
282 HD21 LEU 34 HD21 LEU 34 -0.578 3.519 0.579
283 HD22 LEU 34 HD22 LEU 34 -0.323 3.522 -1.166
284 HD23 LEU 34 HD23 LEU 34 0.894 4.218 -0.096
285 H ASN 35 H ASN 35 -0.238 7.207 -4.206
286 HA ASN 35 HA ASN 35 2.158 6.030 -5.353
287 HB2 ASN 35 HB2 ASN 35 -0.017 5.304 -6.201
288 HB3 ASN 35 HB3 ASN 35 -0.412 6.960 -6.652
289 HD21 ASN 35 HD21 ASN 35 2.620 5.192 -7.032
290 HD22 ASN 35 HD22 ASN 35 2.669 5.295 -8.756
291 H SER 36 H SER 36 0.213 8.851 -6.333
292 HA SER 36 HA SER 36 0.800 10.943 -7.014
293 HB2 SER 36 HB2 SER 36 2.839 10.228 -5.079
294 HB3 SER 36 HB3 SER 36 3.494 11.276 -6.337
295 HG SER 36 HG SER 36 1.858 12.766 -5.878
296 H THR 37 H THR 37 1.531 8.352 -8.474
297 HA THR 37 HA THR 37 3.645 9.364 -10.235
298 HB THR 37 HB THR 37 2.367 6.623 -10.144
299 HG1 THR 37 HG1 THR 37 3.781 7.282 -8.340
300 HG21 THR 37 HG21 THR 37 4.176 5.943 -11.631
301 HG22 THR 37 HG22 THR 37 3.218 7.224 -12.374
302 HG23 THR 37 HG23 THR 37 4.789 7.596 -11.666
303 H ASN 38 H ASN 38 0.255 8.480 -10.190
304 HA ASN 38 HA ASN 38 0.014 9.035 -13.053
305 HB2 ASN 38 HB2 ASN 38 -1.107 7.028 -12.380
306 HB3 ASN 38 HB3 ASN 38 -1.904 7.850 -11.042
307 HD21 ASN 38 HD21 ASN 38 -1.497 8.779 -14.432
308 HD22 ASN 38 HD22 ASN 38 -3.185 8.906 -14.779
309 H LYS 39 H LYS 39 0.032 11.206 -13.328
310 HA LYS 39 HA LYS 39 -0.881 13.186 -11.667
311 HB2 LYS 39 HB2 LYS 39 0.365 13.757 -13.629
312 HB3 LYS 39 HB3 LYS 39 -0.861 13.065 -14.683
313 HG2 LYS 39 HG2 LYS 39 -2.432 14.816 -13.980
314 HG3 LYS 39 HG3 LYS 39 -1.170 15.522 -12.968
315 HD2 LYS 39 HD2 LYS 39 0.077 16.226 -14.792
316 HD3 LYS 39 HD3 LYS 39 -0.675 15.059 -15.883
317 HE2 LYS 39 HE2 LYS 39 -2.775 16.648 -14.984
318 HE3 LYS 39 HE3 LYS 39 -1.449 17.776 -15.258
319 HZ1 LYS 39 HZ1 LYS 39 -3.107 16.557 -17.155
320 HZ2 LYS 39 HZ2 LYS 39 -1.841 17.650 -17.418
321 HZ3 LYS 39 HZ3 LYS 39 -1.534 15.986 -17.406
322 H ASP 40 H ASP 40 -2.743 11.559 -14.228
323 HA ASP 40 HA ASP 40 -5.135 12.888 -14.012
324 HB2 ASP 40 HB2 ASP 40 -4.986 9.894 -14.346
325 HB3 ASP 40 HB3 ASP 40 -6.173 11.006 -15.023
326 H TRP 41 H TRP 41 -4.020 10.140 -12.065
327 HA TRP 41 HA TRP 41 -5.895 10.942 -9.968
328 HB2 TRP 41 HB2 TRP 41 -5.774 8.231 -11.269
329 HB3 TRP 41 HB3 TRP 41 -6.355 8.426 -9.617
330 HD1 TRP 41 HD1 TRP 41 -7.329 9.114 -13.237
331 HE1 TRP 41 HE1 TRP 41 -9.813 9.785 -13.316
332 HE3 TRP 41 HE3 TRP 41 -8.214 9.544 -8.220
333 HZ2 TRP 41 HZ2 TRP 41 -11.874 10.414 -11.493
334 HZ3 TRP 41 HZ3 TRP 41 -10.468 10.185 -7.471
335 HH2 TRP 41 HH2 TRP 41 -12.259 10.611 -9.075
336 H TRP 42 H TRP 42 -4.742 11.238 -8.189
337 HA TRP 42 HA TRP 42 -2.234 9.766 -7.845
338 HB2 TRP 42 HB2 TRP 42 -3.332 12.296 -6.641
339 HB3 TRP 42 HB3 TRP 42 -1.960 11.462 -5.917
340 HD1 TRP 42 HD1 TRP 42 -0.750 10.664 -8.918
341 HE1 TRP 42 HE1 TRP 42 0.545 12.508 -10.162
342 HE3 TRP 42 HE3 TRP 42 -2.552 14.746 -6.422
343 HZ2 TRP 42 HZ2 TRP 42 0.772 15.320 -10.094
344 HZ3 TRP 42 HZ3 TRP 42 -1.744 16.977 -7.073
345 HH2 TRP 42 HH2 TRP 42 -0.116 17.256 -8.871
346 H LYS 43 H LYS 43 -2.514 7.875 -6.843
347 HA LYS 43 HA LYS 43 -4.619 7.196 -5.136
348 HB2 LYS 43 HB2 LYS 43 -3.279 5.498 -6.229
349 HB3 LYS 43 HB3 LYS 43 -1.843 6.019 -5.357
350 HG2 LYS 43 HG2 LYS 43 -3.461 5.471 -3.285
351 HG3 LYS 43 HG3 LYS 43 -4.089 4.330 -4.477
352 HD2 LYS 43 HD2 LYS 43 -1.170 4.414 -4.358
353 HD3 LYS 43 HD3 LYS 43 -1.925 3.906 -2.845
354 HE2 LYS 43 HE2 LYS 43 -2.227 1.882 -3.706
355 HE3 LYS 43 HE3 LYS 43 -3.287 2.581 -4.930
356 HZ1 LYS 43 HZ1 LYS 43 -1.512 1.346 -5.965
357 HZ2 LYS 43 HZ2 LYS 43 -1.324 2.992 -6.308
358 HZ3 LYS 43 HZ3 LYS 43 -0.343 2.253 -5.145
359 H VAL 44 H VAL 44 -5.022 7.571 -3.051
360 HA VAL 44 HA VAL 44 -2.826 8.289 -1.256
361 HB VAL 44 HB VAL 44 -3.955 10.214 -0.362
362 HG11 VAL 44 HG11 VAL 44 -3.351 11.668 -1.997
363 HG12 VAL 44 HG12 VAL 44 -2.676 10.201 -2.705
364 HG13 VAL 44 HG13 VAL 44 -4.242 10.803 -3.249
365 HG21 VAL 44 HG21 VAL 44 -6.254 9.471 -0.607
366 HG22 VAL 44 HG22 VAL 44 -6.047 11.063 -1.337
367 HG23 VAL 44 HG23 VAL 44 -6.139 9.629 -2.360
368 H GLU 45 H GLU 45 -3.685 8.478 1.063
369 HA GLU 45 HA GLU 45 -5.775 6.445 1.492
370 HB2 GLU 45 HB2 GLU 45 -3.727 5.408 2.091
371 HB3 GLU 45 HB3 GLU 45 -3.157 6.846 2.927
372 HG2 GLU 45 HG2 GLU 45 -4.733 6.525 4.695
373 HG3 GLU 45 HG3 GLU 45 -5.512 5.206 3.823
374 H VAL 46 H VAL 46 -7.449 7.074 2.685
375 HA VAL 46 HA VAL 46 -7.108 9.195 4.670
376 HB VAL 46 HB VAL 46 -9.302 10.210 3.858
377 HG11 VAL 46 HG11 VAL 46 -6.830 10.999 3.479
378 HG12 VAL 46 HG12 VAL 46 -7.186 10.608 1.796
379 HG13 VAL 46 HG13 VAL 46 -8.166 11.800 2.651
380 HG21 VAL 46 HG21 VAL 46 -8.567 8.963 1.226
381 HG22 VAL 46 HG22 VAL 46 -9.728 8.214 2.321
382 HG23 VAL 46 HG23 VAL 46 -10.044 9.821 1.666
383 H ASN 47 H ASN 47 -8.196 8.800 6.497
384 HA ASN 47 HA ASN 47 -9.311 7.496 8.026
385 HB2 ASN 47 HB2 ASN 47 -11.831 7.310 7.288
386 HB3 ASN 47 HB3 ASN 47 -11.130 8.879 7.673
387 HD21 ASN 47 HD21 ASN 47 -12.201 6.764 5.124
388 HD22 ASN 47 HD22 ASN 47 -12.296 7.971 3.892
389 H ASP 48 H ASP 48 -7.895 5.654 7.199
390 HA ASP 48 HA ASP 48 -7.611 3.513 6.419
391 HB2 ASP 48 HB2 ASP 48 -9.331 3.587 8.539
392 HB3 ASP 48 HB3 ASP 48 -10.278 2.687 7.357
393 H ARG 49 H ARG 49 -8.713 5.236 4.436
394 HA ARG 49 HA ARG 49 -9.993 3.222 2.761
395 HB2 ARG 49 HB2 ARG 49 -11.363 5.533 3.853
396 HB3 ARG 49 HB3 ARG 49 -11.354 5.570 2.095
397 HG2 ARG 49 HG2 ARG 49 -12.207 3.146 3.647
398 HG3 ARG 49 HG3 ARG 49 -13.325 4.439 3.207
399 HD2 ARG 49 HD2 ARG 49 -11.838 3.737 0.893
400 HD3 ARG 49 HD3 ARG 49 -12.425 2.248 1.632
401 HE ARG 49 HE ARG 49 -14.422 4.309 1.375
402 HH11 ARG 49 HH11 ARG 49 -12.858 1.603 -0.159
403 HH12 ARG 49 HH12 ARG 49 -14.181 1.278 -1.229
404 HH21 ARG 49 HH21 ARG 49 -16.170 3.892 -0.030
405 HH22 ARG 49 HH22 ARG 49 -16.064 2.582 -1.156
406 H GLN 50 H GLN 50 -7.958 3.209 1.701
407 HA GLN 50 HA GLN 50 -7.122 5.662 0.364
408 HB2 GLN 50 HB2 GLN 50 -5.071 4.610 -0.060
409 HB3 GLN 50 HB3 GLN 50 -5.529 4.020 1.532
410 HG2 GLN 50 HG2 GLN 50 -5.129 1.989 0.738
411 HG3 GLN 50 HG3 GLN 50 -6.637 2.160 -0.157
412 HE21 GLN 50 HE21 GLN 50 -3.165 2.758 -0.360
413 HE22 GLN 50 HE22 GLN 50 -3.046 2.541 -2.070
414 H GLY 51 H GLY 51 -6.894 5.843 -1.890
415 HA2 GLY 51 HA2 GLY 51 -7.711 3.746 -3.662
416 HA3 GLY 51 HA3 GLY 51 -8.962 4.965 -3.464
417 H PHE 52 H PHE 52 -8.907 6.662 -4.782
418 HA PHE 52 HA PHE 52 -6.350 7.517 -5.919
419 HB2 PHE 52 HB2 PHE 52 -8.790 6.724 -7.508
420 HB3 PHE 52 HB3 PHE 52 -7.507 7.729 -8.173
421 HD1 PHE 52 HD1 PHE 52 -8.692 4.632 -8.436
422 HD2 PHE 52 HD2 PHE 52 -5.071 6.550 -7.284
423 HE1 PHE 52 HE1 PHE 52 -7.430 2.608 -9.043
424 HE2 PHE 52 HE2 PHE 52 -3.804 4.531 -7.890
425 HZ PHE 52 HZ PHE 52 -4.983 2.556 -8.771
426 H VAL 53 H VAL 53 -6.132 9.651 -5.813
427 HA VAL 53 HA VAL 53 -8.556 11.281 -5.430
428 HB VAL 53 HB VAL 53 -6.363 11.126 -3.794
429 HG11 VAL 53 HG11 VAL 53 -5.083 13.147 -4.016
430 HG12 VAL 53 HG12 VAL 53 -5.007 12.263 -5.540
431 HG13 VAL 53 HG13 VAL 53 -6.062 13.668 -5.387
432 HG21 VAL 53 HG21 VAL 53 -8.788 12.406 -3.837
433 HG22 VAL 53 HG22 VAL 53 -7.622 12.465 -2.515
434 HG23 VAL 53 HG23 VAL 53 -7.648 13.747 -3.726
435 HA PRO 54 HA PRO 54 -7.742 13.204 -9.321
436 HB2 PRO 54 HB2 PRO 54 -9.302 15.400 -8.987
437 HB3 PRO 54 HB3 PRO 54 -9.963 13.793 -9.312
438 HG2 PRO 54 HG2 PRO 54 -9.702 15.243 -6.706
439 HG3 PRO 54 HG3 PRO 54 -11.064 14.290 -7.324
440 HD2 PRO 54 HD2 PRO 54 -9.293 13.305 -5.528
441 HD3 PRO 54 HD3 PRO 54 -10.086 12.284 -6.745
442 H ALA 55 H ALA 55 -5.853 14.154 -9.743
443 HA ALA 55 HA ALA 55 -4.446 15.824 -7.977
444 HB1 ALA 55 HB1 ALA 55 -3.411 14.498 -9.793
445 HB2 ALA 55 HB2 ALA 55 -4.089 15.628 -10.964
446 HB3 ALA 55 HB3 ALA 55 -2.899 16.185 -9.788
447 H ALA 56 H ALA 56 -6.089 16.670 -11.032
448 HA ALA 56 HA ALA 56 -5.748 19.387 -11.014
449 HB1 ALA 56 HB1 ALA 56 -8.234 17.910 -11.871
450 HB2 ALA 56 HB2 ALA 56 -7.782 19.545 -12.354
451 HB3 ALA 56 HB3 ALA 56 -6.795 18.172 -12.855
452 H TYR 57 H TYR 57 -7.998 17.482 -9.112
453 HA TYR 57 HA TYR 57 -9.202 19.899 -7.994
454 HB2 TYR 57 HB2 TYR 57 -9.881 16.969 -7.728
455 HB3 TYR 57 HB3 TYR 57 -10.683 18.228 -6.795
456 HD1 TYR 57 HD1 TYR 57 -11.022 16.227 -9.580
457 HD2 TYR 57 HD2 TYR 57 -11.475 20.289 -8.397
458 HE1 TYR 57 HE1 TYR 57 -12.599 16.585 -11.433
459 HE2 TYR 57 HE2 TYR 57 -13.054 20.658 -10.246
460 HH TYR 57 HH TYR 57 -13.361 19.316 -12.698
461 H VAL 58 H VAL 58 -6.503 19.534 -7.377
462 HA VAL 58 HA VAL 58 -6.677 19.348 -4.476
463 HB VAL 58 HB VAL 58 -5.809 17.132 -5.762
464 HG11 VAL 58 HG11 VAL 58 -3.474 17.012 -5.914
465 HG12 VAL 58 HG12 VAL 58 -3.885 18.561 -6.650
466 HG13 VAL 58 HG13 VAL 58 -3.250 18.507 -5.005
467 HG21 VAL 58 HG21 VAL 58 -6.274 17.504 -3.325
468 HG22 VAL 58 HG22 VAL 58 -4.924 16.421 -3.665
469 HG23 VAL 58 HG23 VAL 58 -4.617 18.084 -3.164
470 H LYS 59 H LYS 59 -4.504 19.996 -3.480
471 HA LYS 59 HA LYS 59 -2.828 21.685 -5.117
472 HB2 LYS 59 HB2 LYS 59 -5.062 22.801 -3.724
473 HB3 LYS 59 HB3 LYS 59 -3.585 23.367 -2.955
474 HG2 LYS 59 HG2 LYS 59 -2.795 24.321 -4.979
475 HG3 LYS 59 HG3 LYS 59 -4.067 23.535 -5.918
476 HD2 LYS 59 HD2 LYS 59 -5.745 24.864 -4.662
477 HD3 LYS 59 HD3 LYS 59 -4.422 25.708 -3.853
478 HE2 LYS 59 HE2 LYS 59 -4.103 27.054 -5.601
479 HE3 LYS 59 HE3 LYS 59 -4.087 25.699 -6.729
480 HZ1 LYS 59 HZ1 LYS 59 -6.046 26.405 -7.445
481 HZ2 LYS 59 HZ2 LYS 59 -6.715 26.011 -5.942
482 HZ3 LYS 59 HZ3 LYS 59 -6.147 27.578 -6.231
483 H LYS 60 H LYS 60 -0.866 21.131 -4.458
484 HA LYS 60 HA LYS 60 -0.296 19.917 -1.978
485 HB2 LYS 60 HB2 LYS 60 1.017 19.970 -4.276
486 HB3 LYS 60 HB3 LYS 60 1.849 21.318 -3.512
487 HG2 LYS 60 HG2 LYS 60 1.633 18.534 -2.384
488 HG3 LYS 60 HG3 LYS 60 3.041 19.206 -3.210
489 HD2 LYS 60 HD2 LYS 60 2.683 21.097 -1.346
490 HD3 LYS 60 HD3 LYS 60 2.010 19.713 -0.482
491 HE2 LYS 60 HE2 LYS 60 4.264 19.693 0.110
492 HE3 LYS 60 HE3 LYS 60 4.160 18.493 -1.177
493 HZ1 LYS 60 HZ1 LYS 60 5.220 19.871 -2.668
494 HZ2 LYS 60 HZ2 LYS 60 4.841 21.285 -1.820
495 HZ3 LYS 60 HZ3 LYS 60 6.035 20.240 -1.232
496 H LEU 61 H LEU 61 -1.016 21.209 -0.292
497 HA LEU 61 HA LEU 61 0.516 23.691 0.127
498 HB2 LEU 61 HB2 LEU 61 -2.218 23.120 1.243
499 HB3 LEU 61 HB3 LEU 61 -1.339 24.648 1.273
500 HG LEU 61 HG LEU 61 -2.145 23.425 -1.338
501 HD11 LEU 61 HD11 LEU 61 -4.304 23.629 -0.879
502 HD12 LEU 61 HD12 LEU 61 -3.950 24.274 0.724
503 HD13 LEU 61 HD13 LEU 61 -4.054 25.361 -0.661
504 HD21 LEU 61 HD21 LEU 61 -2.015 25.655 -2.133
505 HD22 LEU 61 HD22 LEU 61 -1.930 26.307 -0.496
506 HD23 LEU 61 HD23 LEU 61 -0.576 25.386 -1.150
507 H ASP 62 H ASP 62 1.848 21.634 0.960
508 HA ASP 62 HA ASP 62 1.709 21.820 3.849
509 HB2 ASP 62 HB2 ASP 62 0.425 19.689 2.692
510 HB3 ASP 62 HB3 ASP 62 2.027 19.025 3.002
Start of MODEL 2
1 H1 MET 1 H MET 1 1.808 -0.000 0.855
2 HA MET 1 HA MET 1 2.743 -0.862 -1.230
3 HB2 MET 1 HB2 MET 1 0.307 0.548 -2.283
4 HB3 MET 1 HB3 MET 1 1.681 0.216 -3.329
5 HG2 MET 1 HG2 MET 1 1.171 -2.197 -2.053
6 HG3 MET 1 HG3 MET 1 -0.420 -1.539 -2.428
7 HE1 MET 1 HE1 MET 1 0.552 -4.402 -4.374
8 HE2 MET 1 HE2 MET 1 2.180 -3.932 -4.863
9 HE3 MET 1 HE3 MET 1 1.714 -3.861 -3.163
10 H ASP 2 H ASP 2 1.331 2.349 -1.802
11 HA ASP 2 HA ASP 2 2.259 4.433 -1.861
12 HB2 ASP 2 HB2 ASP 2 4.834 3.389 -0.727
13 HB3 ASP 2 HB3 ASP 2 4.076 4.961 -0.495
14 H GLU 3 H GLU 3 5.092 2.315 -2.316
15 HA GLU 3 HA GLU 3 6.591 2.131 -4.017
16 HB2 GLU 3 HB2 GLU 3 4.179 1.684 -5.123
17 HB3 GLU 3 HB3 GLU 3 4.668 3.089 -6.060
18 HG2 GLU 3 HG2 GLU 3 6.761 1.077 -5.825
19 HG3 GLU 3 HG3 GLU 3 5.301 0.486 -6.617
20 H THR 4 H THR 4 6.458 4.626 -2.636
21 HA THR 4 HA THR 4 7.890 6.260 -4.537
22 HB THR 4 HB THR 4 5.350 7.297 -3.267
23 HG1 THR 4 HG1 THR 4 6.128 6.603 -5.887
24 HG21 THR 4 HG21 THR 4 6.326 9.206 -5.032
25 HG22 THR 4 HG22 THR 4 6.353 9.295 -3.271
26 HG23 THR 4 HG23 THR 4 7.752 8.669 -4.144
27 H GLY 5 H GLY 5 6.195 7.128 -1.535
28 HA2 GLY 5 HA2 GLY 5 8.161 6.740 0.331
29 HA3 GLY 5 HA3 GLY 5 8.584 8.267 -0.430
30 H LYS 6 H LYS 6 7.117 10.039 -0.263
31 HA LYS 6 HA LYS 6 4.806 9.823 1.440
32 HB2 LYS 6 HB2 LYS 6 5.722 11.566 3.054
33 HB3 LYS 6 HB3 LYS 6 6.350 9.932 3.223
34 HG2 LYS 6 HG2 LYS 6 7.919 11.607 1.420
35 HG3 LYS 6 HG3 LYS 6 7.853 12.206 3.079
36 HD2 LYS 6 HD2 LYS 6 8.324 9.629 3.589
37 HD3 LYS 6 HD3 LYS 6 9.071 9.730 1.993
38 HE2 LYS 6 HE2 LYS 6 10.718 10.169 3.716
39 HE3 LYS 6 HE3 LYS 6 10.428 11.627 2.768
40 HZ1 LYS 6 HZ1 LYS 6 10.280 11.368 5.509
41 HZ2 LYS 6 HZ2 LYS 6 9.807 12.704 4.586
42 HZ3 LYS 6 HZ3 LYS 6 8.675 11.515 4.993
43 H GLU 7 H GLU 7 3.593 11.813 1.565
44 HA GLU 7 HA GLU 7 4.326 14.223 0.371
45 HB2 GLU 7 HB2 GLU 7 3.582 12.151 -1.512
46 HB3 GLU 7 HB3 GLU 7 2.488 13.523 -1.615
47 HG2 GLU 7 HG2 GLU 7 5.166 14.486 -1.465
48 HG3 GLU 7 HG3 GLU 7 5.063 13.253 -2.721
49 H LEU 8 H LEU 8 2.610 15.754 0.310
50 HA LEU 8 HA LEU 8 0.034 14.834 1.371
51 HB2 LEU 8 HB2 LEU 8 2.013 16.329 2.800
52 HB3 LEU 8 HB3 LEU 8 0.580 17.329 2.565
53 HG LEU 8 HG LEU 8 -0.790 15.785 3.751
54 HD11 LEU 8 HD11 LEU 8 -0.044 13.681 2.996
55 HD12 LEU 8 HD12 LEU 8 1.589 13.954 3.603
56 HD13 LEU 8 HD13 LEU 8 0.258 13.703 4.733
57 HD21 LEU 8 HD21 LEU 8 0.252 17.166 5.301
58 HD22 LEU 8 HD22 LEU 8 0.578 15.550 5.927
59 HD23 LEU 8 HD23 LEU 8 1.832 16.425 5.049
60 H VAL 9 H VAL 9 -1.737 16.174 0.895
61 HA VAL 9 HA VAL 9 -1.289 18.527 -0.764
62 HB VAL 9 HB VAL 9 -2.738 17.781 -2.559
63 HG11 VAL 9 HG11 VAL 9 -0.510 15.838 -1.965
64 HG12 VAL 9 HG12 VAL 9 -1.296 16.021 -3.533
65 HG13 VAL 9 HG13 VAL 9 -0.380 17.361 -2.844
66 HG21 VAL 9 HG21 VAL 9 -2.927 15.232 -0.966
67 HG22 VAL 9 HG22 VAL 9 -4.238 16.314 -1.434
68 HG23 VAL 9 HG23 VAL 9 -3.402 15.360 -2.659
69 H LEU 10 H LEU 10 -3.434 19.582 -1.326
70 HA LEU 10 HA LEU 10 -5.316 19.229 0.914
71 HB2 LEU 10 HB2 LEU 10 -4.186 21.668 -0.371
72 HB3 LEU 10 HB3 LEU 10 -5.818 21.736 0.292
73 HG LEU 10 HG LEU 10 -4.023 22.585 1.810
74 HD11 LEU 10 HD11 LEU 10 -5.035 21.752 3.737
75 HD12 LEU 10 HD12 LEU 10 -6.282 21.587 2.501
76 HD13 LEU 10 HD13 LEU 10 -5.349 20.178 3.007
77 HD21 LEU 10 HD21 LEU 10 -2.532 21.063 2.885
78 HD22 LEU 10 HD22 LEU 10 -3.270 19.680 2.076
79 HD23 LEU 10 HD23 LEU 10 -2.344 20.856 1.144
80 H ALA 11 H ALA 11 -7.495 19.263 0.491
81 HA ALA 11 HA ALA 11 -8.328 18.478 -2.102
82 HB1 ALA 11 HB1 ALA 11 -10.663 18.858 -1.037
83 HB2 ALA 11 HB2 ALA 11 -9.626 17.575 -0.414
84 HB3 ALA 11 HB3 ALA 11 -9.750 19.107 0.452
85 H LEU 12 H LEU 12 -8.354 19.841 -3.771
86 HA LEU 12 HA LEU 12 -8.816 22.664 -3.424
87 HB2 LEU 12 HB2 LEU 12 -7.231 21.589 -5.092
88 HB3 LEU 12 HB3 LEU 12 -8.664 21.168 -6.027
89 HG LEU 12 HG LEU 12 -9.193 23.555 -6.267
90 HD11 LEU 12 HD11 LEU 12 -6.752 23.850 -4.561
91 HD12 LEU 12 HD12 LEU 12 -7.225 25.121 -5.689
92 HD13 LEU 12 HD13 LEU 12 -8.327 24.628 -4.404
93 HD21 LEU 12 HD21 LEU 12 -6.917 22.180 -7.382
94 HD22 LEU 12 HD22 LEU 12 -8.066 23.268 -8.161
95 HD23 LEU 12 HD23 LEU 12 -6.647 23.923 -7.344
96 H TYR 13 H TYR 13 -10.660 19.872 -4.352
97 HA TYR 13 HA TYR 13 -13.047 21.558 -4.543
98 HB2 TYR 13 HB2 TYR 13 -12.514 21.230 -6.844
99 HB3 TYR 13 HB3 TYR 13 -12.161 19.524 -6.590
100 HD1 TYR 13 HD1 TYR 13 -13.711 18.136 -7.569
101 HD2 TYR 13 HD2 TYR 13 -15.051 21.782 -5.832
102 HE1 TYR 13 HE1 TYR 13 -16.026 17.565 -8.171
103 HE2 TYR 13 HE2 TYR 13 -17.370 21.220 -6.428
104 HH TYR 13 HH TYR 13 -18.156 18.173 -8.080
105 H ASP 14 H ASP 14 -14.802 20.717 -3.565
106 HA ASP 14 HA ASP 14 -14.540 18.535 -1.817
107 HB2 ASP 14 HB2 ASP 14 -17.093 19.793 -2.846
108 HB3 ASP 14 HB3 ASP 14 -16.932 18.803 -1.397
109 H TYR 15 H TYR 15 -14.043 16.595 -2.698
110 HA TYR 15 HA TYR 15 -15.742 15.575 -4.866
111 HB2 TYR 15 HB2 TYR 15 -13.001 15.541 -4.587
112 HB3 TYR 15 HB3 TYR 15 -13.458 13.922 -4.071
113 HD1 TYR 15 HD1 TYR 15 -14.800 12.479 -5.643
114 HD2 TYR 15 HD2 TYR 15 -13.005 16.136 -6.871
115 HE1 TYR 15 HE1 TYR 15 -15.001 11.782 -7.993
116 HE2 TYR 15 HE2 TYR 15 -13.202 15.450 -9.225
117 HH TYR 15 HH TYR 15 -13.827 12.320 -10.180
118 H GLN 16 H GLN 16 -17.205 14.050 -4.479
119 HA GLN 16 HA GLN 16 -17.286 12.837 -1.820
120 HB2 GLN 16 HB2 GLN 16 -19.279 13.546 -3.865
121 HB3 GLN 16 HB3 GLN 16 -19.571 12.008 -3.064
122 HG2 GLN 16 HG2 GLN 16 -18.883 14.087 -1.175
123 HG3 GLN 16 HG3 GLN 16 -20.286 14.518 -2.153
124 HE21 GLN 16 HE21 GLN 16 -22.186 13.766 -1.536
125 HE22 GLN 16 HE22 GLN 16 -22.449 12.473 -0.421
126 H GLU 17 H GLU 17 -16.608 12.069 -5.099
127 HA GLU 17 HA GLU 17 -15.915 10.159 -6.123
128 HB2 GLU 17 HB2 GLU 17 -15.760 8.959 -3.356
129 HB3 GLU 17 HB3 GLU 17 -14.916 8.414 -4.798
130 HG2 GLU 17 HG2 GLU 17 -14.482 11.057 -3.426
131 HG3 GLU 17 HG3 GLU 17 -13.457 9.633 -3.252
132 H LYS 18 H LYS 18 -16.376 7.464 -5.508
133 HA LYS 18 HA LYS 18 -19.037 6.880 -4.804
134 HB2 LYS 18 HB2 LYS 18 -18.629 7.822 -7.518
135 HB3 LYS 18 HB3 LYS 18 -19.278 6.187 -7.499
136 HG2 LYS 18 HG2 LYS 18 -21.298 6.923 -6.969
137 HG3 LYS 18 HG3 LYS 18 -20.667 7.846 -5.603
138 HD2 LYS 18 HD2 LYS 18 -20.689 9.779 -6.749
139 HD3 LYS 18 HD3 LYS 18 -20.082 9.022 -8.223
140 HE2 LYS 18 HE2 LYS 18 -22.825 8.274 -7.499
141 HE3 LYS 18 HE3 LYS 18 -22.609 9.980 -7.887
142 HZ1 LYS 18 HZ1 LYS 18 -21.455 9.195 -9.958
143 HZ2 LYS 18 HZ2 LYS 18 -22.022 7.640 -9.606
144 HZ3 LYS 18 HZ3 LYS 18 -23.119 8.895 -9.896
145 H SER 19 H SER 19 -16.205 6.022 -6.696
146 HA SER 19 HA SER 19 -16.790 3.181 -6.484
147 HB2 SER 19 HB2 SER 19 -15.155 4.839 -8.189
148 HB3 SER 19 HB3 SER 19 -14.190 3.530 -7.507
149 HG SER 19 HG SER 19 -15.139 2.757 -9.356
150 HA PRO 20 HA PRO 20 -14.328 2.309 -2.961
151 HB2 PRO 20 HB2 PRO 20 -13.183 -0.059 -3.633
152 HB3 PRO 20 HB3 PRO 20 -14.898 0.100 -3.234
153 HG2 PRO 20 HG2 PRO 20 -13.583 -0.042 -5.919
154 HG3 PRO 20 HG3 PRO 20 -15.060 -0.843 -5.353
155 HD2 PRO 20 HD2 PRO 20 -15.109 1.393 -6.878
156 HD3 PRO 20 HD3 PRO 20 -16.350 1.042 -5.658
157 H ARG 21 H ARG 21 -12.778 2.436 -6.078
158 HA ARG 21 HA ARG 21 -10.113 2.523 -4.905
159 HB2 ARG 21 HB2 ARG 21 -9.289 2.511 -7.171
160 HB3 ARG 21 HB3 ARG 21 -10.527 1.273 -7.013
161 HG2 ARG 21 HG2 ARG 21 -11.523 3.881 -7.901
162 HG3 ARG 21 HG3 ARG 21 -10.400 3.097 -9.014
163 HD2 ARG 21 HD2 ARG 21 -12.983 1.995 -7.926
164 HD3 ARG 21 HD3 ARG 21 -12.615 2.416 -9.598
165 HE ARG 21 HE ARG 21 -10.769 0.523 -9.000
166 HH11 ARG 21 HH11 ARG 21 -14.239 0.670 -8.751
167 HH12 ARG 21 HH12 ARG 21 -14.458 -1.032 -8.994
168 HH21 ARG 21 HH21 ARG 21 -11.046 -1.718 -9.322
169 HH22 ARG 21 HH22 ARG 21 -12.641 -2.389 -9.318
170 H GLU 22 H GLU 22 -12.315 4.652 -4.671
171 HA GLU 22 HA GLU 22 -10.726 6.928 -5.657
172 HB2 GLU 22 HB2 GLU 22 -13.678 6.556 -5.271
173 HB3 GLU 22 HB3 GLU 22 -12.979 8.168 -5.254
174 HG2 GLU 22 HG2 GLU 22 -12.043 7.760 -7.493
175 HG3 GLU 22 HG3 GLU 22 -12.826 6.181 -7.508
176 H VAL 23 H VAL 23 -10.789 8.884 -4.296
177 HA VAL 23 HA VAL 23 -10.981 8.217 -1.430
178 HB VAL 23 HB VAL 23 -8.850 9.732 -2.903
179 HG11 VAL 23 HG11 VAL 23 -9.915 10.283 -0.215
180 HG12 VAL 23 HG12 VAL 23 -8.161 10.129 -0.320
181 HG13 VAL 23 HG13 VAL 23 -9.002 11.320 -1.312
182 HG21 VAL 23 HG21 VAL 23 -8.109 8.061 -0.641
183 HG22 VAL 23 HG22 VAL 23 -9.006 7.176 -1.875
184 HG23 VAL 23 HG23 VAL 23 -7.527 8.035 -2.306
185 H THR 24 H THR 24 -12.645 9.282 -0.592
186 HA THR 24 HA THR 24 -13.719 11.661 -1.754
187 HB THR 24 HB THR 24 -14.333 10.379 0.916
188 HG1 THR 24 HG1 THR 24 -15.932 9.318 -0.173
189 HG21 THR 24 HG21 THR 24 -16.490 11.870 -0.262
190 HG22 THR 24 HG22 THR 24 -15.743 12.057 1.324
191 HG23 THR 24 HG23 THR 24 -15.074 12.904 -0.071
192 H MET 25 H MET 25 -13.083 13.684 -1.431
193 HA MET 25 HA MET 25 -11.745 14.361 1.100
194 HB2 MET 25 HB2 MET 25 -10.106 15.676 -0.015
195 HB3 MET 25 HB3 MET 25 -10.131 14.114 -0.822
196 HG2 MET 25 HG2 MET 25 -11.958 15.996 -2.045
197 HG3 MET 25 HG3 MET 25 -10.302 16.597 -2.016
198 HE1 MET 25 HE1 MET 25 -8.674 16.166 -3.475
199 HE2 MET 25 HE2 MET 25 -8.656 15.030 -4.824
200 HE3 MET 25 HE3 MET 25 -9.774 16.394 -4.834
201 H LYS 26 H LYS 26 -11.981 16.539 1.793
202 HA LYS 26 HA LYS 26 -14.291 17.904 0.575
203 HB2 LYS 26 HB2 LYS 26 -13.495 17.417 3.392
204 HB3 LYS 26 HB3 LYS 26 -14.214 18.982 3.036
205 HG2 LYS 26 HG2 LYS 26 -15.613 16.613 1.962
206 HG3 LYS 26 HG3 LYS 26 -15.643 16.831 3.713
207 HD2 LYS 26 HD2 LYS 26 -16.843 18.787 3.585
208 HD3 LYS 26 HD3 LYS 26 -16.252 19.168 1.966
209 HE2 LYS 26 HE2 LYS 26 -17.621 16.870 1.501
210 HE3 LYS 26 HE3 LYS 26 -18.569 17.568 2.812
211 HZ1 LYS 26 HZ1 LYS 26 -19.557 18.676 1.151
212 HZ2 LYS 26 HZ2 LYS 26 -18.206 19.691 1.224
213 HZ3 LYS 26 HZ3 LYS 26 -18.272 18.452 0.074
214 H LYS 27 H LYS 27 -13.975 19.867 -0.245
215 HA LYS 27 HA LYS 27 -11.603 21.066 -0.732
216 HB2 LYS 27 HB2 LYS 27 -13.881 21.770 -1.571
217 HB3 LYS 27 HB3 LYS 27 -14.083 22.654 -0.064
218 HG2 LYS 27 HG2 LYS 27 -12.077 23.980 -0.608
219 HG3 LYS 27 HG3 LYS 27 -11.966 23.131 -2.152
220 HD2 LYS 27 HD2 LYS 27 -13.078 25.132 -2.657
221 HD3 LYS 27 HD3 LYS 27 -14.363 23.926 -2.557
222 HE2 LYS 27 HE2 LYS 27 -15.336 24.975 -0.845
223 HE3 LYS 27 HE3 LYS 27 -13.806 25.148 0.014
224 HZ1 LYS 27 HZ1 LYS 27 -14.680 26.911 -2.208
225 HZ2 LYS 27 HZ2 LYS 27 -14.864 27.285 -0.568
226 HZ3 LYS 27 HZ3 LYS 27 -13.315 27.114 -1.229
227 H GLY 28 H GLY 28 -10.022 21.331 0.735
228 HA2 GLY 28 HA2 GLY 28 -9.072 22.938 2.276
229 HA3 GLY 28 HA3 GLY 28 -10.639 23.028 3.066
230 H ASP 29 H ASP 29 -9.203 19.999 2.081
231 HA ASP 29 HA ASP 29 -8.621 19.394 4.905
232 HB2 ASP 29 HB2 ASP 29 -9.869 17.504 4.888
233 HB3 ASP 29 HB3 ASP 29 -10.719 18.308 3.571
234 H ILE 30 H ILE 30 -7.078 17.613 5.208
235 HA ILE 30 HA ILE 30 -5.064 17.615 3.062
236 HB ILE 30 HB ILE 30 -4.867 17.947 5.925
237 HG12 ILE 30 HG12 ILE 30 -3.848 19.261 3.943
238 HG13 ILE 30 HG13 ILE 30 -2.859 19.024 5.380
239 HG21 ILE 30 HG21 ILE 30 -2.877 16.505 6.253
240 HG22 ILE 30 HG22 ILE 30 -4.369 15.595 6.018
241 HG23 ILE 30 HG23 ILE 30 -3.212 15.748 4.696
242 HD11 ILE 30 HD11 ILE 30 -1.446 17.564 4.330
243 HD12 ILE 30 HD12 ILE 30 -2.659 17.065 3.151
244 HD13 ILE 30 HD13 ILE 30 -1.874 18.637 2.997
245 H LEU 31 H LEU 31 -4.163 15.717 2.343
246 HA LEU 31 HA LEU 31 -5.224 13.215 3.463
247 HB2 LEU 31 HB2 LEU 31 -4.902 12.652 0.797
248 HB3 LEU 31 HB3 LEU 31 -6.433 12.958 1.614
249 HG LEU 31 HG LEU 31 -4.894 15.245 0.460
250 HD11 LEU 31 HD11 LEU 31 -5.163 13.307 -1.217
251 HD12 LEU 31 HD12 LEU 31 -6.877 13.721 -1.185
252 HD13 LEU 31 HD13 LEU 31 -5.689 14.921 -1.696
253 HD21 LEU 31 HD21 LEU 31 -7.393 14.863 1.733
254 HD22 LEU 31 HD22 LEU 31 -6.714 16.352 1.074
255 HD23 LEU 31 HD23 LEU 31 -7.710 15.310 0.056
256 H THR 32 H THR 32 -3.936 11.305 2.892
257 HA THR 32 HA THR 32 -1.087 11.989 2.819
258 HB THR 32 HB THR 32 -2.160 9.250 3.434
259 HG1 THR 32 HG1 THR 32 -1.920 11.458 5.223
260 HG21 THR 32 HG21 THR 32 -0.102 8.850 4.387
261 HG22 THR 32 HG22 THR 32 0.348 9.958 3.091
262 HG23 THR 32 HG23 THR 32 0.185 10.553 4.743
263 H LEU 33 H LEU 33 -0.198 11.932 0.862
264 HA LEU 33 HA LEU 33 -1.273 10.557 -1.354
265 HB2 LEU 33 HB2 LEU 33 1.216 12.050 -0.765
266 HB3 LEU 33 HB3 LEU 33 1.246 10.957 -2.147
267 HG LEU 33 HG LEU 33 0.721 13.376 -2.642
268 HD11 LEU 33 HD11 LEU 33 0.047 11.205 -3.962
269 HD12 LEU 33 HD12 LEU 33 -1.583 11.708 -3.514
270 HD13 LEU 33 HD13 LEU 33 -0.552 12.791 -4.449
271 HD21 LEU 33 HD21 LEU 33 -1.643 14.043 -2.274
272 HD22 LEU 33 HD22 LEU 33 -1.844 12.624 -1.247
273 HD23 LEU 33 HD23 LEU 33 -0.711 13.894 -0.785
274 H LEU 34 H LEU 34 -0.627 8.682 -2.399
275 HA LEU 34 HA LEU 34 1.109 6.890 -0.830
276 HB2 LEU 34 HB2 LEU 34 -1.572 6.518 -1.944
277 HB3 LEU 34 HB3 LEU 34 -0.450 5.214 -2.327
278 HG LEU 34 HG LEU 34 -0.630 6.075 0.509
279 HD11 LEU 34 HD11 LEU 34 -2.882 5.933 0.434
280 HD12 LEU 34 HD12 LEU 34 -2.884 4.981 -1.050
281 HD13 LEU 34 HD13 LEU 34 -2.549 4.203 0.497
282 HD21 LEU 34 HD21 LEU 34 0.887 4.275 -0.427
283 HD22 LEU 34 HD22 LEU 34 -0.125 3.812 0.941
284 HD23 LEU 34 HD23 LEU 34 -0.571 3.319 -0.693
285 H ASN 35 H ASN 35 -0.272 7.152 -4.113
286 HA ASN 35 HA ASN 35 2.138 5.975 -5.230
287 HB2 ASN 35 HB2 ASN 35 -0.029 5.243 -6.098
288 HB3 ASN 35 HB3 ASN 35 -0.420 6.897 -6.561
289 HD21 ASN 35 HD21 ASN 35 2.616 5.127 -6.900
290 HD22 ASN 35 HD22 ASN 35 2.685 5.224 -8.624
291 H SER 36 H SER 36 0.198 8.788 -6.244
292 HA SER 36 HA SER 36 0.788 10.879 -6.926
293 HB2 SER 36 HB2 SER 36 2.800 10.178 -4.960
294 HB3 SER 36 HB3 SER 36 3.477 11.214 -6.216
295 HG SER 36 HG SER 36 2.401 12.820 -5.410
296 H THR 37 H THR 37 1.551 8.279 -8.361
297 HA THR 37 HA THR 37 3.683 9.288 -10.101
298 HB THR 37 HB THR 37 2.402 6.548 -10.034
299 HG1 THR 37 HG1 THR 37 5.059 7.065 -9.276
300 HG21 THR 37 HG21 THR 37 4.876 7.508 -11.478
301 HG22 THR 37 HG22 THR 37 4.234 5.865 -11.480
302 HG23 THR 37 HG23 THR 37 3.322 7.170 -12.239
303 H ASN 38 H ASN 38 0.292 8.406 -10.096
304 HA ASN 38 HA ASN 38 0.088 8.951 -12.964
305 HB2 ASN 38 HB2 ASN 38 -1.039 6.943 -12.277
306 HB3 ASN 38 HB3 ASN 38 -1.872 7.791 -10.977
307 HD21 ASN 38 HD21 ASN 38 -1.371 8.622 -14.382
308 HD22 ASN 38 HD22 ASN 38 -3.048 8.757 -14.774
309 H LYS 39 H LYS 39 0.126 11.125 -13.232
310 HA LYS 39 HA LYS 39 -0.805 13.113 -11.599
311 HB2 LYS 39 HB2 LYS 39 0.456 13.670 -13.556
312 HB3 LYS 39 HB3 LYS 39 -0.766 12.976 -14.614
313 HG2 LYS 39 HG2 LYS 39 -2.337 14.734 -13.926
314 HG3 LYS 39 HG3 LYS 39 -1.075 15.443 -12.915
315 HD2 LYS 39 HD2 LYS 39 -0.022 15.043 -15.531
316 HD3 LYS 39 HD3 LYS 39 -1.574 15.872 -15.673
317 HE2 LYS 39 HE2 LYS 39 -0.837 17.596 -14.155
318 HE3 LYS 39 HE3 LYS 39 0.669 16.733 -13.849
319 HZ1 LYS 39 HZ1 LYS 39 1.549 17.839 -15.534
320 HZ2 LYS 39 HZ2 LYS 39 0.483 17.063 -16.594
321 HZ3 LYS 39 HZ3 LYS 39 0.065 18.556 -15.917
322 H ASP 40 H ASP 40 -2.651 11.481 -14.169
323 HA ASP 40 HA ASP 40 -5.043 12.814 -13.973
324 HB2 ASP 40 HB2 ASP 40 -4.637 11.111 -15.667
325 HB3 ASP 40 HB3 ASP 40 -4.609 9.855 -14.432
326 H TRP 41 H TRP 41 -3.987 10.025 -12.041
327 HA TRP 41 HA TRP 41 -5.869 10.848 -9.953
328 HB2 TRP 41 HB2 TRP 41 -5.724 8.138 -11.251
329 HB3 TRP 41 HB3 TRP 41 -6.311 8.325 -9.601
330 HD1 TRP 41 HD1 TRP 41 -7.302 8.933 -13.217
331 HE1 TRP 41 HE1 TRP 41 -9.781 9.621 -13.303
332 HE3 TRP 41 HE3 TRP 41 -8.150 9.544 -8.212
333 HZ2 TRP 41 HZ2 TRP 41 -11.825 10.330 -11.490
334 HZ3 TRP 41 HZ3 TRP 41 -10.394 10.229 -7.471
335 HH2 TRP 41 HH2 TRP 41 -12.192 10.614 -9.077
336 H TRP 42 H TRP 42 -4.734 11.161 -8.165
337 HA TRP 42 HA TRP 42 -2.226 9.697 -7.784
338 HB2 TRP 42 HB2 TRP 42 -3.341 12.237 -6.620
339 HB3 TRP 42 HB3 TRP 42 -1.985 11.408 -5.860
340 HD1 TRP 42 HD1 TRP 42 -0.744 10.579 -8.853
341 HE1 TRP 42 HE1 TRP 42 0.587 12.406 -10.083
342 HE3 TRP 42 HE3 TRP 42 -2.525 14.683 -6.380
343 HZ2 TRP 42 HZ2 TRP 42 0.848 15.216 -10.013
344 HZ3 TRP 42 HZ3 TRP 42 -1.683 16.904 -7.022
345 HH2 TRP 42 HH2 TRP 42 -0.031 17.163 -8.801
346 H LYS 43 H LYS 43 -2.533 7.806 -6.785
347 HA LYS 43 HA LYS 43 -4.649 7.144 -5.087
348 HB2 LYS 43 HB2 LYS 43 -3.294 5.444 -6.172
349 HB3 LYS 43 HB3 LYS 43 -1.876 5.953 -5.265
350 HG2 LYS 43 HG2 LYS 43 -3.565 5.409 -3.239
351 HG3 LYS 43 HG3 LYS 43 -4.140 4.262 -4.451
352 HD2 LYS 43 HD2 LYS 43 -1.214 4.423 -4.122
353 HD3 LYS 43 HD3 LYS 43 -2.105 3.762 -2.749
354 HE2 LYS 43 HE2 LYS 43 -1.837 1.837 -3.916
355 HE3 LYS 43 HE3 LYS 43 -3.301 2.409 -4.714
356 HZ1 LYS 43 HZ1 LYS 43 -2.147 3.032 -6.583
357 HZ2 LYS 43 HZ2 LYS 43 -0.671 3.192 -5.772
358 HZ3 LYS 43 HZ3 LYS 43 -1.283 1.653 -6.120
359 H VAL 44 H VAL 44 -5.060 7.513 -3.001
360 HA VAL 44 HA VAL 44 -2.871 8.249 -1.202
361 HB VAL 44 HB VAL 44 -4.025 10.163 -0.309
362 HG11 VAL 44 HG11 VAL 44 -3.423 11.624 -1.939
363 HG12 VAL 44 HG12 VAL 44 -2.727 10.163 -2.641
364 HG13 VAL 44 HG13 VAL 44 -4.294 10.749 -3.199
365 HG21 VAL 44 HG21 VAL 44 -6.315 9.419 -0.560
366 HG22 VAL 44 HG22 VAL 44 -6.115 10.997 -1.323
367 HG23 VAL 44 HG23 VAL 44 -6.191 9.540 -2.315
368 H GLU 45 H GLU 45 -3.737 8.433 1.115
369 HA GLU 45 HA GLU 45 -5.808 6.382 1.544
370 HB2 GLU 45 HB2 GLU 45 -3.736 5.378 2.144
371 HB3 GLU 45 HB3 GLU 45 -3.206 6.818 3.001
372 HG2 GLU 45 HG2 GLU 45 -4.839 6.450 4.729
373 HG3 GLU 45 HG3 GLU 45 -5.517 5.085 3.844
374 H VAL 46 H VAL 46 -7.502 7.019 2.699
375 HA VAL 46 HA VAL 46 -7.186 9.129 4.701
376 HB VAL 46 HB VAL 46 -9.370 10.147 3.865
377 HG11 VAL 46 HG11 VAL 46 -7.236 10.562 1.829
378 HG12 VAL 46 HG12 VAL 46 -8.217 11.746 2.693
379 HG13 VAL 46 HG13 VAL 46 -6.887 10.931 3.518
380 HG21 VAL 46 HG21 VAL 46 -10.099 9.757 1.676
381 HG22 VAL 46 HG22 VAL 46 -8.604 8.937 1.227
382 HG23 VAL 46 HG23 VAL 46 -9.754 8.146 2.306
383 H ASN 47 H ASN 47 -8.325 8.751 6.506
384 HA ASN 47 HA ASN 47 -9.465 7.451 8.018
385 HB2 ASN 47 HB2 ASN 47 -11.962 7.221 7.210
386 HB3 ASN 47 HB3 ASN 47 -11.294 8.801 7.610
387 HD21 ASN 47 HD21 ASN 47 -12.287 6.670 5.047
388 HD22 ASN 47 HD22 ASN 47 -12.353 7.869 3.805
389 H ASP 48 H ASP 48 -7.989 5.630 7.208
390 HA ASP 48 HA ASP 48 -7.662 3.486 6.454
391 HB2 ASP 48 HB2 ASP 48 -9.142 3.430 8.616
392 HB3 ASP 48 HB3 ASP 48 -10.396 2.865 7.514
393 H ARG 49 H ARG 49 -8.779 5.170 4.446
394 HA ARG 49 HA ARG 49 -10.004 3.118 2.778
395 HB2 ARG 49 HB2 ARG 49 -11.434 5.406 3.842
396 HB3 ARG 49 HB3 ARG 49 -11.416 5.425 2.084
397 HG2 ARG 49 HG2 ARG 49 -12.219 2.996 3.655
398 HG3 ARG 49 HG3 ARG 49 -13.365 4.259 3.200
399 HD2 ARG 49 HD2 ARG 49 -11.851 3.569 0.899
400 HD3 ARG 49 HD3 ARG 49 -12.416 2.076 1.648
401 HE ARG 49 HE ARG 49 -13.996 3.996 0.257
402 HH11 ARG 49 HH11 ARG 49 -14.052 1.688 2.863
403 HH12 ARG 49 HH12 ARG 49 -15.761 1.421 2.763
404 HH21 ARG 49 HH21 ARG 49 -16.247 3.653 0.116
405 HH22 ARG 49 HH22 ARG 49 -17.008 2.539 1.200
406 H GLN 50 H GLN 50 -7.971 3.139 1.722
407 HA GLN 50 HA GLN 50 -7.159 5.602 0.393
408 HB2 GLN 50 HB2 GLN 50 -5.119 4.507 -0.120
409 HB3 GLN 50 HB3 GLN 50 -5.518 4.048 1.530
410 HG2 GLN 50 HG2 GLN 50 -5.079 1.975 0.836
411 HG3 GLN 50 HG3 GLN 50 -6.691 2.045 0.127
412 HE21 GLN 50 HE21 GLN 50 -3.302 2.770 -0.582
413 HE22 GLN 50 HE22 GLN 50 -3.385 2.370 -2.261
414 H GLY 51 H GLY 51 -6.973 5.824 -1.851
415 HA2 GLY 51 HA2 GLY 51 -7.791 3.723 -3.634
416 HA3 GLY 51 HA3 GLY 51 -9.022 4.962 -3.436
417 H PHE 52 H PHE 52 -8.942 6.652 -4.761
418 HA PHE 52 HA PHE 52 -6.371 7.481 -5.882
419 HB2 PHE 52 HB2 PHE 52 -8.801 6.695 -7.491
420 HB3 PHE 52 HB3 PHE 52 -7.506 7.690 -8.148
421 HD1 PHE 52 HD1 PHE 52 -5.083 6.510 -7.253
422 HD2 PHE 52 HD2 PHE 52 -8.708 4.590 -8.389
423 HE1 PHE 52 HE1 PHE 52 -3.821 4.481 -7.838
424 HE2 PHE 52 HE2 PHE 52 -7.451 2.558 -8.975
425 HZ PHE 52 HZ PHE 52 -5.005 2.501 -8.699
426 H VAL 53 H VAL 53 -6.141 9.613 -5.777
427 HA VAL 53 HA VAL 53 -8.558 11.260 -5.428
428 HB VAL 53 HB VAL 53 -6.379 11.098 -3.770
429 HG11 VAL 53 HG11 VAL 53 -5.093 13.115 -3.984
430 HG12 VAL 53 HG12 VAL 53 -5.006 12.229 -5.506
431 HG13 VAL 53 HG13 VAL 53 -6.059 13.637 -5.364
432 HG21 VAL 53 HG21 VAL 53 -8.801 12.388 -3.841
433 HG22 VAL 53 HG22 VAL 53 -7.651 12.436 -2.505
434 HG23 VAL 53 HG23 VAL 53 -7.654 13.722 -3.711
435 HA PRO 54 HA PRO 54 -7.690 13.164 -9.316
436 HB2 PRO 54 HB2 PRO 54 -9.238 15.372 -9.006
437 HB3 PRO 54 HB3 PRO 54 -9.906 13.769 -9.332
438 HG2 PRO 54 HG2 PRO 54 -9.663 15.226 -6.728
439 HG3 PRO 54 HG3 PRO 54 -11.024 14.281 -7.358
440 HD2 PRO 54 HD2 PRO 54 -9.279 13.290 -5.540
441 HD3 PRO 54 HD3 PRO 54 -10.067 12.271 -6.762
442 H ALA 55 H ALA 55 -5.784 14.091 -9.713
443 HA ALA 55 HA ALA 55 -4.388 15.763 -7.940
444 HB1 ALA 55 HB1 ALA 55 -2.811 16.095 -9.726
445 HB2 ALA 55 HB2 ALA 55 -3.344 14.414 -9.738
446 HB3 ALA 55 HB3 ALA 55 -3.989 15.552 -10.921
447 H ALA 56 H ALA 56 -5.989 16.599 -11.020
448 HA ALA 56 HA ALA 56 -5.625 19.313 -11.020
449 HB1 ALA 56 HB1 ALA 56 -7.646 19.478 -12.380
450 HB2 ALA 56 HB2 ALA 56 -6.666 18.093 -12.861
451 HB3 ALA 56 HB3 ALA 56 -8.117 17.851 -11.887
452 H TYR 57 H TYR 57 -7.915 17.446 -9.128
453 HA TYR 57 HA TYR 57 -9.100 19.884 -8.037
454 HB2 TYR 57 HB2 TYR 57 -9.820 16.965 -7.758
455 HB3 TYR 57 HB3 TYR 57 -10.618 18.242 -6.847
456 HD1 TYR 57 HD1 TYR 57 -10.933 16.226 -9.629
457 HD2 TYR 57 HD2 TYR 57 -11.375 20.295 -8.467
458 HE1 TYR 57 HE1 TYR 57 -12.480 16.587 -11.506
459 HE2 TYR 57 HE2 TYR 57 -12.925 20.667 -10.340
460 HH TYR 57 HH TYR 57 -13.925 18.008 -12.454
461 H VAL 58 H VAL 58 -6.414 19.489 -7.388
462 HA VAL 58 HA VAL 58 -6.621 19.325 -4.488
463 HB VAL 58 HB VAL 58 -5.776 17.084 -5.748
464 HG11 VAL 58 HG11 VAL 58 -3.203 18.421 -4.970
465 HG12 VAL 58 HG12 VAL 58 -3.443 16.924 -5.872
466 HG13 VAL 58 HG13 VAL 58 -3.818 18.476 -6.623
467 HG21 VAL 58 HG21 VAL 58 -6.263 17.487 -3.318
468 HG22 VAL 58 HG22 VAL 58 -4.933 16.373 -3.636
469 HG23 VAL 58 HG23 VAL 58 -4.594 18.033 -3.144
470 H LYS 59 H LYS 59 -4.446 19.943 -3.474
471 HA LYS 59 HA LYS 59 -2.724 21.590 -5.105
472 HB2 LYS 59 HB2 LYS 59 -4.944 22.747 -3.684
473 HB3 LYS 59 HB3 LYS 59 -3.432 23.331 -3.001
474 HG2 LYS 59 HG2 LYS 59 -2.834 23.691 -5.549
475 HG3 LYS 59 HG3 LYS 59 -4.591 23.760 -5.698
476 HD2 LYS 59 HD2 LYS 59 -4.232 25.364 -3.562
477 HD3 LYS 59 HD3 LYS 59 -2.715 25.647 -4.420
478 HE2 LYS 59 HE2 LYS 59 -3.727 26.855 -6.000
479 HE3 LYS 59 HE3 LYS 59 -5.008 25.661 -6.201
480 HZ1 LYS 59 HZ1 LYS 59 -6.363 26.736 -4.768
481 HZ2 LYS 59 HZ2 LYS 59 -5.101 27.302 -3.793
482 HZ3 LYS 59 HZ3 LYS 59 -5.454 28.078 -5.254
483 H LYS 60 H LYS 60 -0.776 21.022 -4.420
484 HA LYS 60 HA LYS 60 -0.254 19.812 -1.927
485 HB2 LYS 60 HB2 LYS 60 1.087 19.835 -4.210
486 HB3 LYS 60 HB3 LYS 60 1.930 21.173 -3.442
487 HG2 LYS 60 HG2 LYS 60 1.660 18.397 -2.307
488 HG3 LYS 60 HG3 LYS 60 3.089 19.048 -3.115
489 HD2 LYS 60 HD2 LYS 60 2.706 20.950 -1.253
490 HD3 LYS 60 HD3 LYS 60 2.039 19.556 -0.399
491 HE2 LYS 60 HE2 LYS 60 4.387 19.784 0.123
492 HE3 LYS 60 HE3 LYS 60 4.132 18.326 -0.836
493 HZ1 LYS 60 HZ1 LYS 60 4.652 20.514 -2.541
494 HZ2 LYS 60 HZ2 LYS 60 5.871 20.417 -1.372
495 HZ3 LYS 60 HZ3 LYS 60 5.533 19.082 -2.354
496 H LEU 61 H LEU 61 -0.982 21.129 -0.261
497 HA LEU 61 HA LEU 61 0.581 23.591 0.162
498 HB2 LEU 61 HB2 LEU 61 -2.170 23.060 1.257
499 HB3 LEU 61 HB3 LEU 61 -1.273 24.577 1.282
500 HG LEU 61 HG LEU 61 -2.077 23.342 -1.324
501 HD11 LEU 61 HD11 LEU 61 -4.235 23.590 -0.884
502 HD12 LEU 61 HD12 LEU 61 -3.880 24.243 0.716
503 HD13 LEU 61 HD13 LEU 61 -3.955 25.319 -0.679
504 HD21 LEU 61 HD21 LEU 61 -1.089 25.942 -0.329
505 HD22 LEU 61 HD22 LEU 61 -0.796 25.125 -1.865
506 HD23 LEU 61 HD23 LEU 61 -2.306 25.998 -1.605
507 H ASP 62 H ASP 62 1.872 21.511 1.018
508 HA ASP 62 HA ASP 62 1.720 21.725 3.903
509 HB2 ASP 62 HB2 ASP 62 0.400 19.609 2.754
510 HB3 ASP 62 HB3 ASP 62 1.983 18.916 3.092
Start of MODEL 3
1 H1 MET 1 H MET 1 1.129 0.927 0.312
2 HA MET 1 HA MET 1 2.885 -0.770 -1.283
3 HB2 MET 1 HB2 MET 1 0.435 0.629 -2.321
4 HB3 MET 1 HB3 MET 1 1.804 0.299 -3.375
5 HG2 MET 1 HG2 MET 1 1.231 -2.098 -2.017
6 HG3 MET 1 HG3 MET 1 -0.309 -1.435 -2.560
7 HE1 MET 1 HE1 MET 1 -1.243 -1.693 -4.702
8 HE2 MET 1 HE2 MET 1 -0.548 -2.687 -5.982
9 HE3 MET 1 HE3 MET 1 -0.858 -3.386 -4.393
10 H ASP 2 H ASP 2 1.446 2.432 -1.841
11 HA ASP 2 HA ASP 2 2.359 4.522 -1.904
12 HB2 ASP 2 HB2 ASP 2 4.947 3.495 -0.784
13 HB3 ASP 2 HB3 ASP 2 4.180 5.063 -0.547
14 H GLU 3 H GLU 3 5.205 2.425 -2.375
15 HA GLU 3 HA GLU 3 6.694 2.250 -4.086
16 HB2 GLU 3 HB2 GLU 3 4.281 1.795 -5.182
17 HB3 GLU 3 HB3 GLU 3 4.754 3.209 -6.113
18 HG2 GLU 3 HG2 GLU 3 6.866 1.217 -5.907
19 HG3 GLU 3 HG3 GLU 3 5.405 0.610 -6.684
20 H THR 4 H THR 4 6.557 4.740 -2.694
21 HA THR 4 HA THR 4 7.980 6.385 -4.592
22 HB THR 4 HB THR 4 5.433 7.410 -3.325
23 HG1 THR 4 HG1 THR 4 4.617 6.984 -5.222
24 HG21 THR 4 HG21 THR 4 7.790 8.793 -4.478
25 HG22 THR 4 HG22 THR 4 6.199 9.416 -4.915
26 HG23 THR 4 HG23 THR 4 6.672 9.319 -3.219
27 H GLY 5 H GLY 5 6.276 7.242 -1.592
28 HA2 GLY 5 HA2 GLY 5 8.245 6.861 0.275
29 HA3 GLY 5 HA3 GLY 5 8.655 8.394 -0.481
30 H LYS 6 H LYS 6 7.180 10.155 -0.303
31 HA LYS 6 HA LYS 6 4.866 9.915 1.394
32 HB2 LYS 6 HB2 LYS 6 7.452 10.898 2.436
33 HB3 LYS 6 HB3 LYS 6 6.052 11.892 2.817
34 HG2 LYS 6 HG2 LYS 6 5.748 10.537 4.551
35 HG3 LYS 6 HG3 LYS 6 5.176 9.347 3.379
36 HD2 LYS 6 HD2 LYS 6 6.791 8.087 4.357
37 HD3 LYS 6 HD3 LYS 6 7.804 8.911 3.170
38 HE2 LYS 6 HE2 LYS 6 9.028 9.261 5.075
39 HE3 LYS 6 HE3 LYS 6 8.018 10.706 5.077
40 HZ1 LYS 6 HZ1 LYS 6 6.461 9.422 6.544
41 HZ2 LYS 6 HZ2 LYS 6 7.671 8.249 6.697
42 HZ3 LYS 6 HZ3 LYS 6 7.946 9.826 7.246
43 H GLU 7 H GLU 7 3.643 11.899 1.531
44 HA GLU 7 HA GLU 7 4.365 14.320 0.351
45 HB2 GLU 7 HB2 GLU 7 3.657 12.257 -1.548
46 HB3 GLU 7 HB3 GLU 7 2.523 13.598 -1.637
47 HG2 GLU 7 HG2 GLU 7 4.046 15.008 -2.499
48 HG3 GLU 7 HG3 GLU 7 5.364 14.349 -1.532
49 H LEU 8 H LEU 8 2.625 15.836 0.265
50 HA LEU 8 HA LEU 8 0.060 14.898 1.330
51 HB2 LEU 8 HB2 LEU 8 2.025 16.388 2.774
52 HB3 LEU 8 HB3 LEU 8 0.602 17.399 2.527
53 HG LEU 8 HG LEU 8 -0.791 15.849 3.692
54 HD11 LEU 8 HD11 LEU 8 0.238 13.778 4.700
55 HD12 LEU 8 HD12 LEU 8 -0.005 13.747 2.954
56 HD13 LEU 8 HD13 LEU 8 1.605 14.033 3.615
57 HD21 LEU 8 HD21 LEU 8 1.102 15.544 5.737
58 HD22 LEU 8 HD22 LEU 8 1.542 17.023 4.882
59 HD23 LEU 8 HD23 LEU 8 -0.081 16.838 5.547
60 H VAL 9 H VAL 9 -1.720 16.232 0.860
61 HA VAL 9 HA VAL 9 -1.285 18.591 -0.793
62 HB VAL 9 HB VAL 9 -2.728 17.840 -2.593
63 HG11 VAL 9 HG11 VAL 9 -0.364 17.439 -2.873
64 HG12 VAL 9 HG12 VAL 9 -0.487 15.909 -2.004
65 HG13 VAL 9 HG13 VAL 9 -1.271 16.098 -3.573
66 HG21 VAL 9 HG21 VAL 9 -4.217 16.358 -1.470
67 HG22 VAL 9 HG22 VAL 9 -3.375 15.417 -2.702
68 HG23 VAL 9 HG23 VAL 9 -2.896 15.283 -1.010
69 H LEU 10 H LEU 10 -3.441 19.627 -1.361
70 HA LEU 10 HA LEU 10 -5.320 19.260 0.879
71 HB2 LEU 10 HB2 LEU 10 -4.212 21.708 -0.407
72 HB3 LEU 10 HB3 LEU 10 -5.843 21.762 0.258
73 HG LEU 10 HG LEU 10 -4.054 22.627 1.774
74 HD11 LEU 10 HD11 LEU 10 -6.300 21.617 2.472
75 HD12 LEU 10 HD12 LEU 10 -5.362 20.207 2.966
76 HD13 LEU 10 HD13 LEU 10 -5.049 21.777 3.705
77 HD21 LEU 10 HD21 LEU 10 -2.544 21.122 2.843
78 HD22 LEU 10 HD22 LEU 10 -3.274 19.730 2.043
79 HD23 LEU 10 HD23 LEU 10 -2.363 20.910 1.102
80 H ALA 11 H ALA 11 -7.501 19.285 0.456
81 HA ALA 11 HA ALA 11 -8.327 18.487 -2.136
82 HB1 ALA 11 HB1 ALA 11 -10.665 18.856 -1.071
83 HB2 ALA 11 HB2 ALA 11 -9.621 17.578 -0.449
84 HB3 ALA 11 HB3 ALA 11 -9.753 19.109 0.417
85 H LEU 12 H LEU 12 -8.359 19.848 -3.806
86 HA LEU 12 HA LEU 12 -8.841 22.669 -3.465
87 HB2 LEU 12 HB2 LEU 12 -7.252 21.589 -5.133
88 HB3 LEU 12 HB3 LEU 12 -8.687 21.177 -6.070
89 HG LEU 12 HG LEU 12 -8.229 24.025 -5.308
90 HD11 LEU 12 HD11 LEU 12 -6.069 23.221 -6.185
91 HD12 LEU 12 HD12 LEU 12 -6.890 22.675 -7.647
92 HD13 LEU 12 HD13 LEU 12 -6.845 24.393 -7.249
93 HD21 LEU 12 HD21 LEU 12 -9.067 23.557 -7.992
94 HD22 LEU 12 HD22 LEU 12 -10.047 22.571 -6.907
95 HD23 LEU 12 HD23 LEU 12 -9.954 24.316 -6.670
96 H TYR 13 H TYR 13 -10.668 19.864 -4.384
97 HA TYR 13 HA TYR 13 -13.066 21.533 -4.577
98 HB2 TYR 13 HB2 TYR 13 -12.532 21.209 -6.878
99 HB3 TYR 13 HB3 TYR 13 -12.167 19.506 -6.625
100 HD1 TYR 13 HD1 TYR 13 -15.091 21.646 -5.700
101 HD2 TYR 13 HD2 TYR 13 -13.688 18.201 -7.766
102 HE1 TYR 13 HE1 TYR 13 -17.407 21.067 -6.294
103 HE2 TYR 13 HE2 TYR 13 -16.000 17.614 -8.367
104 HH TYR 13 HH TYR 13 -18.742 19.585 -7.268
105 H ASP 14 H ASP 14 -14.814 20.681 -3.598
106 HA ASP 14 HA ASP 14 -14.536 18.500 -1.850
107 HB2 ASP 14 HB2 ASP 14 -17.098 19.740 -2.878
108 HB3 ASP 14 HB3 ASP 14 -16.930 18.752 -1.430
109 H TYR 15 H TYR 15 -14.023 16.565 -2.735
110 HA TYR 15 HA TYR 15 -15.717 15.533 -4.900
111 HB2 TYR 15 HB2 TYR 15 -12.977 15.519 -4.625
112 HB3 TYR 15 HB3 TYR 15 -13.420 13.896 -4.107
113 HD1 TYR 15 HD1 TYR 15 -14.757 12.445 -5.677
114 HD2 TYR 15 HD2 TYR 15 -12.984 16.111 -6.909
115 HE1 TYR 15 HE1 TYR 15 -14.955 11.745 -8.027
116 HE2 TYR 15 HE2 TYR 15 -13.179 15.422 -9.262
117 HH TYR 15 HH TYR 15 -14.698 12.340 -10.154
118 H GLN 16 H GLN 16 -17.172 14.000 -4.510
119 HA GLN 16 HA GLN 16 -17.241 12.785 -1.852
120 HB2 GLN 16 HB2 GLN 16 -19.223 13.705 -3.703
121 HB3 GLN 16 HB3 GLN 16 -19.488 11.995 -3.388
122 HG2 GLN 16 HG2 GLN 16 -18.946 13.446 -0.951
123 HG3 GLN 16 HG3 GLN 16 -20.312 14.133 -1.828
124 HE21 GLN 16 HE21 GLN 16 -21.882 12.437 -2.664
125 HE22 GLN 16 HE22 GLN 16 -22.298 11.175 -1.560
126 H GLU 17 H GLU 17 -16.560 12.021 -5.132
127 HA GLU 17 HA GLU 17 -15.851 10.116 -6.154
128 HB2 GLU 17 HB2 GLU 17 -15.689 8.916 -3.387
129 HB3 GLU 17 HB3 GLU 17 -14.839 8.380 -4.829
130 HG2 GLU 17 HG2 GLU 17 -14.427 11.024 -3.453
131 HG3 GLU 17 HG3 GLU 17 -13.391 9.609 -3.281
132 H LYS 18 H LYS 18 -16.292 7.418 -5.538
133 HA LYS 18 HA LYS 18 -18.949 6.814 -4.835
134 HB2 LYS 18 HB2 LYS 18 -18.548 7.760 -7.549
135 HB3 LYS 18 HB3 LYS 18 -19.182 6.120 -7.531
136 HG2 LYS 18 HG2 LYS 18 -21.206 6.806 -6.919
137 HG3 LYS 18 HG3 LYS 18 -20.557 7.850 -5.651
138 HD2 LYS 18 HD2 LYS 18 -20.282 9.654 -7.121
139 HD3 LYS 18 HD3 LYS 18 -20.405 8.623 -8.549
140 HE2 LYS 18 HE2 LYS 18 -22.482 9.605 -8.537
141 HE3 LYS 18 HE3 LYS 18 -22.802 8.135 -7.619
142 HZ1 LYS 18 HZ1 LYS 18 -23.767 10.033 -6.520
143 HZ2 LYS 18 HZ2 LYS 18 -22.505 9.421 -5.574
144 HZ3 LYS 18 HZ3 LYS 18 -22.275 10.828 -6.484
145 H SER 19 H SER 19 -16.109 5.977 -6.727
146 HA SER 19 HA SER 19 -16.674 3.132 -6.515
147 HB2 SER 19 HB2 SER 19 -15.052 4.801 -8.221
148 HB3 SER 19 HB3 SER 19 -14.076 3.501 -7.537
149 HG SER 19 HG SER 19 -15.640 3.293 -9.570
150 HA PRO 20 HA PRO 20 -14.205 2.280 -2.991
151 HB2 PRO 20 HB2 PRO 20 -13.043 -0.080 -3.662
152 HB3 PRO 20 HB3 PRO 20 -14.759 0.066 -3.263
153 HG2 PRO 20 HG2 PRO 20 -13.443 -0.068 -5.949
154 HG3 PRO 20 HG3 PRO 20 -14.914 -0.879 -5.382
155 HD2 PRO 20 HD2 PRO 20 -14.980 1.357 -6.908
156 HD3 PRO 20 HD3 PRO 20 -16.218 0.997 -5.688
157 H ARG 21 H ARG 21 -12.657 2.418 -6.108
158 HA ARG 21 HA ARG 21 -9.992 2.524 -4.936
159 HB2 ARG 21 HB2 ARG 21 -9.168 2.518 -7.202
160 HB3 ARG 21 HB3 ARG 21 -10.399 1.273 -7.045
161 HG2 ARG 21 HG2 ARG 21 -11.412 3.875 -7.930
162 HG3 ARG 21 HG3 ARG 21 -10.282 3.101 -9.044
163 HD2 ARG 21 HD2 ARG 21 -12.858 1.977 -7.959
164 HD3 ARG 21 HD3 ARG 21 -12.492 2.405 -9.630
165 HE ARG 21 HE ARG 21 -10.632 0.526 -9.041
166 HH11 ARG 21 HH11 ARG 21 -14.102 0.642 -8.777
167 HH12 ARG 21 HH12 ARG 21 -14.308 -1.061 -9.021
168 HH21 ARG 21 HH21 ARG 21 -10.891 -1.718 -9.364
169 HH22 ARG 21 HH22 ARG 21 -12.481 -2.402 -9.354
170 H GLU 22 H GLU 22 -12.212 4.637 -4.704
171 HA GLU 22 HA GLU 22 -10.639 6.925 -5.688
172 HB2 GLU 22 HB2 GLU 22 -13.589 6.531 -5.300
173 HB3 GLU 22 HB3 GLU 22 -12.901 8.149 -5.284
174 HG2 GLU 22 HG2 GLU 22 -11.963 7.744 -7.524
175 HG3 GLU 22 HG3 GLU 22 -12.737 6.161 -7.538
176 H VAL 23 H VAL 23 -10.715 8.880 -4.326
177 HA VAL 23 HA VAL 23 -10.902 8.210 -1.461
178 HB VAL 23 HB VAL 23 -8.783 9.741 -2.934
179 HG11 VAL 23 HG11 VAL 23 -9.850 10.284 -0.245
180 HG12 VAL 23 HG12 VAL 23 -8.095 10.147 -0.354
181 HG13 VAL 23 HG13 VAL 23 -8.950 11.330 -1.344
182 HG21 VAL 23 HG21 VAL 23 -8.028 8.079 -0.672
183 HG22 VAL 23 HG22 VAL 23 -8.920 7.185 -1.902
184 HG23 VAL 23 HG23 VAL 23 -7.448 8.053 -2.337
185 H THR 24 H THR 24 -12.574 9.263 -0.622
186 HA THR 24 HA THR 24 -13.667 11.633 -1.782
187 HB THR 24 HB THR 24 -14.269 10.352 0.891
188 HG1 THR 24 HG1 THR 24 -14.852 8.929 -0.702
189 HG21 THR 24 HG21 THR 24 -16.439 11.816 -0.298
190 HG22 THR 24 HG22 THR 24 -15.699 12.014 1.290
191 HG23 THR 24 HG23 THR 24 -15.034 12.864 -0.105
192 H MET 25 H MET 25 -13.042 13.660 -1.462
193 HA MET 25 HA MET 25 -11.709 14.348 1.069
194 HB2 MET 25 HB2 MET 25 -10.082 15.678 -0.050
195 HB3 MET 25 HB3 MET 25 -10.094 14.113 -0.853
196 HG2 MET 25 HG2 MET 25 -11.940 15.972 -2.082
197 HG3 MET 25 HG3 MET 25 -10.292 16.595 -2.050
198 HE1 MET 25 HE1 MET 25 -8.614 15.040 -4.846
199 HE2 MET 25 HE2 MET 25 -9.746 16.392 -4.866
200 HE3 MET 25 HE3 MET 25 -8.651 16.179 -3.500
201 H LYS 26 H LYS 26 -11.961 16.523 1.762
202 HA LYS 26 HA LYS 26 -14.282 17.871 0.546
203 HB2 LYS 26 HB2 LYS 26 -13.607 17.213 3.308
204 HB3 LYS 26 HB3 LYS 26 -14.010 18.912 3.099
205 HG2 LYS 26 HG2 LYS 26 -15.862 17.125 1.739
206 HG3 LYS 26 HG3 LYS 26 -15.794 16.868 3.484
207 HD2 LYS 26 HD2 LYS 26 -16.003 19.436 3.642
208 HD3 LYS 26 HD3 LYS 26 -16.549 19.342 1.966
209 HE2 LYS 26 HE2 LYS 26 -18.275 17.696 2.705
210 HE3 LYS 26 HE3 LYS 26 -17.787 18.008 4.370
211 HZ1 LYS 26 HZ1 LYS 26 -18.223 20.473 3.628
212 HZ2 LYS 26 HZ2 LYS 26 -19.249 19.728 2.507
213 HZ3 LYS 26 HZ3 LYS 26 -19.487 19.483 4.164
214 H LYS 27 H LYS 27 -13.980 19.834 -0.277
215 HA LYS 27 HA LYS 27 -11.619 21.052 -0.765
216 HB2 LYS 27 HB2 LYS 27 -13.901 21.739 -1.603
217 HB3 LYS 27 HB3 LYS 27 -14.111 22.620 -0.095
218 HG2 LYS 27 HG2 LYS 27 -12.116 23.963 -0.636
219 HG3 LYS 27 HG3 LYS 27 -11.998 23.119 -2.182
220 HD2 LYS 27 HD2 LYS 27 -13.391 24.618 -3.052
221 HD3 LYS 27 HD3 LYS 27 -14.654 24.021 -1.973
222 HE2 LYS 27 HE2 LYS 27 -14.438 26.396 -1.678
223 HE3 LYS 27 HE3 LYS 27 -13.835 25.587 -0.233
224 HZ1 LYS 27 HZ1 LYS 27 -11.621 25.823 -1.770
225 HZ2 LYS 27 HZ2 LYS 27 -12.444 27.262 -2.109
226 HZ3 LYS 27 HZ3 LYS 27 -12.049 26.869 -0.511
227 H GLY 28 H GLY 28 -10.038 21.328 0.700
228 HA2 GLY 28 HA2 GLY 28 -9.097 22.942 2.240
229 HA3 GLY 28 HA3 GLY 28 -10.664 23.022 3.031
230 H ASP 29 H ASP 29 -9.209 20.001 2.047
231 HA ASP 29 HA ASP 29 -8.621 19.402 4.870
232 HB2 ASP 29 HB2 ASP 29 -9.855 17.501 4.855
233 HB3 ASP 29 HB3 ASP 29 -10.714 18.302 3.542
234 H ILE 30 H ILE 30 -7.062 17.638 5.176
235 HA ILE 30 HA ILE 30 -5.052 17.649 3.026
236 HB ILE 30 HB ILE 30 -4.855 17.981 5.891
237 HG12 ILE 30 HG12 ILE 30 -3.855 19.310 3.907
238 HG13 ILE 30 HG13 ILE 30 -2.864 19.084 5.344
239 HG21 ILE 30 HG21 ILE 30 -4.330 15.636 5.980
240 HG22 ILE 30 HG22 ILE 30 -3.182 15.801 4.651
241 HG23 ILE 30 HG23 ILE 30 -2.845 16.561 6.207
242 HD11 ILE 30 HD11 ILE 30 -2.644 17.141 3.099
243 HD12 ILE 30 HD12 ILE 30 -1.860 18.716 2.975
244 HD13 ILE 30 HD13 ILE 30 -1.441 17.624 4.296
245 H LEU 31 H LEU 31 -4.139 15.757 2.308
246 HA LEU 31 HA LEU 31 -5.184 13.249 3.432
247 HB2 LEU 31 HB2 LEU 31 -4.853 12.687 0.765
248 HB3 LEU 31 HB3 LEU 31 -6.387 12.978 1.582
249 HG LEU 31 HG LEU 31 -4.869 15.279 0.428
250 HD11 LEU 31 HD11 LEU 31 -5.655 14.946 -1.727
251 HD12 LEU 31 HD12 LEU 31 -5.131 13.332 -1.246
252 HD13 LEU 31 HD13 LEU 31 -6.845 13.748 -1.217
253 HD21 LEU 31 HD21 LEU 31 -7.541 15.607 -0.047
254 HD22 LEU 31 HD22 LEU 31 -7.539 14.717 1.476
255 HD23 LEU 31 HD23 LEU 31 -6.667 16.244 1.346
256 H THR 32 H THR 32 -3.883 11.346 2.865
257 HA THR 32 HA THR 32 -1.038 12.049 2.797
258 HB THR 32 HB THR 32 -2.230 9.360 3.481
259 HG1 THR 32 HG1 THR 32 -1.335 11.262 5.380
260 HG21 THR 32 HG21 THR 32 -0.082 8.991 4.591
261 HG22 THR 32 HG22 THR 32 0.150 9.356 2.881
262 HG23 THR 32 HG23 THR 32 0.458 10.596 4.096
263 H LEU 33 H LEU 33 -0.145 12.003 0.841
264 HA LEU 33 HA LEU 33 -1.206 10.623 -1.379
265 HB2 LEU 33 HB2 LEU 33 1.271 12.133 -0.783
266 HB3 LEU 33 HB3 LEU 33 1.312 11.043 -2.167
267 HG LEU 33 HG LEU 33 0.770 13.459 -2.659
268 HD11 LEU 33 HD11 LEU 33 0.110 11.281 -3.980
269 HD12 LEU 33 HD12 LEU 33 -1.523 11.781 -3.540
270 HD13 LEU 33 HD13 LEU 33 -0.489 12.865 -4.471
271 HD21 LEU 33 HD21 LEU 33 -1.796 12.686 -1.276
272 HD22 LEU 33 HD22 LEU 33 -0.671 13.956 -0.798
273 HD23 LEU 33 HD23 LEU 33 -1.595 14.114 -2.292
274 H LEU 34 H LEU 34 -0.542 8.755 -2.427
275 HA LEU 34 HA LEU 34 1.207 6.975 -0.860
276 HB2 LEU 34 HB2 LEU 34 -1.474 6.582 -1.967
277 HB3 LEU 34 HB3 LEU 34 -0.342 5.286 -2.351
278 HG LEU 34 HG LEU 34 -0.517 6.147 0.484
279 HD11 LEU 34 HD11 LEU 34 -2.434 4.265 0.472
280 HD12 LEU 34 HD12 LEU 34 -2.766 5.997 0.430
281 HD13 LEU 34 HD13 LEU 34 -2.779 5.061 -1.064
282 HD21 LEU 34 HD21 LEU 34 -0.463 3.389 -0.714
283 HD22 LEU 34 HD22 LEU 34 0.997 4.347 -0.463
284 HD23 LEU 34 HD23 LEU 34 -0.004 3.886 0.915
285 H ASN 35 H ASN 35 -0.186 7.224 -4.139
286 HA ASN 35 HA ASN 35 2.229 6.065 -5.263
287 HB2 ASN 35 HB2 ASN 35 0.067 5.316 -6.125
288 HB3 ASN 35 HB3 ASN 35 -0.339 6.967 -6.585
289 HD21 ASN 35 HD21 ASN 35 2.711 5.223 -6.935
290 HD22 ASN 35 HD22 ASN 35 2.773 5.321 -8.659
291 H SER 36 H SER 36 0.266 8.862 -6.274
292 HA SER 36 HA SER 36 0.838 10.957 -6.959
293 HB2 SER 36 HB2 SER 36 2.863 10.273 -4.999
294 HB3 SER 36 HB3 SER 36 3.523 11.320 -6.255
295 HG SER 36 HG SER 36 1.803 12.769 -5.838
296 H THR 37 H THR 37 1.610 8.367 -8.400
297 HA THR 37 HA THR 37 3.734 9.390 -10.141
298 HB THR 37 HB THR 37 2.476 6.640 -10.068
299 HG1 THR 37 HG1 THR 37 5.033 7.512 -9.152
300 HG21 THR 37 HG21 THR 37 3.334 6.608 -12.168
301 HG22 THR 37 HG22 THR 37 4.447 7.938 -11.849
302 HG23 THR 37 HG23 THR 37 4.843 6.307 -11.305
303 H ASN 38 H ASN 38 0.351 8.476 -10.131
304 HA ASN 38 HA ASN 38 0.136 9.015 -12.999
305 HB2 ASN 38 HB2 ASN 38 -0.984 7.009 -12.333
306 HB3 ASN 38 HB3 ASN 38 -1.789 7.828 -10.997
307 HD21 ASN 38 HD21 ASN 38 -1.376 8.767 -14.383
308 HD22 ASN 38 HD22 ASN 38 -3.064 8.883 -14.737
309 H LYS 39 H LYS 39 0.156 11.187 -13.279
310 HA LYS 39 HA LYS 39 -0.784 13.174 -11.646
311 HB2 LYS 39 HB2 LYS 39 0.475 13.736 -13.602
312 HB3 LYS 39 HB3 LYS 39 -0.740 13.030 -14.660
313 HG2 LYS 39 HG2 LYS 39 -2.316 14.777 -14.046
314 HG3 LYS 39 HG3 LYS 39 -1.127 15.474 -12.943
315 HD2 LYS 39 HD2 LYS 39 0.335 16.016 -14.763
316 HD3 LYS 39 HD3 LYS 39 -0.681 15.134 -15.906
317 HE2 LYS 39 HE2 LYS 39 -2.224 17.107 -14.485
318 HE3 LYS 39 HE3 LYS 39 -0.817 17.851 -15.243
319 HZ1 LYS 39 HZ1 LYS 39 -3.192 17.147 -16.460
320 HZ2 LYS 39 HZ2 LYS 39 -1.779 17.689 -17.216
321 HZ3 LYS 39 HZ3 LYS 39 -2.053 16.030 -17.024
322 H ASP 40 H ASP 40 -2.618 11.522 -14.211
323 HA ASP 40 HA ASP 40 -5.018 12.841 -14.023
324 HB2 ASP 40 HB2 ASP 40 -4.854 9.846 -14.334
325 HB3 ASP 40 HB3 ASP 40 -6.039 10.948 -15.029
326 H TRP 41 H TRP 41 -3.907 10.111 -12.048
327 HA TRP 41 HA TRP 41 -5.794 10.923 -9.968
328 HB2 TRP 41 HB2 TRP 41 -5.675 8.205 -11.254
329 HB3 TRP 41 HB3 TRP 41 -6.269 8.413 -9.609
330 HD1 TRP 41 HD1 TRP 41 -7.205 9.099 -13.242
331 HE1 TRP 41 HE1 TRP 41 -9.687 9.773 -13.346
332 HE3 TRP 41 HE3 TRP 41 -8.141 9.524 -8.234
333 HZ2 TRP 41 HZ2 TRP 41 -11.766 10.403 -11.544
334 HZ3 TRP 41 HZ3 TRP 41 -10.403 10.167 -7.508
335 HH2 TRP 41 HH2 TRP 41 -12.176 10.597 -9.130
336 H TRP 42 H TRP 42 -4.654 11.218 -8.181
337 HA TRP 42 HA TRP 42 -2.152 9.739 -7.819
338 HB2 TRP 42 HB2 TRP 42 -3.247 12.275 -6.624
339 HB3 TRP 42 HB3 TRP 42 -1.876 11.440 -5.899
340 HD1 TRP 42 HD1 TRP 42 -0.667 10.635 -8.898
341 HE1 TRP 42 HE1 TRP 42 0.631 12.475 -10.146
342 HE3 TRP 42 HE3 TRP 42 -2.463 14.724 -6.410
343 HZ2 TRP 42 HZ2 TRP 42 0.862 15.287 -10.083
344 HZ3 TRP 42 HZ3 TRP 42 -1.652 16.953 -7.065
345 HH2 TRP 42 HH2 TRP 42 -0.023 17.226 -8.863
346 H LYS 43 H LYS 43 -2.443 7.853 -6.810
347 HA LYS 43 HA LYS 43 -4.560 7.185 -5.115
348 HB2 LYS 43 HB2 LYS 43 -3.196 5.488 -6.197
349 HB3 LYS 43 HB3 LYS 43 -1.781 6.004 -5.287
350 HG2 LYS 43 HG2 LYS 43 -3.482 5.455 -3.267
351 HG3 LYS 43 HG3 LYS 43 -4.034 4.298 -4.481
352 HD2 LYS 43 HD2 LYS 43 -1.113 4.492 -4.128
353 HD3 LYS 43 HD3 LYS 43 -2.008 3.827 -2.760
354 HE2 LYS 43 HE2 LYS 43 -3.127 2.276 -4.409
355 HE3 LYS 43 HE3 LYS 43 -1.951 2.828 -5.600
356 HZ1 LYS 43 HZ1 LYS 43 -1.499 0.713 -4.172
357 HZ2 LYS 43 HZ2 LYS 43 -0.239 1.783 -4.531
358 HZ3 LYS 43 HZ3 LYS 43 -0.985 1.833 -3.014
359 H VAL 44 H VAL 44 -4.974 7.545 -3.028
360 HA VAL 44 HA VAL 44 -2.792 8.297 -1.227
361 HB VAL 44 HB VAL 44 -3.960 10.203 -0.336
362 HG11 VAL 44 HG11 VAL 44 -4.226 10.785 -3.227
363 HG12 VAL 44 HG12 VAL 44 -3.367 11.669 -1.965
364 HG13 VAL 44 HG13 VAL 44 -2.656 10.213 -2.662
365 HG21 VAL 44 HG21 VAL 44 -6.245 9.442 -0.593
366 HG22 VAL 44 HG22 VAL 44 -6.054 11.023 -1.349
367 HG23 VAL 44 HG23 VAL 44 -6.118 9.570 -2.347
368 H GLU 45 H GLU 45 -3.661 8.475 1.089
369 HA GLU 45 HA GLU 45 -5.719 6.410 1.516
370 HB2 GLU 45 HB2 GLU 45 -3.643 5.419 2.119
371 HB3 GLU 45 HB3 GLU 45 -3.121 6.864 2.974
372 HG2 GLU 45 HG2 GLU 45 -4.718 6.488 4.716
373 HG3 GLU 45 HG3 GLU 45 -5.440 5.149 3.825
374 H VAL 46 H VAL 46 -7.418 7.035 2.669
375 HA VAL 46 HA VAL 46 -7.120 9.148 4.671
376 HB VAL 46 HB VAL 46 -9.308 10.152 3.832
377 HG11 VAL 46 HG11 VAL 46 -7.174 10.576 1.797
378 HG12 VAL 46 HG12 VAL 46 -8.163 11.756 2.657
379 HG13 VAL 46 HG13 VAL 46 -6.830 10.951 3.485
380 HG21 VAL 46 HG21 VAL 46 -9.679 8.148 2.275
381 HG22 VAL 46 HG22 VAL 46 -10.035 9.756 1.645
382 HG23 VAL 46 HG23 VAL 46 -8.535 8.945 1.196
383 H ASN 47 H ASN 47 -8.261 8.764 6.473
384 HA ASN 47 HA ASN 47 -9.395 7.457 7.985
385 HB2 ASN 47 HB2 ASN 47 -11.889 7.208 7.171
386 HB3 ASN 47 HB3 ASN 47 -11.233 8.793 7.570
387 HD21 ASN 47 HD21 ASN 47 -12.205 6.652 5.008
388 HD22 ASN 47 HD22 ASN 47 -12.277 7.849 3.764
389 H ASP 48 H ASP 48 -7.905 5.645 7.181
390 HA ASP 48 HA ASP 48 -7.560 3.503 6.427
391 HB2 ASP 48 HB2 ASP 48 -9.243 3.536 8.548
392 HB3 ASP 48 HB3 ASP 48 -10.236 2.673 7.376
393 H ARG 49 H ARG 49 -8.684 5.176 4.416
394 HA ARG 49 HA ARG 49 -9.891 3.114 2.748
395 HB2 ARG 49 HB2 ARG 49 -11.342 5.392 3.808
396 HB3 ARG 49 HB3 ARG 49 -11.322 5.407 2.050
397 HG2 ARG 49 HG2 ARG 49 -12.107 2.976 3.625
398 HG3 ARG 49 HG3 ARG 49 -13.263 4.227 3.165
399 HD2 ARG 49 HD2 ARG 49 -11.740 3.545 0.868
400 HD3 ARG 49 HD3 ARG 49 -12.290 2.048 1.621
401 HE ARG 49 HE ARG 49 -13.907 4.018 0.292
402 HH11 ARG 49 HH11 ARG 49 -13.874 1.455 2.647
403 HH12 ARG 49 HH12 ARG 49 -15.563 1.108 2.485
404 HH21 ARG 49 HH21 ARG 49 -16.132 3.571 0.070
405 HH22 ARG 49 HH22 ARG 49 -16.847 2.312 1.019
406 H GLN 50 H GLN 50 -7.857 3.152 1.695
407 HA GLN 50 HA GLN 50 -7.063 5.620 0.366
408 HB2 GLN 50 HB2 GLN 50 -5.015 4.535 -0.151
409 HB3 GLN 50 HB3 GLN 50 -5.408 4.085 1.503
410 HG2 GLN 50 HG2 GLN 50 -4.959 2.010 0.824
411 HG3 GLN 50 HG3 GLN 50 -6.571 2.065 0.114
412 HE21 GLN 50 HE21 GLN 50 -3.194 2.840 -0.608
413 HE22 GLN 50 HE22 GLN 50 -3.272 2.415 -2.280
414 H GLY 51 H GLY 51 -6.882 5.848 -1.876
415 HA2 GLY 51 HA2 GLY 51 -7.682 3.740 -3.661
416 HA3 GLY 51 HA3 GLY 51 -8.921 4.971 -3.464
417 H PHE 52 H PHE 52 -8.850 6.664 -4.785
418 HA PHE 52 HA PHE 52 -6.283 7.509 -5.905
419 HB2 PHE 52 HB2 PHE 52 -8.706 6.706 -7.515
420 HB3 PHE 52 HB3 PHE 52 -7.419 7.712 -8.171
421 HD1 PHE 52 HD1 PHE 52 -8.597 4.596 -8.397
422 HD2 PHE 52 HD2 PHE 52 -4.984 6.559 -7.294
423 HE1 PHE 52 HE1 PHE 52 -7.323 2.574 -8.983
424 HE2 PHE 52 HE2 PHE 52 -3.705 4.541 -7.880
425 HZ PHE 52 HZ PHE 52 -4.874 2.545 -8.726
426 H VAL 53 H VAL 53 -6.068 9.644 -5.807
427 HA VAL 53 HA VAL 53 -8.496 11.274 -5.455
428 HB VAL 53 HB VAL 53 -6.309 11.129 -3.803
429 HG11 VAL 53 HG11 VAL 53 -5.046 13.162 -4.019
430 HG12 VAL 53 HG12 VAL 53 -4.953 12.277 -5.542
431 HG13 VAL 53 HG13 VAL 53 -6.022 13.672 -5.397
432 HG21 VAL 53 HG21 VAL 53 -7.595 12.446 -2.532
433 HG22 VAL 53 HG22 VAL 53 -7.606 13.740 -3.730
434 HG23 VAL 53 HG23 VAL 53 -8.744 12.399 -3.869
435 HA PRO 54 HA PRO 54 -7.647 13.180 -9.346
436 HB2 PRO 54 HB2 PRO 54 -9.210 15.379 -9.036
437 HB3 PRO 54 HB3 PRO 54 -9.868 13.770 -9.358
438 HG2 PRO 54 HG2 PRO 54 -9.629 15.232 -6.757
439 HG3 PRO 54 HG3 PRO 54 -10.985 14.277 -7.383
440 HD2 PRO 54 HD2 PRO 54 -9.230 13.299 -5.567
441 HD3 PRO 54 HD3 PRO 54 -10.014 12.274 -6.787
442 H ALA 55 H ALA 55 -5.760 14.133 -9.764
443 HA ALA 55 HA ALA 55 -4.366 15.810 -7.991
444 HB1 ALA 55 HB1 ALA 55 -2.802 16.161 -9.789
445 HB2 ALA 55 HB2 ALA 55 -3.315 14.474 -9.791
446 HB3 ALA 55 HB3 ALA 55 -3.982 15.599 -10.974
447 H ALA 56 H ALA 56 -5.981 16.640 -11.065
448 HA ALA 56 HA ALA 56 -5.640 19.357 -11.060
449 HB1 ALA 56 HB1 ALA 56 -8.121 17.876 -11.925
450 HB2 ALA 56 HB2 ALA 56 -7.665 19.508 -12.414
451 HB3 ALA 56 HB3 ALA 56 -6.675 18.132 -12.901
452 H TYR 57 H TYR 57 -7.910 17.466 -9.166
453 HA TYR 57 HA TYR 57 -9.113 19.892 -8.067
454 HB2 TYR 57 HB2 TYR 57 -9.808 16.966 -7.789
455 HB3 TYR 57 HB3 TYR 57 -10.618 18.239 -6.882
456 HD1 TYR 57 HD1 TYR 57 -11.393 20.281 -8.505
457 HD2 TYR 57 HD2 TYR 57 -10.913 16.215 -9.660
458 HE1 TYR 57 HE1 TYR 57 -12.943 20.637 -10.381
459 HE2 TYR 57 HE2 TYR 57 -12.460 16.560 -11.540
460 HH TYR 57 HH TYR 57 -14.383 18.183 -12.065
461 H VAL 58 H VAL 58 -6.423 19.520 -7.424
462 HA VAL 58 HA VAL 58 -6.623 19.346 -4.524
463 HB VAL 58 HB VAL 58 -5.762 17.115 -5.791
464 HG11 VAL 58 HG11 VAL 58 -3.199 18.473 -5.016
465 HG12 VAL 58 HG12 VAL 58 -3.427 16.975 -5.919
466 HG13 VAL 58 HG13 VAL 58 -3.817 18.524 -6.667
467 HG21 VAL 58 HG21 VAL 58 -4.908 16.406 -3.683
468 HG22 VAL 58 HG22 VAL 58 -4.585 18.068 -3.187
469 HG23 VAL 58 HG23 VAL 58 -6.248 17.506 -3.360
470 H LYS 59 H LYS 59 -4.453 19.979 -3.512
471 HA LYS 59 HA LYS 59 -2.745 21.642 -5.141
472 HB2 LYS 59 HB2 LYS 59 -4.991 22.796 -3.830
473 HB3 LYS 59 HB3 LYS 59 -3.546 23.328 -2.980
474 HG2 LYS 59 HG2 LYS 59 -2.667 24.364 -4.884
475 HG3 LYS 59 HG3 LYS 59 -3.772 23.510 -5.964
476 HD2 LYS 59 HD2 LYS 59 -5.644 24.740 -4.736
477 HD3 LYS 59 HD3 LYS 59 -4.372 25.768 -4.073
478 HE2 LYS 59 HE2 LYS 59 -3.786 26.593 -6.189
479 HE3 LYS 59 HE3 LYS 59 -4.636 25.295 -7.026
480 HZ1 LYS 59 HZ1 LYS 59 -6.563 26.395 -6.929
481 HZ2 LYS 59 HZ2 LYS 59 -6.320 26.916 -5.338
482 HZ3 LYS 59 HZ3 LYS 59 -5.619 27.766 -6.622
483 H LYS 60 H LYS 60 -0.794 21.086 -4.454
484 HA LYS 60 HA LYS 60 -0.263 19.882 -1.960
485 HB2 LYS 60 HB2 LYS 60 1.079 19.915 -4.242
486 HB3 LYS 60 HB3 LYS 60 1.910 21.261 -3.474
487 HG2 LYS 60 HG2 LYS 60 1.663 18.483 -2.338
488 HG3 LYS 60 HG3 LYS 60 3.086 19.145 -3.145
489 HD2 LYS 60 HD2 LYS 60 2.666 21.045 -1.277
490 HD3 LYS 60 HD3 LYS 60 2.044 19.629 -0.427
491 HE2 LYS 60 HE2 LYS 60 4.493 18.930 -1.708
492 HE3 LYS 60 HE3 LYS 60 4.738 20.420 -0.798
493 HZ1 LYS 60 HZ1 LYS 60 4.871 19.195 1.024
494 HZ2 LYS 60 HZ2 LYS 60 3.259 18.721 0.821
495 HZ3 LYS 60 HZ3 LYS 60 4.505 17.782 0.168
496 H LEU 61 H LEU 61 -0.998 21.189 -0.292
497 HA LEU 61 HA LEU 61 0.546 23.662 0.134
498 HB2 LEU 61 HB2 LEU 61 -2.207 23.119 1.217
499 HB3 LEU 61 HB3 LEU 61 -1.318 24.640 1.246
500 HG LEU 61 HG LEU 61 -2.099 23.403 -1.366
501 HD11 LEU 61 HD11 LEU 61 -3.925 24.276 0.665
502 HD12 LEU 61 HD12 LEU 61 -4.003 25.358 -0.726
503 HD13 LEU 61 HD13 LEU 61 -4.262 23.626 -0.939
504 HD21 LEU 61 HD21 LEU 61 -0.658 25.218 -1.653
505 HD22 LEU 61 HD22 LEU 61 -2.264 25.909 -1.883
506 HD23 LEU 61 HD23 LEU 61 -1.414 26.143 -0.355
507 H ASP 62 H ASP 62 1.850 21.600 0.998
508 HA ASP 62 HA ASP 62 1.671 21.804 3.884
509 HB2 ASP 62 HB2 ASP 62 0.306 19.741 2.857
510 HB3 ASP 62 HB3 ASP 62 1.907 19.008 2.900
Start of MODEL 4
1 H1 MET 1 H MET 1 0.043 0.915 1.970
2 HA MET 1 HA MET 1 2.033 0.112 1.206
3 HB2 MET 1 HB2 MET 1 0.891 0.936 -1.466
4 HB3 MET 1 HB3 MET 1 2.421 0.089 -1.278
5 HG2 MET 1 HG2 MET 1 0.296 -1.253 0.139
6 HG3 MET 1 HG3 MET 1 -0.096 -1.038 -1.566
7 HE1 MET 1 HE1 MET 1 -0.411 -3.245 -1.783
8 HE2 MET 1 HE2 MET 1 0.774 -3.802 -2.964
9 HE3 MET 1 HE3 MET 1 0.673 -4.577 -1.383
10 H ASP 2 H ASP 2 1.644 2.716 -1.170
11 HA ASP 2 HA ASP 2 2.821 4.625 -1.554
12 HB2 ASP 2 HB2 ASP 2 2.097 4.983 0.899
13 HB3 ASP 2 HB3 ASP 2 3.761 4.572 1.304
14 H GLU 3 H GLU 3 4.426 4.079 -2.917
15 HA GLU 3 HA GLU 3 7.079 3.748 -1.826
16 HB2 GLU 3 HB2 GLU 3 5.821 1.424 -2.167
17 HB3 GLU 3 HB3 GLU 3 6.352 1.665 -3.825
18 HG2 GLU 3 HG2 GLU 3 8.431 2.105 -1.812
19 HG3 GLU 3 HG3 GLU 3 7.807 0.457 -1.880
20 H THR 4 H THR 4 6.379 5.913 -3.097
21 HA THR 4 HA THR 4 7.963 5.866 -5.490
22 HB THR 4 HB THR 4 5.136 6.826 -5.868
23 HG1 THR 4 HG1 THR 4 4.703 4.725 -5.688
24 HG21 THR 4 HG21 THR 4 7.564 6.580 -7.502
25 HG22 THR 4 HG22 THR 4 6.092 6.000 -8.282
26 HG23 THR 4 HG23 THR 4 6.179 7.657 -7.684
27 H GLY 5 H GLY 5 5.732 7.655 -3.413
28 HA2 GLY 5 HA2 GLY 5 7.536 9.759 -2.945
29 HA3 GLY 5 HA3 GLY 5 6.432 10.251 -4.220
30 H LYS 6 H LYS 6 6.749 9.435 -0.846
31 HA LYS 6 HA LYS 6 3.959 9.812 -0.250
32 HB2 LYS 6 HB2 LYS 6 4.730 9.680 2.125
33 HB3 LYS 6 HB3 LYS 6 5.194 8.297 1.142
34 HG2 LYS 6 HG2 LYS 6 7.311 10.106 0.923
35 HG3 LYS 6 HG3 LYS 6 6.842 10.125 2.624
36 HD2 LYS 6 HD2 LYS 6 7.473 7.970 2.961
37 HD3 LYS 6 HD3 LYS 6 7.025 7.471 1.329
38 HE2 LYS 6 HE2 LYS 6 9.066 9.014 0.678
39 HE3 LYS 6 HE3 LYS 6 9.564 8.658 2.331
40 HZ1 LYS 6 HZ1 LYS 6 10.187 6.626 1.740
41 HZ2 LYS 6 HZ2 LYS 6 8.719 6.307 0.963
42 HZ3 LYS 6 HZ3 LYS 6 9.969 7.081 0.125
43 H GLU 7 H GLU 7 3.015 11.734 -0.191
44 HA GLU 7 HA GLU 7 4.368 13.962 1.110
45 HB2 GLU 7 HB2 GLU 7 3.779 15.506 -0.750
46 HB3 GLU 7 HB3 GLU 7 4.990 14.311 -1.191
47 HG2 GLU 7 HG2 GLU 7 2.736 13.027 -1.936
48 HG3 GLU 7 HG3 GLU 7 2.263 14.704 -2.202
49 H LEU 8 H LEU 8 2.646 15.971 0.727
50 HA LEU 8 HA LEU 8 0.025 14.899 1.538
51 HB2 LEU 8 HB2 LEU 8 -0.117 17.013 2.961
52 HB3 LEU 8 HB3 LEU 8 0.907 15.699 3.536
53 HG LEU 8 HG LEU 8 2.870 16.953 2.585
54 HD11 LEU 8 HD11 LEU 8 2.329 18.582 1.150
55 HD12 LEU 8 HD12 LEU 8 0.695 18.742 1.796
56 HD13 LEU 8 HD13 LEU 8 2.043 19.551 2.596
57 HD21 LEU 8 HD21 LEU 8 3.161 17.599 4.686
58 HD22 LEU 8 HD22 LEU 8 1.987 18.900 4.483
59 HD23 LEU 8 HD23 LEU 8 1.450 17.299 4.992
60 H VAL 9 H VAL 9 -1.802 16.269 1.101
61 HA VAL 9 HA VAL 9 -1.406 18.523 -0.690
62 HB VAL 9 HB VAL 9 -2.869 17.653 -2.436
63 HG11 VAL 9 HG11 VAL 9 -0.553 15.819 -1.828
64 HG12 VAL 9 HG12 VAL 9 -1.343 15.985 -3.395
65 HG13 VAL 9 HG13 VAL 9 -0.472 17.351 -2.698
66 HG21 VAL 9 HG21 VAL 9 -4.238 16.143 -1.145
67 HG22 VAL 9 HG22 VAL 9 -3.470 15.250 -2.457
68 HG23 VAL 9 HG23 VAL 9 -2.848 15.111 -0.813
69 H LEU 10 H LEU 10 -3.483 19.614 -1.205
70 HA LEU 10 HA LEU 10 -5.414 19.254 0.992
71 HB2 LEU 10 HB2 LEU 10 -4.240 21.676 -0.272
72 HB3 LEU 10 HB3 LEU 10 -5.901 21.763 0.309
73 HG LEU 10 HG LEU 10 -3.995 22.557 1.851
74 HD11 LEU 10 HD11 LEU 10 -6.512 21.362 2.319
75 HD12 LEU 10 HD12 LEU 10 -5.415 20.793 3.576
76 HD13 LEU 10 HD13 LEU 10 -5.646 22.523 3.325
77 HD21 LEU 10 HD21 LEU 10 -2.584 20.556 1.504
78 HD22 LEU 10 HD22 LEU 10 -2.953 20.852 3.203
79 HD23 LEU 10 HD23 LEU 10 -3.807 19.584 2.323
80 H ALA 11 H ALA 11 -7.572 19.210 0.533
81 HA ALA 11 HA ALA 11 -8.367 18.440 -2.070
82 HB1 ALA 11 HB1 ALA 11 -9.799 19.013 0.484
83 HB2 ALA 11 HB2 ALA 11 -10.723 18.837 -1.008
84 HB3 ALA 11 HB3 ALA 11 -9.702 17.515 -0.442
85 H LEU 12 H LEU 12 -8.399 19.800 -3.739
86 HA LEU 12 HA LEU 12 -8.899 22.619 -3.392
87 HB2 LEU 12 HB2 LEU 12 -7.270 21.563 -5.036
88 HB3 LEU 12 HB3 LEU 12 -8.683 21.138 -5.999
89 HG LEU 12 HG LEU 12 -8.858 23.904 -5.438
90 HD11 LEU 12 HD11 LEU 12 -6.145 23.083 -6.463
91 HD12 LEU 12 HD12 LEU 12 -6.784 24.726 -6.441
92 HD13 LEU 12 HD13 LEU 12 -6.481 23.877 -4.925
93 HD21 LEU 12 HD21 LEU 12 -9.797 23.303 -7.421
94 HD22 LEU 12 HD22 LEU 12 -8.229 23.848 -8.018
95 HD23 LEU 12 HD23 LEU 12 -8.536 22.127 -7.791
96 H TYR 13 H TYR 13 -10.703 19.805 -4.282
97 HA TYR 13 HA TYR 13 -13.103 21.455 -4.539
98 HB2 TYR 13 HB2 TYR 13 -12.550 21.141 -6.831
99 HB3 TYR 13 HB3 TYR 13 -12.146 19.447 -6.576
100 HD1 TYR 13 HD1 TYR 13 -13.627 18.071 -7.679
101 HD2 TYR 13 HD2 TYR 13 -15.127 21.550 -5.743
102 HE1 TYR 13 HE1 TYR 13 -15.916 17.427 -8.308
103 HE2 TYR 13 HE2 TYR 13 -17.420 20.915 -6.365
104 HH TYR 13 HH TYR 13 -18.682 18.956 -6.993
105 H ASP 14 H ASP 14 -14.842 20.603 -3.555
106 HA ASP 14 HA ASP 14 -14.572 18.407 -1.824
107 HB2 ASP 14 HB2 ASP 14 -17.123 19.676 -2.843
108 HB3 ASP 14 HB3 ASP 14 -16.971 18.659 -1.413
109 H TYR 15 H TYR 15 -14.103 16.457 -2.680
110 HA TYR 15 HA TYR 15 -15.793 15.454 -4.865
111 HB2 TYR 15 HB2 TYR 15 -13.051 15.437 -4.612
112 HB3 TYR 15 HB3 TYR 15 -13.490 13.811 -4.098
113 HD1 TYR 15 HD1 TYR 15 -13.106 16.053 -6.894
114 HD2 TYR 15 HD2 TYR 15 -14.812 12.355 -5.663
115 HE1 TYR 15 HE1 TYR 15 -13.319 15.375 -9.249
116 HE2 TYR 15 HE2 TYR 15 -15.029 11.666 -8.014
117 HH TYR 15 HH TYR 15 -13.651 13.555 -10.618
118 H GLN 16 H GLN 16 -17.226 13.893 -4.494
119 HA GLN 16 HA GLN 16 -17.289 12.669 -1.838
120 HB2 GLN 16 HB2 GLN 16 -19.326 13.098 -3.992
121 HB3 GLN 16 HB3 GLN 16 -19.589 11.852 -2.779
122 HG2 GLN 16 HG2 GLN 16 -20.692 13.952 -2.200
123 HG3 GLN 16 HG3 GLN 16 -19.470 13.496 -1.013
124 HE21 GLN 16 HE21 GLN 16 -18.835 15.400 -0.224
125 HE22 GLN 16 HE22 GLN 16 -18.198 16.702 -1.164
126 H GLU 17 H GLU 17 -16.620 11.929 -5.126
127 HA GLU 17 HA GLU 17 -15.910 10.032 -6.164
128 HB2 GLU 17 HB2 GLU 17 -15.738 8.815 -3.405
129 HB3 GLU 17 HB3 GLU 17 -14.893 8.287 -4.854
130 HG2 GLU 17 HG2 GLU 17 -14.477 10.924 -3.466
131 HG3 GLU 17 HG3 GLU 17 -13.441 9.508 -3.303
132 H LYS 18 H LYS 18 -16.344 7.330 -5.573
133 HA LYS 18 HA LYS 18 -18.996 6.713 -4.863
134 HB2 LYS 18 HB2 LYS 18 -18.613 7.690 -7.568
135 HB3 LYS 18 HB3 LYS 18 -19.246 6.049 -7.564
136 HG2 LYS 18 HG2 LYS 18 -21.270 6.762 -7.021
137 HG3 LYS 18 HG3 LYS 18 -20.642 7.667 -5.641
138 HD2 LYS 18 HD2 LYS 18 -20.663 9.620 -6.758
139 HD3 LYS 18 HD3 LYS 18 -20.089 8.882 -8.255
140 HE2 LYS 18 HE2 LYS 18 -22.313 8.074 -8.750
141 HE3 LYS 18 HE3 LYS 18 -22.909 8.676 -7.204
142 HZ1 LYS 18 HZ1 LYS 18 -21.621 10.685 -8.813
143 HZ2 LYS 18 HZ2 LYS 18 -23.001 10.028 -9.538
144 HZ3 LYS 18 HZ3 LYS 18 -23.106 10.735 -8.004
145 H SER 19 H SER 19 -16.166 5.904 -6.781
146 HA SER 19 HA SER 19 -16.724 3.056 -6.604
147 HB2 SER 19 HB2 SER 19 -15.099 4.753 -8.283
148 HB3 SER 19 HB3 SER 19 -14.130 3.436 -7.624
149 HG SER 19 HG SER 19 -16.570 3.201 -9.056
150 HA PRO 20 HA PRO 20 -14.253 2.158 -3.093
151 HB2 PRO 20 HB2 PRO 20 -13.089 -0.192 -3.798
152 HB3 PRO 20 HB3 PRO 20 -14.805 -0.052 -3.396
153 HG2 PRO 20 HG2 PRO 20 -13.491 -0.148 -6.084
154 HG3 PRO 20 HG3 PRO 20 -14.961 -0.969 -5.527
155 HD2 PRO 20 HD2 PRO 20 -15.029 1.288 -7.023
156 HD3 PRO 20 HD3 PRO 20 -16.267 0.910 -5.807
157 H ARG 21 H ARG 21 -12.705 2.336 -6.210
158 HA ARG 21 HA ARG 21 -10.041 2.434 -5.034
159 HB2 ARG 21 HB2 ARG 21 -9.215 2.448 -7.299
160 HB3 ARG 21 HB3 ARG 21 -10.445 1.199 -7.154
161 HG2 ARG 21 HG2 ARG 21 -11.457 3.809 -8.021
162 HG3 ARG 21 HG3 ARG 21 -10.329 3.040 -9.140
163 HD2 ARG 21 HD2 ARG 21 -12.907 1.917 -8.062
164 HD3 ARG 21 HD3 ARG 21 -12.538 2.349 -9.731
165 HE ARG 21 HE ARG 21 -10.685 0.463 -9.146
166 HH11 ARG 21 HH11 ARG 21 -14.154 0.588 -8.881
167 HH12 ARG 21 HH12 ARG 21 -14.364 -1.114 -9.129
168 HH21 ARG 21 HH21 ARG 21 -10.949 -1.779 -9.474
169 HH22 ARG 21 HH22 ARG 21 -12.541 -2.459 -9.466
170 H GLU 22 H GLU 22 -12.255 4.540 -4.770
171 HA GLU 22 HA GLU 22 -10.691 6.840 -5.742
172 HB2 GLU 22 HB2 GLU 22 -13.639 6.437 -5.354
173 HB3 GLU 22 HB3 GLU 22 -12.954 8.056 -5.323
174 HG2 GLU 22 HG2 GLU 22 -12.018 7.674 -7.567
175 HG3 GLU 22 HG3 GLU 22 -12.791 6.091 -7.596
176 H VAL 23 H VAL 23 -10.766 8.782 -4.363
177 HA VAL 23 HA VAL 23 -10.952 8.088 -1.503
178 HB VAL 23 HB VAL 23 -8.829 9.631 -2.961
179 HG11 VAL 23 HG11 VAL 23 -8.148 9.983 -0.363
180 HG12 VAL 23 HG12 VAL 23 -8.969 11.194 -1.348
181 HG13 VAL 23 HG13 VAL 23 -9.901 10.150 -0.275
182 HG21 VAL 23 HG21 VAL 23 -7.461 7.968 -2.337
183 HG22 VAL 23 HG22 VAL 23 -8.138 7.894 -0.711
184 HG23 VAL 23 HG23 VAL 23 -8.944 7.061 -2.040
185 H THR 24 H THR 24 -12.613 9.143 -0.648
186 HA THR 24 HA THR 24 -13.707 11.521 -1.792
187 HB THR 24 HB THR 24 -14.296 10.228 0.878
188 HG1 THR 24 HG1 THR 24 -15.833 9.106 -0.195
189 HG21 THR 24 HG21 THR 24 -15.718 11.893 1.296
190 HG22 THR 24 HG22 THR 24 -15.060 12.748 -0.098
191 HG23 THR 24 HG23 THR 24 -16.470 11.706 -0.288
192 H MET 25 H MET 25 -13.108 13.553 -1.449
193 HA MET 25 HA MET 25 -11.744 14.223 1.069
194 HB2 MET 25 HB2 MET 25 -10.125 15.557 -0.051
195 HB3 MET 25 HB3 MET 25 -10.149 14.004 -0.876
196 HG2 MET 25 HG2 MET 25 -12.008 15.866 -2.068
197 HG3 MET 25 HG3 MET 25 -10.369 16.512 -2.029
198 HE1 MET 25 HE1 MET 25 -9.704 16.348 -4.802
199 HE2 MET 25 HE2 MET 25 -8.659 16.064 -3.410
200 HE3 MET 25 HE3 MET 25 -8.612 14.963 -4.787
201 H LYS 26 H LYS 26 -11.992 16.394 1.779
202 HA LYS 26 HA LYS 26 -14.320 17.752 0.586
203 HB2 LYS 26 HB2 LYS 26 -13.478 17.312 3.414
204 HB3 LYS 26 HB3 LYS 26 -14.333 18.798 3.025
205 HG2 LYS 26 HG2 LYS 26 -15.775 16.731 1.796
206 HG3 LYS 26 HG3 LYS 26 -15.366 16.157 3.415
207 HD2 LYS 26 HD2 LYS 26 -17.317 17.274 3.859
208 HD3 LYS 26 HD3 LYS 26 -16.151 18.575 4.106
209 HE2 LYS 26 HE2 LYS 26 -17.036 19.768 2.450
210 HE3 LYS 26 HE3 LYS 26 -16.916 18.408 1.335
211 HZ1 LYS 26 HZ1 LYS 26 -19.207 19.190 1.647
212 HZ2 LYS 26 HZ2 LYS 26 -19.014 17.578 2.124
213 HZ3 LYS 26 HZ3 LYS 26 -19.116 18.800 3.291
214 H LYS 27 H LYS 27 -14.006 19.715 -0.228
215 HA LYS 27 HA LYS 27 -11.638 20.940 -0.678
216 HB2 LYS 27 HB2 LYS 27 -13.918 21.620 -1.542
217 HB3 LYS 27 HB3 LYS 27 -14.138 22.506 -0.039
218 HG2 LYS 27 HG2 LYS 27 -12.143 23.848 -0.565
219 HG3 LYS 27 HG3 LYS 27 -12.000 22.993 -2.103
220 HD2 LYS 27 HD2 LYS 27 -13.127 24.971 -2.647
221 HD3 LYS 27 HD3 LYS 27 -14.408 23.762 -2.535
222 HE2 LYS 27 HE2 LYS 27 -15.334 24.726 -0.719
223 HE3 LYS 27 HE3 LYS 27 -13.772 25.161 -0.026
224 HZ1 LYS 27 HZ1 LYS 27 -14.126 27.225 -0.700
225 HZ2 LYS 27 HZ2 LYS 27 -14.115 26.706 -2.311
226 HZ3 LYS 27 HZ3 LYS 27 -15.574 26.784 -1.457
227 H GLY 28 H GLY 28 -10.081 21.215 0.812
228 HA2 GLY 28 HA2 GLY 28 -9.170 22.826 2.373
229 HA3 GLY 28 HA3 GLY 28 -10.750 22.899 3.140
230 H ASP 29 H ASP 29 -9.338 19.864 2.173
231 HA ASP 29 HA ASP 29 -8.853 19.239 5.013
232 HB2 ASP 29 HB2 ASP 29 -9.935 17.243 4.832
233 HB3 ASP 29 HB3 ASP 29 -10.793 18.091 3.549
234 H ILE 30 H ILE 30 -7.483 17.053 5.063
235 HA ILE 30 HA ILE 30 -5.228 17.388 3.197
236 HB ILE 30 HB ILE 30 -5.192 17.806 5.995
237 HG12 ILE 30 HG12 ILE 30 -3.853 18.930 4.198
238 HG13 ILE 30 HG13 ILE 30 -2.906 18.442 5.599
239 HG21 ILE 30 HG21 ILE 30 -3.506 16.207 6.737
240 HG22 ILE 30 HG22 ILE 30 -4.989 15.384 6.253
241 HG23 ILE 30 HG23 ILE 30 -3.590 15.385 5.178
242 HD11 ILE 30 HD11 ILE 30 -1.585 17.179 4.351
243 HD12 ILE 30 HD12 ILE 30 -2.958 16.367 3.600
244 HD13 ILE 30 HD13 ILE 30 -2.365 17.891 2.939
245 H LEU 31 H LEU 31 -4.264 15.548 2.440
246 HA LEU 31 HA LEU 31 -5.232 12.972 3.464
247 HB2 LEU 31 HB2 LEU 31 -4.947 12.476 0.795
248 HB3 LEU 31 HB3 LEU 31 -6.475 12.760 1.626
249 HG LEU 31 HG LEU 31 -4.993 15.104 0.537
250 HD11 LEU 31 HD11 LEU 31 -4.899 13.543 -1.306
251 HD12 LEU 31 HD12 LEU 31 -6.616 13.184 -1.128
252 HD13 LEU 31 HD13 LEU 31 -6.099 14.791 -1.640
253 HD21 LEU 31 HD21 LEU 31 -6.879 15.865 1.550
254 HD22 LEU 31 HD22 LEU 31 -7.560 15.509 -0.037
255 HD23 LEU 31 HD23 LEU 31 -7.763 14.362 1.287
256 H THR 32 H THR 32 -3.866 11.146 2.858
257 HA THR 32 HA THR 32 -1.053 11.961 2.716
258 HB THR 32 HB THR 32 -2.035 9.195 3.392
259 HG1 THR 32 HG1 THR 32 -2.758 9.976 5.212
260 HG21 THR 32 HG21 THR 32 0.467 10.700 4.166
261 HG22 THR 32 HG22 THR 32 0.094 9.019 4.548
262 HG23 THR 32 HG23 THR 32 0.361 9.505 2.873
263 H LEU 33 H LEU 33 -0.158 11.896 0.767
264 HA LEU 33 HA LEU 33 -1.243 10.518 -1.443
265 HB2 LEU 33 HB2 LEU 33 1.229 12.044 -0.876
266 HB3 LEU 33 HB3 LEU 33 1.265 10.952 -2.259
267 HG LEU 33 HG LEU 33 0.699 13.362 -2.750
268 HD11 LEU 33 HD11 LEU 33 -0.529 12.741 -4.560
269 HD12 LEU 33 HD12 LEU 33 0.014 11.147 -4.035
270 HD13 LEU 33 HD13 LEU 33 -1.606 11.709 -3.619
271 HD21 LEU 33 HD21 LEU 33 -1.835 12.571 -1.322
272 HD22 LEU 33 HD22 LEU 33 -0.724 13.870 -0.889
273 HD23 LEU 33 HD23 LEU 33 -1.681 13.984 -2.366
274 H LEU 34 H LEU 34 -0.598 8.650 -2.496
275 HA LEU 34 HA LEU 34 1.183 6.876 -0.959
276 HB2 LEU 34 HB2 LEU 34 -1.501 6.465 -2.071
277 HB3 LEU 34 HB3 LEU 34 -0.358 5.169 -2.414
278 HG LEU 34 HG LEU 34 -0.282 5.909 0.378
279 HD11 LEU 34 HD11 LEU 34 -2.695 4.601 0.433
280 HD12 LEU 34 HD12 LEU 34 -2.445 6.321 0.732
281 HD13 LEU 34 HD13 LEU 34 -2.906 5.763 -0.877
282 HD21 LEU 34 HD21 LEU 34 0.302 3.771 0.434
283 HD22 LEU 34 HD22 LEU 34 -1.312 3.301 -0.099
284 HD23 LEU 34 HD23 LEU 34 -0.051 3.631 -1.288
285 H ASN 35 H ASN 35 -0.245 7.131 -4.222
286 HA ASN 35 HA ASN 35 2.153 5.974 -5.379
287 HB2 ASN 35 HB2 ASN 35 -0.025 5.258 -6.231
288 HB3 ASN 35 HB3 ASN 35 -0.416 6.917 -6.671
289 HD21 ASN 35 HD21 ASN 35 2.610 5.142 -7.063
290 HD22 ASN 35 HD22 ASN 35 2.660 5.258 -8.787
291 H SER 36 H SER 36 0.210 8.801 -6.345
292 HA SER 36 HA SER 36 0.799 10.897 -7.012
293 HB2 SER 36 HB2 SER 36 2.832 10.172 -5.075
294 HB3 SER 36 HB3 SER 36 3.490 11.230 -6.323
295 HG SER 36 HG SER 36 2.055 11.939 -4.260
296 H THR 37 H THR 37 1.539 8.314 -8.483
297 HA THR 37 HA THR 37 3.660 9.335 -10.229
298 HB THR 37 HB THR 37 2.374 6.598 -10.177
299 HG1 THR 37 HG1 THR 37 4.564 7.729 -8.866
300 HG21 THR 37 HG21 THR 37 4.544 6.083 -11.495
301 HG22 THR 37 HG22 THR 37 3.193 6.831 -12.346
302 HG23 THR 37 HG23 THR 37 4.562 7.815 -11.829
303 H ASN 38 H ASN 38 0.268 8.451 -10.207
304 HA ASN 38 HA ASN 38 0.042 9.033 -13.066
305 HB2 ASN 38 HB2 ASN 38 -1.081 7.019 -12.414
306 HB3 ASN 38 HB3 ASN 38 -1.888 7.832 -11.077
307 HD21 ASN 38 HD21 ASN 38 -1.456 8.782 -14.458
308 HD22 ASN 38 HD22 ASN 38 -3.141 8.911 -14.818
309 H LYS 39 H LYS 39 0.074 11.211 -13.307
310 HA LYS 39 HA LYS 39 -0.855 13.172 -11.636
311 HB2 LYS 39 HB2 LYS 39 0.407 13.763 -13.582
312 HB3 LYS 39 HB3 LYS 39 -0.812 13.085 -14.653
313 HG2 LYS 39 HG2 LYS 39 -2.380 14.829 -13.990
314 HG3 LYS 39 HG3 LYS 39 -1.172 15.503 -12.894
315 HD2 LYS 39 HD2 LYS 39 -0.377 15.124 -15.726
316 HD3 LYS 39 HD3 LYS 39 -1.530 16.414 -15.376
317 HE2 LYS 39 HE2 LYS 39 0.337 16.776 -13.417
318 HE3 LYS 39 HE3 LYS 39 1.329 16.215 -14.762
319 HZ1 LYS 39 HZ1 LYS 39 0.243 17.958 -16.136
320 HZ2 LYS 39 HZ2 LYS 39 -0.493 18.556 -14.735
321 HZ3 LYS 39 HZ3 LYS 39 1.193 18.570 -14.877
322 H ASP 40 H ASP 40 -2.697 11.553 -14.214
323 HA ASP 40 HA ASP 40 -5.091 12.887 -14.009
324 HB2 ASP 40 HB2 ASP 40 -4.939 9.897 -14.370
325 HB3 ASP 40 HB3 ASP 40 -6.121 11.014 -15.046
326 H TRP 41 H TRP 41 -3.991 10.119 -12.081
327 HA TRP 41 HA TRP 41 -5.881 10.902 -9.990
328 HB2 TRP 41 HB2 TRP 41 -5.750 8.203 -11.315
329 HB3 TRP 41 HB3 TRP 41 -6.344 8.383 -9.667
330 HD1 TRP 41 HD1 TRP 41 -7.284 9.123 -13.289
331 HE1 TRP 41 HE1 TRP 41 -9.769 9.788 -13.382
332 HE3 TRP 41 HE3 TRP 41 -8.222 9.462 -8.274
333 HZ2 TRP 41 HZ2 TRP 41 -11.851 10.378 -11.569
334 HZ3 TRP 41 HZ3 TRP 41 -10.486 10.083 -7.537
335 HH2 TRP 41 HH2 TRP 41 -12.261 10.532 -9.152
336 H TRP 42 H TRP 42 -4.743 11.179 -8.199
337 HA TRP 42 HA TRP 42 -2.237 9.704 -7.851
338 HB2 TRP 42 HB2 TRP 42 -3.343 12.223 -6.632
339 HB3 TRP 42 HB3 TRP 42 -1.978 11.381 -5.904
340 HD1 TRP 42 HD1 TRP 42 -0.772 10.613 -8.928
341 HE1 TRP 42 HE1 TRP 42 0.545 12.465 -10.135
342 HE3 TRP 42 HE3 TRP 42 -2.522 14.665 -6.349
343 HZ2 TRP 42 HZ2 TRP 42 0.808 15.273 -10.010
344 HZ3 TRP 42 HZ3 TRP 42 -1.687 16.899 -6.954
345 HH2 TRP 42 HH2 TRP 42 -0.055 17.194 -8.747
346 H LYS 43 H LYS 43 -2.504 7.811 -6.853
347 HA LYS 43 HA LYS 43 -4.628 7.110 -5.175
348 HB2 LYS 43 HB2 LYS 43 -3.269 5.426 -6.269
349 HB3 LYS 43 HB3 LYS 43 -1.846 5.945 -5.375
350 HG2 LYS 43 HG2 LYS 43 -3.516 5.373 -3.336
351 HG3 LYS 43 HG3 LYS 43 -4.078 4.221 -4.549
352 HD2 LYS 43 HD2 LYS 43 -1.185 4.325 -4.419
353 HD3 LYS 43 HD3 LYS 43 -1.897 3.922 -2.855
354 HE2 LYS 43 HE2 LYS 43 -1.823 1.828 -3.718
355 HE3 LYS 43 HE3 LYS 43 -3.365 2.323 -4.413
356 HZ1 LYS 43 HZ1 LYS 43 -2.314 2.819 -6.469
357 HZ2 LYS 43 HZ2 LYS 43 -0.767 2.603 -5.818
358 HZ3 LYS 43 HZ3 LYS 43 -1.797 1.275 -6.010
359 H VAL 44 H VAL 44 -5.048 7.452 -3.086
360 HA VAL 44 HA VAL 44 -2.875 8.158 -1.263
361 HB VAL 44 HB VAL 44 -3.986 10.091 -0.378
362 HG11 VAL 44 HG11 VAL 44 -2.696 10.088 -2.702
363 HG12 VAL 44 HG12 VAL 44 -4.261 10.664 -3.275
364 HG13 VAL 44 HG13 VAL 44 -3.400 11.554 -2.020
365 HG21 VAL 44 HG21 VAL 44 -6.177 9.522 -2.373
366 HG22 VAL 44 HG22 VAL 44 -6.290 9.368 -0.620
367 HG23 VAL 44 HG23 VAL 44 -6.074 10.957 -1.353
368 H GLU 45 H GLU 45 -3.690 8.262 1.041
369 HA GLU 45 HA GLU 45 -5.822 6.265 1.431
370 HB2 GLU 45 HB2 GLU 45 -3.828 5.192 2.076
371 HB3 GLU 45 HB3 GLU 45 -3.200 6.638 2.854
372 HG2 GLU 45 HG2 GLU 45 -4.661 6.404 4.690
373 HG3 GLU 45 HG3 GLU 45 -5.627 5.186 3.860
374 H VAL 46 H VAL 46 -7.505 6.870 2.627
375 HA VAL 46 HA VAL 46 -7.193 8.989 4.617
376 HB VAL 46 HB VAL 46 -9.374 10.009 3.791
377 HG11 VAL 46 HG11 VAL 46 -8.256 11.538 2.402
378 HG12 VAL 46 HG12 VAL 46 -7.013 10.919 3.488
379 HG13 VAL 46 HG13 VAL 46 -7.116 10.318 1.833
380 HG21 VAL 46 HG21 VAL 46 -9.799 8.006 2.258
381 HG22 VAL 46 HG22 VAL 46 -10.121 9.612 1.605
382 HG23 VAL 46 HG23 VAL 46 -8.642 8.760 1.160
383 H ASN 47 H ASN 47 -8.315 8.600 6.428
384 HA ASN 47 HA ASN 47 -9.441 7.289 7.943
385 HB2 ASN 47 HB2 ASN 47 -11.946 7.083 7.177
386 HB3 ASN 47 HB3 ASN 47 -11.262 8.662 7.553
387 HD21 ASN 47 HD21 ASN 47 -12.261 6.502 5.006
388 HD22 ASN 47 HD22 ASN 47 -12.362 7.699 3.763
389 H ASP 48 H ASP 48 -7.998 5.456 7.147
390 HA ASP 48 HA ASP 48 -7.685 3.316 6.371
391 HB2 ASP 48 HB2 ASP 48 -9.372 3.360 8.489
392 HB3 ASP 48 HB3 ASP 48 -10.375 2.520 7.309
393 H ARG 49 H ARG 49 -8.755 5.009 4.361
394 HA ARG 49 HA ARG 49 -9.982 2.984 2.670
395 HB2 ARG 49 HB2 ARG 49 -11.436 5.246 3.764
396 HB3 ARG 49 HB3 ARG 49 -11.419 5.282 2.006
397 HG2 ARG 49 HG2 ARG 49 -12.202 2.837 3.563
398 HG3 ARG 49 HG3 ARG 49 -13.358 4.087 3.098
399 HD2 ARG 49 HD2 ARG 49 -11.816 3.413 0.811
400 HD3 ARG 49 HD3 ARG 49 -12.372 1.914 1.555
401 HE ARG 49 HE ARG 49 -13.965 3.837 0.169
402 HH11 ARG 49 HH11 ARG 49 -14.001 1.453 2.705
403 HH12 ARG 49 HH12 ARG 49 -15.702 1.150 2.575
404 HH21 ARG 49 HH21 ARG 49 -16.205 3.447 -0.013
405 HH22 ARG 49 HH22 ARG 49 -16.955 2.284 1.028
406 H GLN 50 H GLN 50 -7.979 3.027 1.584
407 HA GLN 50 HA GLN 50 -7.188 5.524 0.298
408 HB2 GLN 50 HB2 GLN 50 -5.117 4.514 -0.159
409 HB3 GLN 50 HB3 GLN 50 -5.551 3.924 1.439
410 HG2 GLN 50 HG2 GLN 50 -5.209 1.872 0.695
411 HG3 GLN 50 HG3 GLN 50 -6.628 2.066 -0.332
412 HE21 GLN 50 HE21 GLN 50 -3.171 2.846 -0.256
413 HE22 GLN 50 HE22 GLN 50 -2.890 2.546 -1.934
414 H GLY 51 H GLY 51 -6.914 5.717 -1.963
415 HA2 GLY 51 HA2 GLY 51 -7.715 3.634 -3.757
416 HA3 GLY 51 HA3 GLY 51 -8.972 4.847 -3.559
417 H PHE 52 H PHE 52 -8.911 6.564 -4.852
418 HA PHE 52 HA PHE 52 -6.350 7.435 -5.967
419 HB2 PHE 52 HB2 PHE 52 -8.775 6.650 -7.584
420 HB3 PHE 52 HB3 PHE 52 -7.484 7.658 -8.228
421 HD1 PHE 52 HD1 PHE 52 -5.058 6.473 -7.326
422 HD2 PHE 52 HD2 PHE 52 -8.668 4.562 -8.524
423 HE1 PHE 52 HE1 PHE 52 -3.786 4.456 -7.932
424 HE2 PHE 52 HE2 PHE 52 -7.402 2.543 -9.131
425 HZ PHE 52 HZ PHE 52 -4.958 2.487 -8.835
426 H VAL 53 H VAL 53 -6.143 9.569 -5.841
427 HA VAL 53 HA VAL 53 -8.579 11.186 -5.477
428 HB VAL 53 HB VAL 53 -6.379 11.023 -3.824
429 HG11 VAL 53 HG11 VAL 53 -5.063 12.262 -5.526
430 HG12 VAL 53 HG12 VAL 53 -6.174 13.619 -5.343
431 HG13 VAL 53 HG13 VAL 53 -5.181 13.102 -3.980
432 HG21 VAL 53 HG21 VAL 53 -7.722 12.230 -2.512
433 HG22 VAL 53 HG22 VAL 53 -7.727 13.590 -3.634
434 HG23 VAL 53 HG23 VAL 53 -8.852 12.252 -3.866
435 HA PRO 54 HA PRO 54 -7.704 13.173 -9.319
436 HB2 PRO 54 HB2 PRO 54 -9.242 15.382 -8.966
437 HB3 PRO 54 HB3 PRO 54 -9.917 13.788 -9.321
438 HG2 PRO 54 HG2 PRO 54 -9.665 15.195 -6.691
439 HG3 PRO 54 HG3 PRO 54 -11.031 14.268 -7.337
440 HD2 PRO 54 HD2 PRO 54 -9.289 13.235 -5.540
441 HD3 PRO 54 HD3 PRO 54 -10.082 12.243 -6.780
442 H ALA 55 H ALA 55 -5.811 14.120 -9.724
443 HA ALA 55 HA ALA 55 -4.396 15.742 -7.915
444 HB1 ALA 55 HB1 ALA 55 -4.012 15.596 -10.901
445 HB2 ALA 55 HB2 ALA 55 -2.826 16.107 -9.700
446 HB3 ALA 55 HB3 ALA 55 -3.367 14.429 -9.748
447 H ALA 56 H ALA 56 -6.001 16.652 -10.972
448 HA ALA 56 HA ALA 56 -5.631 19.367 -10.903
449 HB1 ALA 56 HB1 ALA 56 -6.663 18.195 -12.780
450 HB2 ALA 56 HB2 ALA 56 -8.118 17.927 -11.821
451 HB3 ALA 56 HB3 ALA 56 -7.646 19.567 -12.268
452 H TYR 57 H TYR 57 -7.912 17.450 -9.055
453 HA TYR 57 HA TYR 57 -9.130 19.853 -7.926
454 HB2 TYR 57 HB2 TYR 57 -9.796 16.918 -7.677
455 HB3 TYR 57 HB3 TYR 57 -10.616 18.172 -6.753
456 HD1 TYR 57 HD1 TYR 57 -11.068 16.128 -9.421
457 HD2 TYR 57 HD2 TYR 57 -11.242 20.275 -8.484
458 HE1 TYR 57 HE1 TYR 57 -12.626 16.479 -11.292
459 HE2 TYR 57 HE2 TYR 57 -12.801 20.637 -10.352
460 HH TYR 57 HH TYR 57 -14.388 18.134 -11.935
461 H VAL 58 H VAL 58 -6.425 19.468 -7.296
462 HA VAL 58 HA VAL 58 -6.623 19.277 -4.395
463 HB VAL 58 HB VAL 58 -5.744 17.066 -5.690
464 HG11 VAL 58 HG11 VAL 58 -3.402 16.946 -5.795
465 HG12 VAL 58 HG12 VAL 58 -3.809 18.487 -6.549
466 HG13 VAL 58 HG13 VAL 58 -3.199 18.449 -4.895
467 HG21 VAL 58 HG21 VAL 58 -4.760 16.394 -3.569
468 HG22 VAL 58 HG22 VAL 58 -4.701 18.077 -3.045
469 HG23 VAL 58 HG23 VAL 58 -6.257 17.286 -3.299
470 H LYS 59 H LYS 59 -4.499 19.956 -3.363
471 HA LYS 59 HA LYS 59 -2.797 21.642 -4.987
472 HB2 LYS 59 HB2 LYS 59 -5.050 22.759 -3.690
473 HB3 LYS 59 HB3 LYS 59 -3.638 23.258 -2.768
474 HG2 LYS 59 HG2 LYS 59 -3.559 23.523 -5.727
475 HG3 LYS 59 HG3 LYS 59 -4.525 24.672 -4.797
476 HD2 LYS 59 HD2 LYS 59 -2.250 24.685 -3.352
477 HD3 LYS 59 HD3 LYS 59 -1.595 24.337 -4.954
478 HE2 LYS 59 HE2 LYS 59 -1.695 26.524 -5.357
479 HE3 LYS 59 HE3 LYS 59 -3.450 26.361 -5.382
480 HZ1 LYS 59 HZ1 LYS 59 -3.227 27.946 -3.791
481 HZ2 LYS 59 HZ2 LYS 59 -3.110 26.580 -2.798
482 HZ3 LYS 59 HZ3 LYS 59 -1.710 27.401 -3.275
483 H LYS 60 H LYS 60 -0.851 21.023 -4.330
484 HA LYS 60 HA LYS 60 -0.309 19.844 -1.822
485 HB2 LYS 60 HB2 LYS 60 0.989 19.810 -4.140
486 HB3 LYS 60 HB3 LYS 60 1.884 21.123 -3.386
487 HG2 LYS 60 HG2 LYS 60 1.545 18.350 -2.260
488 HG3 LYS 60 HG3 LYS 60 2.989 18.977 -3.059
489 HD2 LYS 60 HD2 LYS 60 1.773 20.083 -0.528
490 HD3 LYS 60 HD3 LYS 60 3.182 19.023 -0.605
491 HE2 LYS 60 HE2 LYS 60 3.619 21.190 -2.382
492 HE3 LYS 60 HE3 LYS 60 3.064 21.856 -0.847
493 HZ1 LYS 60 HZ1 LYS 60 4.840 20.059 -0.006
494 HZ2 LYS 60 HZ2 LYS 60 5.540 20.489 -1.485
495 HZ3 LYS 60 HZ3 LYS 60 5.226 21.676 -0.321
496 H LEU 61 H LEU 61 -1.004 21.233 -0.190
497 HA LEU 61 HA LEU 61 0.476 23.762 0.074
498 HB2 LEU 61 HB2 LEU 61 -2.107 22.868 1.342
499 HB3 LEU 61 HB3 LEU 61 -1.289 24.389 1.698
500 HG LEU 61 HG LEU 61 -2.193 23.707 -1.083
501 HD11 LEU 61 HD11 LEU 61 -4.085 25.424 -0.200
502 HD12 LEU 61 HD12 LEU 61 -4.286 23.673 -0.267
503 HD13 LEU 61 HD13 LEU 61 -3.823 24.451 1.247
504 HD21 LEU 61 HD21 LEU 61 -2.141 26.449 0.038
505 HD22 LEU 61 HD22 LEU 61 -0.588 25.670 -0.264
506 HD23 LEU 61 HD23 LEU 61 -1.742 25.876 -1.581
507 H ASP 62 H ASP 62 -1.099 21.641 2.450
508 HA ASP 62 HA ASP 62 1.459 21.080 3.715
509 HB2 ASP 62 HB2 ASP 62 -0.732 22.688 5.016
510 HB3 ASP 62 HB3 ASP 62 0.448 21.789 5.965
Start of MODEL 5
1 H1 MET 1 H MET 1 -0.910 1.794 -0.625
2 HA MET 1 HA MET 1 0.312 -0.654 -1.218
3 HB2 MET 1 HB2 MET 1 -0.025 1.122 -3.641
4 HB3 MET 1 HB3 MET 1 0.865 -0.394 -3.571
5 HG2 MET 1 HG2 MET 1 -1.227 -1.581 -3.086
6 HG3 MET 1 HG3 MET 1 -2.104 -0.058 -3.212
7 HE1 MET 1 HE1 MET 1 -2.118 -3.084 -5.744
8 HE2 MET 1 HE2 MET 1 -0.438 -2.841 -6.223
9 HE3 MET 1 HE3 MET 1 -0.852 -3.014 -4.518
10 H ASP 2 H ASP 2 0.586 2.758 -2.226
11 HA ASP 2 HA ASP 2 2.210 4.314 -1.876
12 HB2 ASP 2 HB2 ASP 2 2.050 3.017 0.504
13 HB3 ASP 2 HB3 ASP 2 3.735 2.719 0.088
14 H GLU 3 H GLU 3 4.260 4.811 -2.647
15 HA GLU 3 HA GLU 3 6.204 2.784 -3.206
16 HB2 GLU 3 HB2 GLU 3 4.546 2.415 -5.030
17 HB3 GLU 3 HB3 GLU 3 4.816 4.068 -5.564
18 HG2 GLU 3 HG2 GLU 3 7.355 2.938 -5.410
19 HG3 GLU 3 HG3 GLU 3 6.334 1.687 -6.117
20 H THR 4 H THR 4 5.204 5.888 -4.655
21 HA THR 4 HA THR 4 7.751 7.043 -3.744
22 HB THR 4 HB THR 4 7.928 6.475 -6.151
23 HG1 THR 4 HG1 THR 4 8.947 8.340 -6.552
24 HG21 THR 4 HG21 THR 4 5.989 8.648 -6.800
25 HG22 THR 4 HG22 THR 4 6.504 7.271 -7.774
26 HG23 THR 4 HG23 THR 4 5.371 7.035 -6.444
27 H GLY 5 H GLY 5 5.212 7.286 -2.498
28 HA2 GLY 5 HA2 GLY 5 4.175 9.900 -3.257
29 HA3 GLY 5 HA3 GLY 5 3.528 8.842 -2.012
30 H LYS 6 H LYS 6 4.234 9.033 0.081
31 HA LYS 6 HA LYS 6 4.969 10.173 1.914
32 HB2 LYS 6 HB2 LYS 6 7.366 10.025 0.125
33 HB3 LYS 6 HB3 LYS 6 7.469 10.920 1.635
34 HG2 LYS 6 HG2 LYS 6 8.269 8.759 2.101
35 HG3 LYS 6 HG3 LYS 6 6.644 8.831 2.787
36 HD2 LYS 6 HD2 LYS 6 5.765 7.679 0.811
37 HD3 LYS 6 HD3 LYS 6 7.391 7.607 0.129
38 HE2 LYS 6 HE2 LYS 6 7.620 6.543 2.701
39 HE3 LYS 6 HE3 LYS 6 6.122 5.874 2.056
40 HZ1 LYS 6 HZ1 LYS 6 8.842 5.668 0.898
41 HZ2 LYS 6 HZ2 LYS 6 7.846 4.411 1.437
42 HZ3 LYS 6 HZ3 LYS 6 7.445 5.266 0.033
43 H GLU 7 H GLU 7 3.324 11.795 0.743
44 HA GLU 7 HA GLU 7 4.481 14.407 1.163
45 HB2 GLU 7 HB2 GLU 7 4.393 13.442 -1.450
46 HB3 GLU 7 HB3 GLU 7 2.984 14.486 -1.325
47 HG2 GLU 7 HG2 GLU 7 5.547 15.531 -0.277
48 HG3 GLU 7 HG3 GLU 7 5.379 15.386 -2.026
49 H LEU 8 H LEU 8 2.716 16.137 0.817
50 HA LEU 8 HA LEU 8 0.085 15.048 1.560
51 HB2 LEU 8 HB2 LEU 8 1.850 16.624 3.158
52 HB3 LEU 8 HB3 LEU 8 0.407 17.570 2.797
53 HG LEU 8 HG LEU 8 -1.004 15.964 3.849
54 HD11 LEU 8 HD11 LEU 8 -0.109 13.894 3.174
55 HD12 LEU 8 HD12 LEU 8 1.454 14.236 3.918
56 HD13 LEU 8 HD13 LEU 8 0.043 13.927 4.931
57 HD21 LEU 8 HD21 LEU 8 -0.507 16.765 5.859
58 HD22 LEU 8 HD22 LEU 8 0.940 15.761 5.956
59 HD23 LEU 8 HD23 LEU 8 1.019 17.352 5.199
60 H VAL 9 H VAL 9 -1.722 16.402 1.064
61 HA VAL 9 HA VAL 9 -1.236 18.703 -0.661
62 HB VAL 9 HB VAL 9 -2.670 17.898 -2.447
63 HG11 VAL 9 HG11 VAL 9 -1.216 16.099 -3.337
64 HG12 VAL 9 HG12 VAL 9 -0.313 17.474 -2.700
65 HG13 VAL 9 HG13 VAL 9 -0.440 15.989 -1.757
66 HG21 VAL 9 HG21 VAL 9 -3.303 15.453 -2.460
67 HG22 VAL 9 HG22 VAL 9 -2.890 15.425 -0.745
68 HG23 VAL 9 HG23 VAL 9 -4.190 16.468 -1.323
69 H LEU 10 H LEU 10 -3.324 19.798 -1.248
70 HA LEU 10 HA LEU 10 -5.239 19.540 0.976
71 HB2 LEU 10 HB2 LEU 10 -4.091 21.894 -0.437
72 HB3 LEU 10 HB3 LEU 10 -5.739 22.008 0.177
73 HG LEU 10 HG LEU 10 -3.896 22.923 1.658
74 HD11 LEU 10 HD11 LEU 10 -5.085 21.026 3.444
75 HD12 LEU 10 HD12 LEU 10 -5.432 22.744 3.245
76 HD13 LEU 10 HD13 LEU 10 -6.274 21.553 2.252
77 HD21 LEU 10 HD21 LEU 10 -2.681 21.304 3.020
78 HD22 LEU 10 HD22 LEU 10 -3.385 19.981 2.092
79 HD23 LEU 10 HD23 LEU 10 -2.284 21.117 1.312
80 H ALA 11 H ALA 11 -7.416 19.536 0.550
81 HA ALA 11 HA ALA 11 -8.238 18.613 -2.005
82 HB1 ALA 11 HB1 ALA 11 -9.729 19.401 0.478
83 HB2 ALA 11 HB2 ALA 11 -10.564 18.911 -0.996
84 HB3 ALA 11 HB3 ALA 11 -9.468 17.790 -0.189
85 H LEU 12 H LEU 12 -8.368 19.870 -3.743
86 HA LEU 12 HA LEU 12 -8.871 22.711 -3.505
87 HB2 LEU 12 HB2 LEU 12 -7.230 21.585 -5.109
88 HB3 LEU 12 HB3 LEU 12 -8.648 21.152 -6.062
89 HG LEU 12 HG LEU 12 -7.385 23.188 -6.831
90 HD11 LEU 12 HD11 LEU 12 -9.276 23.862 -7.799
91 HD12 LEU 12 HD12 LEU 12 -10.077 22.620 -6.837
92 HD13 LEU 12 HD13 LEU 12 -10.017 24.284 -6.255
93 HD21 LEU 12 HD21 LEU 12 -7.593 25.235 -5.641
94 HD22 LEU 12 HD22 LEU 12 -8.679 24.511 -4.455
95 HD23 LEU 12 HD23 LEU 12 -6.981 24.037 -4.501
96 H TYR 13 H TYR 13 -10.590 19.824 -4.426
97 HA TYR 13 HA TYR 13 -13.029 21.428 -4.721
98 HB2 TYR 13 HB2 TYR 13 -12.352 20.958 -6.988
99 HB3 TYR 13 HB3 TYR 13 -12.102 19.257 -6.610
100 HD1 TYR 13 HD1 TYR 13 -14.949 21.523 -5.783
101 HD2 TYR 13 HD2 TYR 13 -13.630 18.073 -7.895
102 HE1 TYR 13 HE1 TYR 13 -17.271 21.043 -6.436
103 HE2 TYR 13 HE2 TYR 13 -15.949 17.584 -8.555
104 HH TYR 13 HH TYR 13 -18.331 19.644 -8.568
105 H ASP 14 H ASP 14 -14.821 20.558 -3.809
106 HA ASP 14 HA ASP 14 -14.482 18.384 -1.992
107 HB2 ASP 14 HB2 ASP 14 -16.205 20.529 -2.169
108 HB3 ASP 14 HB3 ASP 14 -17.248 19.162 -2.554
109 H TYR 15 H TYR 15 -14.127 16.450 -2.966
110 HA TYR 15 HA TYR 15 -16.015 15.563 -5.030
111 HB2 TYR 15 HB2 TYR 15 -13.289 15.393 -4.968
112 HB3 TYR 15 HB3 TYR 15 -13.749 13.806 -4.363
113 HD1 TYR 15 HD1 TYR 15 -14.370 16.161 -7.181
114 HD2 TYR 15 HD2 TYR 15 -14.352 12.118 -5.855
115 HE1 TYR 15 HE1 TYR 15 -14.781 15.409 -9.486
116 HE2 TYR 15 HE2 TYR 15 -14.761 11.355 -8.157
117 HH TYR 15 HH TYR 15 -14.677 13.560 -10.866
118 H GLN 16 H GLN 16 -17.459 13.994 -4.661
119 HA GLN 16 HA GLN 16 -17.532 12.816 -1.985
120 HB2 GLN 16 HB2 GLN 16 -19.625 12.936 -4.162
121 HB3 GLN 16 HB3 GLN 16 -19.858 12.174 -2.594
122 HG2 GLN 16 HG2 GLN 16 -19.104 14.567 -1.742
123 HG3 GLN 16 HG3 GLN 16 -19.741 15.043 -3.315
124 HE21 GLN 16 HE21 GLN 16 -20.716 12.689 -0.842
125 HE22 GLN 16 HE22 GLN 16 -22.345 13.248 -0.710
126 H GLU 17 H GLU 17 -15.852 11.966 -4.405
127 HA GLU 17 HA GLU 17 -15.253 10.052 -5.516
128 HB2 GLU 17 HB2 GLU 17 -14.804 8.209 -4.065
129 HB3 GLU 17 HB3 GLU 17 -14.554 9.679 -3.134
130 HG2 GLU 17 HG2 GLU 17 -16.580 9.392 -1.955
131 HG3 GLU 17 HG3 GLU 17 -17.120 8.123 -3.054
132 H LYS 18 H LYS 18 -16.122 7.391 -5.182
133 HA LYS 18 HA LYS 18 -18.886 7.013 -5.320
134 HB2 LYS 18 HB2 LYS 18 -17.737 8.156 -7.705
135 HB3 LYS 18 HB3 LYS 18 -18.378 6.555 -8.050
136 HG2 LYS 18 HG2 LYS 18 -20.480 7.269 -7.952
137 HG3 LYS 18 HG3 LYS 18 -20.198 8.142 -6.443
138 HD2 LYS 18 HD2 LYS 18 -20.668 9.900 -7.829
139 HD3 LYS 18 HD3 LYS 18 -18.920 9.802 -8.053
140 HE2 LYS 18 HE2 LYS 18 -20.127 8.010 -9.887
141 HE3 LYS 18 HE3 LYS 18 -20.992 9.543 -9.993
142 HZ1 LYS 18 HZ1 LYS 18 -18.820 9.093 -11.374
143 HZ2 LYS 18 HZ2 LYS 18 -19.166 10.630 -10.757
144 HZ3 LYS 18 HZ3 LYS 18 -18.068 9.623 -9.954
145 H SER 19 H SER 19 -15.774 6.030 -6.684
146 HA SER 19 HA SER 19 -16.602 3.227 -6.616
147 HB2 SER 19 HB2 SER 19 -14.815 4.754 -8.246
148 HB3 SER 19 HB3 SER 19 -13.893 3.481 -7.446
149 HG SER 19 HG SER 19 -14.833 2.808 -9.445
150 HA PRO 20 HA PRO 20 -14.417 2.141 -2.972
151 HB2 PRO 20 HB2 PRO 20 -13.278 -0.233 -3.635
152 HB3 PRO 20 HB3 PRO 20 -15.015 -0.042 -3.367
153 HG2 PRO 20 HG2 PRO 20 -13.494 -0.130 -5.944
154 HG3 PRO 20 HG3 PRO 20 -15.030 -0.910 -5.525
155 HD2 PRO 20 HD2 PRO 20 -14.904 1.376 -6.969
156 HD3 PRO 20 HD3 PRO 20 -16.246 1.018 -5.864
157 H ARG 21 H ARG 21 -12.609 2.282 -5.956
158 HA ARG 21 HA ARG 21 -10.060 2.338 -4.533
159 HB2 ARG 21 HB2 ARG 21 -9.018 2.229 -6.703
160 HB3 ARG 21 HB3 ARG 21 -10.292 1.019 -6.629
161 HG2 ARG 21 HG2 ARG 21 -11.128 3.617 -7.702
162 HG3 ARG 21 HG3 ARG 21 -9.930 2.757 -8.671
163 HD2 ARG 21 HD2 ARG 21 -12.638 1.774 -7.793
164 HD3 ARG 21 HD3 ARG 21 -12.099 2.113 -9.438
165 HE ARG 21 HE ARG 21 -10.380 0.198 -8.610
166 HH11 ARG 21 HH11 ARG 21 -13.853 0.445 -8.626
167 HH12 ARG 21 HH12 ARG 21 -14.104 -1.260 -8.803
168 HH21 ARG 21 HH21 ARG 21 -10.698 -2.049 -8.844
169 HH22 ARG 21 HH22 ARG 21 -12.309 -2.678 -8.926
170 H GLU 22 H GLU 22 -12.208 4.501 -4.525
171 HA GLU 22 HA GLU 22 -10.529 6.721 -5.489
172 HB2 GLU 22 HB2 GLU 22 -13.502 6.396 -5.261
173 HB3 GLU 22 HB3 GLU 22 -12.787 8.002 -5.239
174 HG2 GLU 22 HG2 GLU 22 -11.698 7.485 -7.409
175 HG3 GLU 22 HG3 GLU 22 -12.581 5.960 -7.438
176 H VAL 23 H VAL 23 -10.665 8.731 -4.197
177 HA VAL 23 HA VAL 23 -10.942 8.131 -1.323
178 HB VAL 23 HB VAL 23 -8.846 9.699 -2.784
179 HG11 VAL 23 HG11 VAL 23 -8.206 10.308 -0.277
180 HG12 VAL 23 HG12 VAL 23 -9.236 11.345 -1.263
181 HG13 VAL 23 HG13 VAL 23 -9.958 10.244 -0.090
182 HG21 VAL 23 HG21 VAL 23 -7.553 7.996 -2.182
183 HG22 VAL 23 HG22 VAL 23 -7.960 8.248 -0.485
184 HG23 VAL 23 HG23 VAL 23 -8.965 7.201 -1.486
185 H THR 24 H THR 24 -12.183 9.453 -0.134
186 HA THR 24 HA THR 24 -13.854 11.360 -1.402
187 HB THR 24 HB THR 24 -13.395 10.929 1.557
188 HG1 THR 24 HG1 THR 24 -14.991 9.648 -0.371
189 HG21 THR 24 HG21 THR 24 -15.734 12.200 0.130
190 HG22 THR 24 HG22 THR 24 -15.539 12.006 1.872
191 HG23 THR 24 HG23 THR 24 -14.470 13.089 0.980
192 H MET 25 H MET 25 -13.319 13.352 -1.984
193 HA MET 25 HA MET 25 -11.135 14.713 -0.578
194 HB2 MET 25 HB2 MET 25 -11.076 14.423 -3.089
195 HB3 MET 25 HB3 MET 25 -12.435 15.535 -3.175
196 HG2 MET 25 HG2 MET 25 -10.610 16.894 -3.572
197 HG3 MET 25 HG3 MET 25 -10.935 17.147 -1.858
198 HE1 MET 25 HE1 MET 25 -7.742 16.812 -4.088
199 HE2 MET 25 HE2 MET 25 -7.441 15.088 -3.870
200 HE3 MET 25 HE3 MET 25 -8.967 15.636 -4.564
201 H LYS 26 H LYS 26 -11.493 16.428 0.682
202 HA LYS 26 HA LYS 26 -14.149 17.703 0.568
203 HB2 LYS 26 HB2 LYS 26 -12.659 16.557 2.822
204 HB3 LYS 26 HB3 LYS 26 -13.268 18.179 3.124
205 HG2 LYS 26 HG2 LYS 26 -15.156 16.236 1.936
206 HG3 LYS 26 HG3 LYS 26 -14.689 15.986 3.620
207 HD2 LYS 26 HD2 LYS 26 -15.365 18.287 4.138
208 HD3 LYS 26 HD3 LYS 26 -15.846 18.521 2.455
209 HE2 LYS 26 HE2 LYS 26 -17.003 16.200 3.891
210 HE3 LYS 26 HE3 LYS 26 -17.566 17.802 4.366
211 HZ1 LYS 26 HZ1 LYS 26 -17.665 17.938 1.683
212 HZ2 LYS 26 HZ2 LYS 26 -18.070 16.316 1.944
213 HZ3 LYS 26 HZ3 LYS 26 -18.981 17.543 2.672
214 H LYS 27 H LYS 27 -13.668 19.506 -0.589
215 HA LYS 27 HA LYS 27 -11.464 21.004 -0.825
216 HB2 LYS 27 HB2 LYS 27 -13.830 21.442 -1.737
217 HB3 LYS 27 HB3 LYS 27 -14.084 22.380 -0.271
218 HG2 LYS 27 HG2 LYS 27 -12.254 23.854 -0.863
219 HG3 LYS 27 HG3 LYS 27 -11.915 22.886 -2.300
220 HD2 LYS 27 HD2 LYS 27 -14.217 23.397 -3.105
221 HD3 LYS 27 HD3 LYS 27 -14.409 24.485 -1.729
222 HE2 LYS 27 HE2 LYS 27 -12.033 25.316 -2.801
223 HE3 LYS 27 HE3 LYS 27 -12.946 24.854 -4.237
224 HZ1 LYS 27 HZ1 LYS 27 -13.182 27.190 -2.745
225 HZ2 LYS 27 HZ2 LYS 27 -14.108 26.713 -4.078
226 HZ3 LYS 27 HZ3 LYS 27 -14.614 26.320 -2.512
227 H GLY 28 H GLY 28 -10.021 21.521 0.695
228 HA2 GLY 28 HA2 GLY 28 -9.351 23.104 2.362
229 HA3 GLY 28 HA3 GLY 28 -10.980 23.049 3.019
230 H ASP 29 H ASP 29 -9.147 20.195 2.137
231 HA ASP 29 HA ASP 29 -8.720 19.611 4.988
232 HB2 ASP 29 HB2 ASP 29 -9.908 17.771 2.906
233 HB3 ASP 29 HB3 ASP 29 -9.304 17.212 4.463
234 H ILE 30 H ILE 30 -7.393 17.349 4.989
235 HA ILE 30 HA ILE 30 -5.200 17.635 3.048
236 HB ILE 30 HB ILE 30 -5.075 17.968 5.927
237 HG12 ILE 30 HG12 ILE 30 -4.111 19.354 3.948
238 HG13 ILE 30 HG13 ILE 30 -3.159 19.197 5.420
239 HG21 ILE 30 HG21 ILE 30 -3.300 15.878 4.678
240 HG22 ILE 30 HG22 ILE 30 -2.986 16.648 6.233
241 HG23 ILE 30 HG23 ILE 30 -4.431 15.661 6.014
242 HD11 ILE 30 HD11 ILE 30 -2.740 17.249 3.211
243 HD12 ILE 30 HD12 ILE 30 -2.061 18.871 3.081
244 HD13 ILE 30 HD13 ILE 30 -1.610 17.832 4.433
245 H LEU 31 H LEU 31 -4.271 15.761 2.333
246 HA LEU 31 HA LEU 31 -5.249 13.239 3.486
247 HB2 LEU 31 HB2 LEU 31 -4.907 12.650 0.831
248 HB3 LEU 31 HB3 LEU 31 -6.448 12.930 1.639
249 HG LEU 31 HG LEU 31 -4.965 15.240 0.459
250 HD11 LEU 31 HD11 LEU 31 -5.506 14.788 -1.690
251 HD12 LEU 31 HD12 LEU 31 -5.344 13.124 -1.127
252 HD13 LEU 31 HD13 LEU 31 -6.941 13.861 -1.253
253 HD21 LEU 31 HD21 LEU 31 -6.998 16.300 0.511
254 HD22 LEU 31 HD22 LEU 31 -7.910 14.796 0.376
255 HD23 LEU 31 HD23 LEU 31 -7.153 15.234 1.907
256 H THR 32 H THR 32 -3.886 11.387 3.060
257 HA THR 32 HA THR 32 -1.065 12.155 2.927
258 HB THR 32 HB THR 32 -2.127 9.432 3.666
259 HG1 THR 32 HG1 THR 32 -2.804 10.270 5.478
260 HG21 THR 32 HG21 THR 32 -0.015 9.204 4.827
261 HG22 THR 32 HG22 THR 32 0.288 9.665 3.152
262 HG23 THR 32 HG23 THR 32 0.416 10.869 4.434
263 H LEU 33 H LEU 33 -0.198 12.088 0.958
264 HA LEU 33 HA LEU 33 -1.216 10.635 -1.220
265 HB2 LEU 33 HB2 LEU 33 1.277 12.136 -0.642
266 HB3 LEU 33 HB3 LEU 33 1.289 11.037 -2.020
267 HG LEU 33 HG LEU 33 0.783 13.440 -2.547
268 HD11 LEU 33 HD11 LEU 33 -0.460 12.818 -4.333
269 HD12 LEU 33 HD12 LEU 33 -0.047 11.205 -3.750
270 HD13 LEU 33 HD13 LEU 33 -1.615 11.911 -3.356
271 HD21 LEU 33 HD21 LEU 33 -1.559 14.164 -2.125
272 HD22 LEU 33 HD22 LEU 33 -1.752 12.774 -1.057
273 HD23 LEU 33 HD23 LEU 33 -0.580 14.032 -0.664
274 H LEU 34 H LEU 34 -0.572 8.733 -2.202
275 HA LEU 34 HA LEU 34 1.173 6.992 -0.586
276 HB2 LEU 34 HB2 LEU 34 -1.470 6.530 -1.829
277 HB3 LEU 34 HB3 LEU 34 -0.309 5.208 -1.934
278 HG LEU 34 HG LEU 34 -1.003 6.490 0.693
279 HD11 LEU 34 HD11 LEU 34 -3.070 5.692 0.534
280 HD12 LEU 34 HD12 LEU 34 -2.709 4.872 -0.986
281 HD13 LEU 34 HD13 LEU 34 -2.365 4.075 0.549
282 HD21 LEU 34 HD21 LEU 34 0.863 5.173 1.001
283 HD22 LEU 34 HD22 LEU 34 -0.437 4.030 1.341
284 HD23 LEU 34 HD23 LEU 34 0.373 4.004 -0.226
285 H ASN 35 H ASN 35 -0.189 7.203 -3.881
286 HA ASN 35 HA ASN 35 2.223 5.992 -4.962
287 HB2 ASN 35 HB2 ASN 35 0.060 5.245 -5.826
288 HB3 ASN 35 HB3 ASN 35 -0.327 6.889 -6.324
289 HD21 ASN 35 HD21 ASN 35 2.710 5.113 -6.612
290 HD22 ASN 35 HD22 ASN 35 2.787 5.174 -8.337
291 H SER 36 H SER 36 0.291 8.785 -6.042
292 HA SER 36 HA SER 36 0.886 10.862 -6.761
293 HB2 SER 36 HB2 SER 36 2.887 10.199 -4.772
294 HB3 SER 36 HB3 SER 36 3.573 11.206 -6.047
295 HG SER 36 HG SER 36 2.065 11.976 -4.035
296 H THR 37 H THR 37 1.653 8.233 -8.141
297 HA THR 37 HA THR 37 3.794 9.204 -9.891
298 HB THR 37 HB THR 37 2.506 6.470 -9.762
299 HG1 THR 37 HG1 THR 37 3.894 7.169 -7.951
300 HG21 THR 37 HG21 THR 37 3.374 6.958 -11.987
301 HG22 THR 37 HG22 THR 37 4.920 7.448 -11.294
302 HG23 THR 37 HG23 THR 37 4.395 5.769 -11.177
303 H ASN 38 H ASN 38 0.398 8.345 -9.881
304 HA ASN 38 HA ASN 38 0.211 8.842 -12.761
305 HB2 ASN 38 HB2 ASN 38 -0.910 6.837 -12.048
306 HB3 ASN 38 HB3 ASN 38 -1.762 7.704 -10.774
307 HD21 ASN 38 HD21 ASN 38 -1.223 8.481 -14.186
308 HD22 ASN 38 HD22 ASN 38 -2.896 8.600 -14.601
309 H LYS 39 H LYS 39 0.225 11.007 -13.072
310 HA LYS 39 HA LYS 39 -0.717 13.013 -11.462
311 HB2 LYS 39 HB2 LYS 39 0.551 13.559 -13.413
312 HB3 LYS 39 HB3 LYS 39 -0.650 12.835 -14.474
313 HG2 LYS 39 HG2 LYS 39 -2.250 14.586 -13.820
314 HG3 LYS 39 HG3 LYS 39 -0.999 15.328 -12.821
315 HD2 LYS 39 HD2 LYS 39 0.392 15.325 -15.014
316 HD3 LYS 39 HD3 LYS 39 -1.174 15.129 -15.804
317 HE2 LYS 39 HE2 LYS 39 -1.925 17.146 -14.441
318 HE3 LYS 39 HE3 LYS 39 -0.219 17.398 -14.079
319 HZ1 LYS 39 HZ1 LYS 39 -0.036 18.448 -16.002
320 HZ2 LYS 39 HZ2 LYS 39 -0.430 17.023 -16.825
321 HZ3 LYS 39 HZ3 LYS 39 -1.648 18.116 -16.395
322 H ASP 40 H ASP 40 -2.540 11.327 -14.011
323 HA ASP 40 HA ASP 40 -4.940 12.655 -13.851
324 HB2 ASP 40 HB2 ASP 40 -4.542 10.947 -15.525
325 HB3 ASP 40 HB3 ASP 40 -4.464 9.700 -14.284
326 H TRP 41 H TRP 41 -3.884 9.894 -11.878
327 HA TRP 41 HA TRP 41 -5.797 10.729 -9.820
328 HB2 TRP 41 HB2 TRP 41 -5.568 7.991 -11.049
329 HB3 TRP 41 HB3 TRP 41 -6.198 8.211 -9.419
330 HD1 TRP 41 HD1 TRP 41 -7.123 8.668 -13.070
331 HE1 TRP 41 HE1 TRP 41 -9.610 9.309 -13.234
332 HE3 TRP 41 HE3 TRP 41 -8.084 9.467 -8.113
333 HZ2 TRP 41 HZ2 TRP 41 -11.702 10.057 -11.493
334 HZ3 TRP 41 HZ3 TRP 41 -10.354 10.144 -7.446
335 HH2 TRP 41 HH2 TRP 41 -12.124 10.432 -9.102
336 H TRP 42 H TRP 42 -4.690 11.106 -8.028
337 HA TRP 42 HA TRP 42 -2.153 9.712 -7.588
338 HB2 TRP 42 HB2 TRP 42 -3.345 12.250 -6.506
339 HB3 TRP 42 HB3 TRP 42 -2.000 11.466 -5.681
340 HD1 TRP 42 HD1 TRP 42 -0.713 10.590 -8.673
341 HE1 TRP 42 HE1 TRP 42 0.652 12.408 -9.881
342 HE3 TRP 42 HE3 TRP 42 -2.487 14.707 -6.214
343 HZ2 TRP 42 HZ2 TRP 42 0.939 15.215 -9.801
344 HZ3 TRP 42 HZ3 TRP 42 -1.615 16.921 -6.840
345 HH2 TRP 42 HH2 TRP 42 0.063 17.167 -8.596
346 H LYS 43 H LYS 43 -2.435 7.826 -6.568
347 HA LYS 43 HA LYS 43 -4.552 7.160 -4.867
348 HB2 LYS 43 HB2 LYS 43 -3.195 5.453 -5.927
349 HB3 LYS 43 HB3 LYS 43 -1.769 5.995 -5.051
350 HG2 LYS 43 HG2 LYS 43 -3.442 5.468 -2.996
351 HG3 LYS 43 HG3 LYS 43 -3.987 4.278 -4.181
352 HD2 LYS 43 HD2 LYS 43 -1.061 4.575 -3.751
353 HD3 LYS 43 HD3 LYS 43 -2.003 3.776 -2.490
354 HE2 LYS 43 HE2 LYS 43 -1.857 1.909 -3.690
355 HE3 LYS 43 HE3 LYS 43 -2.917 2.669 -4.876
356 HZ1 LYS 43 HZ1 LYS 43 0.049 2.828 -4.881
357 HZ2 LYS 43 HZ2 LYS 43 -0.877 1.825 -5.880
358 HZ3 LYS 43 HZ3 LYS 43 -0.985 3.506 -6.036
359 H VAL 44 H VAL 44 -4.954 7.505 -2.771
360 HA VAL 44 HA VAL 44 -2.775 8.303 -0.990
361 HB VAL 44 HB VAL 44 -3.932 10.213 -0.120
362 HG11 VAL 44 HG11 VAL 44 -3.431 11.668 -1.797
363 HG12 VAL 44 HG12 VAL 44 -2.688 10.215 -2.467
364 HG13 VAL 44 HG13 VAL 44 -4.284 10.725 -3.020
365 HG21 VAL 44 HG21 VAL 44 -6.066 10.993 -1.091
366 HG22 VAL 44 HG22 VAL 44 -6.145 9.513 -2.047
367 HG23 VAL 44 HG23 VAL 44 -6.214 9.431 -0.287
368 H GLU 45 H GLU 45 -3.654 8.510 1.329
369 HA GLU 45 HA GLU 45 -5.661 6.399 1.780
370 HB2 GLU 45 HB2 GLU 45 -3.574 5.480 2.435
371 HB3 GLU 45 HB3 GLU 45 -3.088 6.965 3.242
372 HG2 GLU 45 HG2 GLU 45 -4.504 6.586 5.055
373 HG3 GLU 45 HG3 GLU 45 -5.458 5.392 4.177
374 H VAL 46 H VAL 46 -7.410 7.038 2.841
375 HA VAL 46 HA VAL 46 -7.199 9.187 4.820
376 HB VAL 46 HB VAL 46 -9.419 10.088 3.915
377 HG11 VAL 46 HG11 VAL 46 -7.130 11.153 3.737
378 HG12 VAL 46 HG12 VAL 46 -7.057 10.503 2.099
379 HG13 VAL 46 HG13 VAL 46 -8.317 11.658 2.534
380 HG21 VAL 46 HG21 VAL 46 -8.527 8.987 1.283
381 HG22 VAL 46 HG22 VAL 46 -9.555 8.018 2.339
382 HG23 VAL 46 HG23 VAL 46 -10.111 9.591 1.767
383 H ASN 47 H ASN 47 -8.350 8.804 6.615
384 HA ASN 47 HA ASN 47 -9.469 7.494 8.136
385 HB2 ASN 47 HB2 ASN 47 -11.946 7.173 7.305
386 HB3 ASN 47 HB3 ASN 47 -11.331 8.782 7.673
387 HD21 ASN 47 HD21 ASN 47 -12.211 6.555 5.148
388 HD22 ASN 47 HD22 ASN 47 -12.306 7.722 3.878
389 H ASP 48 H ASP 48 -7.933 5.701 7.399
390 HA ASP 48 HA ASP 48 -7.526 3.556 6.679
391 HB2 ASP 48 HB2 ASP 48 -9.033 3.497 8.825
392 HB3 ASP 48 HB3 ASP 48 -10.251 2.868 7.719
393 H ARG 49 H ARG 49 -8.639 5.150 4.615
394 HA ARG 49 HA ARG 49 -9.785 3.035 2.976
395 HB2 ARG 49 HB2 ARG 49 -11.308 5.293 3.978
396 HB3 ARG 49 HB3 ARG 49 -11.270 5.275 2.220
397 HG2 ARG 49 HG2 ARG 49 -12.009 2.857 3.839
398 HG3 ARG 49 HG3 ARG 49 -13.191 4.065 3.332
399 HD2 ARG 49 HD2 ARG 49 -11.620 3.375 1.073
400 HD3 ARG 49 HD3 ARG 49 -12.131 1.879 1.854
401 HE ARG 49 HE ARG 49 -13.765 3.659 0.367
402 HH11 ARG 49 HH11 ARG 49 -13.787 1.541 3.130
403 HH12 ARG 49 HH12 ARG 49 -15.488 1.227 3.040
404 HH21 ARG 49 HH21 ARG 49 -16.006 3.254 0.238
405 HH22 ARG 49 HH22 ARG 49 -16.749 2.201 1.394
406 H GLN 50 H GLN 50 -7.754 3.101 1.930
407 HA GLN 50 HA GLN 50 -6.989 5.569 0.585
408 HB2 GLN 50 HB2 GLN 50 -4.925 4.516 0.094
409 HB3 GLN 50 HB3 GLN 50 -5.328 4.041 1.738
410 HG2 GLN 50 HG2 GLN 50 -4.722 2.018 0.943
411 HG3 GLN 50 HG3 GLN 50 -6.420 1.985 0.467
412 HE21 GLN 50 HE21 GLN 50 -3.172 2.717 -0.680
413 HE22 GLN 50 HE22 GLN 50 -3.482 2.363 -2.343
414 H GLY 51 H GLY 51 -6.892 5.834 -1.636
415 HA2 GLY 51 HA2 GLY 51 -7.645 3.691 -3.419
416 HA3 GLY 51 HA3 GLY 51 -8.883 4.925 -3.232
417 H PHE 52 H PHE 52 -8.823 6.565 -4.613
418 HA PHE 52 HA PHE 52 -6.257 7.466 -5.678
419 HB2 PHE 52 HB2 PHE 52 -8.515 6.332 -7.292
420 HB3 PHE 52 HB3 PHE 52 -7.489 7.585 -7.983
421 HD1 PHE 52 HD1 PHE 52 -7.906 4.125 -7.519
422 HD2 PHE 52 HD2 PHE 52 -4.920 7.143 -7.831
423 HE1 PHE 52 HE1 PHE 52 -6.248 2.416 -8.139
424 HE2 PHE 52 HE2 PHE 52 -3.258 5.439 -8.453
425 HZ PHE 52 HZ PHE 52 -3.921 3.072 -8.608
426 H VAL 53 H VAL 53 -6.139 9.607 -5.616
427 HA VAL 53 HA VAL 53 -8.651 11.141 -5.475
428 HB VAL 53 HB VAL 53 -6.416 11.155 -3.755
429 HG11 VAL 53 HG11 VAL 53 -5.327 12.663 -5.364
430 HG12 VAL 53 HG12 VAL 53 -6.692 13.772 -5.230
431 HG13 VAL 53 HG13 VAL 53 -5.667 13.462 -3.829
432 HG21 VAL 53 HG21 VAL 53 -7.776 12.454 -2.400
433 HG22 VAL 53 HG22 VAL 53 -8.500 13.302 -3.766
434 HG23 VAL 53 HG23 VAL 53 -8.945 11.629 -3.431
435 HA PRO 54 HA PRO 54 -7.594 13.086 -9.285
436 HB2 PRO 54 HB2 PRO 54 -9.110 15.324 -9.039
437 HB3 PRO 54 HB3 PRO 54 -9.796 13.733 -9.387
438 HG2 PRO 54 HG2 PRO 54 -9.624 15.193 -6.779
439 HG3 PRO 54 HG3 PRO 54 -10.979 14.271 -7.459
440 HD2 PRO 54 HD2 PRO 54 -9.324 13.252 -5.573
441 HD3 PRO 54 HD3 PRO 54 -10.083 12.245 -6.822
442 H ALA 55 H ALA 55 -5.679 14.006 -9.646
443 HA ALA 55 HA ALA 55 -4.311 15.646 -7.813
444 HB1 ALA 55 HB1 ALA 55 -3.802 15.449 -10.777
445 HB2 ALA 55 HB2 ALA 55 -2.657 15.930 -9.524
446 HB3 ALA 55 HB3 ALA 55 -3.245 14.268 -9.591
447 H ALA 56 H ALA 56 -5.800 16.501 -10.942
448 HA ALA 56 HA ALA 56 -5.386 19.211 -10.934
449 HB1 ALA 56 HB1 ALA 56 -6.383 18.001 -12.808
450 HB2 ALA 56 HB2 ALA 56 -7.872 17.791 -11.886
451 HB3 ALA 56 HB3 ALA 56 -7.352 19.407 -12.366
452 H TYR 57 H TYR 57 -7.738 17.379 -9.093
453 HA TYR 57 HA TYR 57 -8.971 19.824 -8.079
454 HB2 TYR 57 HB2 TYR 57 -9.647 16.900 -7.786
455 HB3 TYR 57 HB3 TYR 57 -10.454 18.151 -6.847
456 HD1 TYR 57 HD1 TYR 57 -11.020 20.280 -8.617
457 HD2 TYR 57 HD2 TYR 57 -11.011 16.110 -9.464
458 HE1 TYR 57 HE1 TYR 57 -12.594 20.659 -10.469
459 HE2 TYR 57 HE2 TYR 57 -12.584 16.478 -11.319
460 HH TYR 57 HH TYR 57 -13.094 18.748 -12.877
461 H VAL 58 H VAL 58 -6.282 19.468 -7.375
462 HA VAL 58 HA VAL 58 -6.543 19.391 -4.474
463 HB VAL 58 HB VAL 58 -5.651 17.126 -5.645
464 HG11 VAL 58 HG11 VAL 58 -3.317 16.993 -5.756
465 HG12 VAL 58 HG12 VAL 58 -3.702 18.522 -6.546
466 HG13 VAL 58 HG13 VAL 58 -3.099 18.513 -4.889
467 HG21 VAL 58 HG21 VAL 58 -6.157 17.628 -3.228
468 HG22 VAL 58 HG22 VAL 58 -4.839 16.490 -3.506
469 HG23 VAL 58 HG23 VAL 58 -4.484 18.161 -3.070
470 H LYS 59 H LYS 59 -4.378 20.051 -3.446
471 HA LYS 59 HA LYS 59 -2.688 21.714 -5.105
472 HB2 LYS 59 HB2 LYS 59 -4.898 22.943 -4.144
473 HB3 LYS 59 HB3 LYS 59 -3.798 23.192 -2.794
474 HG2 LYS 59 HG2 LYS 59 -2.586 24.708 -3.904
475 HG3 LYS 59 HG3 LYS 59 -2.633 23.789 -5.410
476 HD2 LYS 59 HD2 LYS 59 -3.810 25.782 -5.852
477 HD3 LYS 59 HD3 LYS 59 -5.050 24.547 -5.621
478 HE2 LYS 59 HE2 LYS 59 -5.501 25.316 -3.406
479 HE3 LYS 59 HE3 LYS 59 -4.106 26.393 -3.435
480 HZ1 LYS 59 HZ1 LYS 59 -5.960 26.873 -5.576
481 HZ2 LYS 59 HZ2 LYS 59 -6.647 27.098 -4.046
482 HZ3 LYS 59 HZ3 LYS 59 -5.261 27.963 -4.487
483 H LYS 60 H LYS 60 -0.732 21.123 -4.455
484 HA LYS 60 HA LYS 60 -0.164 19.952 -1.951
485 HB2 LYS 60 HB2 LYS 60 1.125 19.891 -4.249
486 HB3 LYS 60 HB3 LYS 60 1.978 21.270 -3.569
487 HG2 LYS 60 HG2 LYS 60 1.715 18.740 -2.002
488 HG3 LYS 60 HG3 LYS 60 2.947 18.897 -3.256
489 HD2 LYS 60 HD2 LYS 60 2.811 21.185 -1.438
490 HD3 LYS 60 HD3 LYS 60 3.231 19.667 -0.642
491 HE2 LYS 60 HE2 LYS 60 4.994 19.332 -2.374
492 HE3 LYS 60 HE3 LYS 60 4.628 20.943 -2.990
493 HZ1 LYS 60 HZ1 LYS 60 5.973 21.787 -1.469
494 HZ2 LYS 60 HZ2 LYS 60 5.028 21.131 -0.228
495 HZ3 LYS 60 HZ3 LYS 60 6.316 20.241 -0.871
496 H LEU 61 H LEU 61 -0.872 21.325 -0.312
497 HA LEU 61 HA LEU 61 0.691 23.803 0.011
498 HB2 LEU 61 HB2 LEU 61 -1.996 23.208 1.232
499 HB3 LEU 61 HB3 LEU 61 -1.127 24.741 1.254
500 HG LEU 61 HG LEU 61 -2.103 23.491 -1.301
501 HD11 LEU 61 HD11 LEU 61 -4.191 23.864 -0.632
502 HD12 LEU 61 HD12 LEU 61 -3.657 24.708 0.822
503 HD13 LEU 61 HD13 LEU 61 -3.807 25.584 -0.702
504 HD21 LEU 61 HD21 LEU 61 -2.134 26.087 -1.766
505 HD22 LEU 61 HD22 LEU 61 -0.946 26.101 -0.463
506 HD23 LEU 61 HD23 LEU 61 -0.650 25.145 -1.916
507 H ASP 62 H ASP 62 1.993 21.639 0.807
508 HA ASP 62 HA ASP 62 2.065 21.955 3.691
509 HB2 ASP 62 HB2 ASP 62 0.643 19.825 2.683
510 HB3 ASP 62 HB3 ASP 62 2.234 19.122 2.959
Start of MODEL 6
1 H1 MET 1 H MET 1 -0.541 -0.593 -0.826
2 HA MET 1 HA MET 1 1.887 -0.881 -1.657
3 HB2 MET 1 HB2 MET 1 -0.151 0.678 -3.252
4 HB3 MET 1 HB3 MET 1 1.320 -0.004 -3.933
5 HG2 MET 1 HG2 MET 1 0.357 -2.210 -2.826
6 HG3 MET 1 HG3 MET 1 -1.163 -1.346 -3.042
7 HE1 MET 1 HE1 MET 1 -0.296 -4.002 -3.972
8 HE2 MET 1 HE2 MET 1 -0.758 -4.168 -5.666
9 HE3 MET 1 HE3 MET 1 0.944 -4.024 -5.226
10 H ASP 2 H ASP 2 0.624 2.326 -2.516
11 HA ASP 2 HA ASP 2 1.544 4.409 -2.397
12 HB2 ASP 2 HB2 ASP 2 3.820 3.423 -0.719
13 HB3 ASP 2 HB3 ASP 2 2.964 4.961 -0.646
14 H GLU 3 H GLU 3 4.424 2.321 -2.164
15 HA GLU 3 HA GLU 3 6.097 1.899 -3.670
16 HB2 GLU 3 HB2 GLU 3 4.087 2.126 -5.349
17 HB3 GLU 3 HB3 GLU 3 4.846 3.664 -5.736
18 HG2 GLU 3 HG2 GLU 3 6.912 1.785 -5.755
19 HG3 GLU 3 HG3 GLU 3 5.555 1.013 -6.574
20 H THR 4 H THR 4 4.850 5.223 -3.883
21 HA THR 4 HA THR 4 7.313 6.302 -2.888
22 HB THR 4 HB THR 4 6.593 7.192 -5.672
23 HG1 THR 4 HG1 THR 4 7.834 5.643 -6.502
24 HG21 THR 4 HG21 THR 4 8.913 7.572 -3.807
25 HG22 THR 4 HG22 THR 4 9.106 7.783 -5.548
26 HG23 THR 4 HG23 THR 4 7.962 8.788 -4.659
27 H GLY 5 H GLY 5 5.406 6.839 -1.452
28 HA2 GLY 5 HA2 GLY 5 3.794 9.072 -2.446
29 HA3 GLY 5 HA3 GLY 5 3.537 8.199 -0.943
30 H LYS 6 H LYS 6 4.400 8.969 0.912
31 HA LYS 6 HA LYS 6 5.203 10.566 2.333
32 HB2 LYS 6 HB2 LYS 6 7.416 10.063 0.386
33 HB3 LYS 6 HB3 LYS 6 7.611 11.336 1.584
34 HG2 LYS 6 HG2 LYS 6 8.576 9.501 2.605
35 HG3 LYS 6 HG3 LYS 6 6.951 9.524 3.293
36 HD2 LYS 6 HD2 LYS 6 6.254 7.846 1.622
37 HD3 LYS 6 HD3 LYS 6 7.910 7.792 1.014
38 HE2 LYS 6 HE2 LYS 6 8.416 6.277 2.555
39 HE3 LYS 6 HE3 LYS 6 8.020 7.440 3.820
40 HZ1 LYS 6 HZ1 LYS 6 6.307 5.356 2.627
41 HZ2 LYS 6 HZ2 LYS 6 6.630 5.661 4.260
42 HZ3 LYS 6 HZ3 LYS 6 5.619 6.701 3.389
43 H GLU 7 H GLU 7 3.399 11.928 1.368
44 HA GLU 7 HA GLU 7 4.376 14.558 0.956
45 HB2 GLU 7 HB2 GLU 7 3.933 12.970 -1.401
46 HB3 GLU 7 HB3 GLU 7 2.783 14.299 -1.358
47 HG2 GLU 7 HG2 GLU 7 5.209 15.455 -0.664
48 HG3 GLU 7 HG3 GLU 7 5.605 14.318 -1.951
49 H LEU 8 H LEU 8 2.588 16.134 0.659
50 HA LEU 8 HA LEU 8 -0.020 15.074 1.500
51 HB2 LEU 8 HB2 LEU 8 1.775 16.671 3.054
52 HB3 LEU 8 HB3 LEU 8 0.313 17.596 2.716
53 HG LEU 8 HG LEU 8 -1.055 15.983 3.811
54 HD11 LEU 8 HD11 LEU 8 0.010 13.958 4.868
55 HD12 LEU 8 HD12 LEU 8 -0.129 13.924 3.110
56 HD13 LEU 8 HD13 LEU 8 1.424 14.282 3.865
57 HD21 LEU 8 HD21 LEU 8 0.864 15.789 5.907
58 HD22 LEU 8 HD22 LEU 8 1.048 17.353 5.112
59 HD23 LEU 8 HD23 LEU 8 -0.518 16.876 5.768
60 H VAL 9 H VAL 9 -1.825 16.406 0.983
61 HA VAL 9 HA VAL 9 -1.347 18.705 -0.748
62 HB VAL 9 HB VAL 9 -2.778 17.892 -2.529
63 HG11 VAL 9 HG11 VAL 9 -0.556 15.982 -1.819
64 HG12 VAL 9 HG12 VAL 9 -1.337 16.064 -3.398
65 HG13 VAL 9 HG13 VAL 9 -0.430 17.449 -2.790
66 HG21 VAL 9 HG21 VAL 9 -3.013 15.426 -0.817
67 HG22 VAL 9 HG22 VAL 9 -4.306 16.482 -1.385
68 HG23 VAL 9 HG23 VAL 9 -3.438 15.458 -2.529
69 H LEU 10 H LEU 10 -3.449 19.783 -1.345
70 HA LEU 10 HA LEU 10 -5.362 19.524 0.881
71 HB2 LEU 10 HB2 LEU 10 -4.179 21.883 -0.483
72 HB3 LEU 10 HB3 LEU 10 -5.842 22.007 0.087
73 HG LEU 10 HG LEU 10 -4.076 22.906 1.638
74 HD11 LEU 10 HD11 LEU 10 -5.410 20.737 3.128
75 HD12 LEU 10 HD12 LEU 10 -5.406 22.478 3.410
76 HD13 LEU 10 HD13 LEU 10 -6.454 21.788 2.171
77 HD21 LEU 10 HD21 LEU 10 -2.408 21.146 1.258
78 HD22 LEU 10 HD22 LEU 10 -2.811 21.315 2.967
79 HD23 LEU 10 HD23 LEU 10 -3.477 19.976 2.032
80 H ALA 11 H ALA 11 -7.548 19.590 0.445
81 HA ALA 11 HA ALA 11 -8.360 18.682 -2.125
82 HB1 ALA 11 HB1 ALA 11 -9.618 19.122 0.486
83 HB2 ALA 11 HB2 ALA 11 -10.693 19.348 -0.894
84 HB3 ALA 11 HB3 ALA 11 -9.843 17.818 -0.680
85 H LEU 12 H LEU 12 -8.324 20.019 -3.822
86 HA LEU 12 HA LEU 12 -8.826 22.839 -3.568
87 HB2 LEU 12 HB2 LEU 12 -7.228 21.723 -5.195
88 HB3 LEU 12 HB3 LEU 12 -8.653 21.263 -6.124
89 HG LEU 12 HG LEU 12 -8.173 24.140 -5.460
90 HD11 LEU 12 HD11 LEU 12 -6.633 24.474 -7.113
91 HD12 LEU 12 HD12 LEU 12 -6.132 22.880 -6.548
92 HD13 LEU 12 HD13 LEU 12 -7.111 23.031 -8.007
93 HD21 LEU 12 HD21 LEU 12 -9.124 23.808 -8.051
94 HD22 LEU 12 HD22 LEU 12 -9.967 22.581 -7.105
95 HD23 LEU 12 HD23 LEU 12 -10.059 24.277 -6.631
96 H TYR 13 H TYR 13 -10.667 20.017 -4.366
97 HA TYR 13 HA TYR 13 -13.058 21.679 -4.621
98 HB2 TYR 13 HB2 TYR 13 -12.538 21.330 -6.915
99 HB3 TYR 13 HB3 TYR 13 -12.141 19.637 -6.643
100 HD1 TYR 13 HD1 TYR 13 -15.113 21.633 -5.589
101 HD2 TYR 13 HD2 TYR 13 -13.630 18.393 -7.914
102 HE1 TYR 13 HE1 TYR 13 -17.418 21.005 -6.172
103 HE2 TYR 13 HE2 TYR 13 -15.931 17.757 -8.505
104 HH TYR 13 HH TYR 13 -18.297 19.281 -8.596
105 H ASP 14 H ASP 14 -14.761 20.870 -3.556
106 HA ASP 14 HA ASP 14 -14.478 18.662 -1.839
107 HB2 ASP 14 HB2 ASP 14 -16.203 20.757 -1.978
108 HB3 ASP 14 HB3 ASP 14 -17.236 19.448 -2.546
109 H TYR 15 H TYR 15 -14.147 16.681 -2.660
110 HA TYR 15 HA TYR 15 -15.965 15.734 -4.773
111 HB2 TYR 15 HB2 TYR 15 -13.229 15.704 -4.765
112 HB3 TYR 15 HB3 TYR 15 -13.602 14.091 -4.168
113 HD1 TYR 15 HD1 TYR 15 -14.186 12.390 -5.659
114 HD2 TYR 15 HD2 TYR 15 -14.351 16.439 -6.955
115 HE1 TYR 15 HE1 TYR 15 -14.604 11.630 -7.961
116 HE2 TYR 15 HE2 TYR 15 -14.771 15.691 -9.260
117 HH TYR 15 HH TYR 15 -14.948 12.234 -10.065
118 H GLN 16 H GLN 16 -17.410 14.224 -4.281
119 HA GLN 16 HA GLN 16 -17.264 12.951 -1.652
120 HB2 GLN 16 HB2 GLN 16 -19.445 13.623 -3.550
121 HB3 GLN 16 HB3 GLN 16 -19.663 12.176 -2.573
122 HG2 GLN 16 HG2 GLN 16 -20.614 14.342 -1.666
123 HG3 GLN 16 HG3 GLN 16 -19.623 13.379 -0.572
124 HE21 GLN 16 HE21 GLN 16 -18.463 14.652 0.670
125 HE22 GLN 16 HE22 GLN 16 -17.635 16.085 0.175
126 H GLU 17 H GLU 17 -15.731 12.169 -4.155
127 HA GLU 17 HA GLU 17 -15.190 10.296 -5.358
128 HB2 GLU 17 HB2 GLU 17 -14.721 8.393 -4.010
129 HB3 GLU 17 HB3 GLU 17 -14.463 9.804 -2.995
130 HG2 GLU 17 HG2 GLU 17 -16.439 9.436 -1.788
131 HG3 GLU 17 HG3 GLU 17 -17.052 8.294 -2.982
132 H LYS 18 H LYS 18 -16.097 7.646 -5.156
133 HA LYS 18 HA LYS 18 -18.878 7.335 -5.242
134 HB2 LYS 18 HB2 LYS 18 -19.055 7.047 -7.781
135 HB3 LYS 18 HB3 LYS 18 -19.036 8.690 -7.155
136 HG2 LYS 18 HG2 LYS 18 -16.775 9.003 -7.812
137 HG3 LYS 18 HG3 LYS 18 -16.585 7.289 -8.192
138 HD2 LYS 18 HD2 LYS 18 -18.578 9.052 -9.599
139 HD3 LYS 18 HD3 LYS 18 -16.914 8.863 -10.159
140 HE2 LYS 18 HE2 LYS 18 -18.910 6.632 -9.781
141 HE3 LYS 18 HE3 LYS 18 -18.455 7.351 -11.325
142 HZ1 LYS 18 HZ1 LYS 18 -17.103 5.360 -9.784
143 HZ2 LYS 18 HZ2 LYS 18 -16.889 5.796 -11.405
144 HZ3 LYS 18 HZ3 LYS 18 -16.079 6.646 -10.187
145 H SER 19 H SER 19 -15.798 6.336 -6.655
146 HA SER 19 HA SER 19 -16.695 3.557 -6.737
147 HB2 SER 19 HB2 SER 19 -14.847 5.117 -8.260
148 HB3 SER 19 HB3 SER 19 -13.965 3.788 -7.507
149 HG SER 19 HG SER 19 -15.011 3.381 -9.621
150 HA PRO 20 HA PRO 20 -14.595 2.216 -3.128
151 HB2 PRO 20 HB2 PRO 20 -13.477 -0.132 -3.907
152 HB3 PRO 20 HB3 PRO 20 -15.216 0.070 -3.663
153 HG2 PRO 20 HG2 PRO 20 -13.643 0.109 -6.210
154 HG3 PRO 20 HG3 PRO 20 -15.199 -0.670 -5.868
155 HD2 PRO 20 HD2 PRO 20 -15.010 1.695 -7.172
156 HD3 PRO 20 HD3 PRO 20 -16.380 1.294 -6.117
157 H ARG 21 H ARG 21 -12.710 2.447 -6.068
158 HA ARG 21 HA ARG 21 -10.204 2.443 -4.564
159 HB2 ARG 21 HB2 ARG 21 -9.093 2.335 -6.697
160 HB3 ARG 21 HB3 ARG 21 -10.385 1.143 -6.679
161 HG2 ARG 21 HG2 ARG 21 -11.143 3.764 -7.756
162 HG3 ARG 21 HG3 ARG 21 -9.929 2.890 -8.692
163 HD2 ARG 21 HD2 ARG 21 -12.681 1.947 -7.910
164 HD3 ARG 21 HD3 ARG 21 -12.085 2.292 -9.533
165 HE ARG 21 HE ARG 21 -10.427 0.337 -8.637
166 HH11 ARG 21 HH11 ARG 21 -13.884 0.658 -8.890
167 HH12 ARG 21 HH12 ARG 21 -14.156 -1.037 -9.123
168 HH21 ARG 21 HH21 ARG 21 -10.771 -1.897 -8.944
169 HH22 ARG 21 HH22 ARG 21 -12.384 -2.490 -9.153
170 H GLU 22 H GLU 22 -12.299 4.629 -4.554
171 HA GLU 22 HA GLU 22 -10.594 6.839 -5.494
172 HB2 GLU 22 HB2 GLU 22 -13.573 6.569 -5.231
173 HB3 GLU 22 HB3 GLU 22 -12.816 8.155 -5.245
174 HG2 GLU 22 HG2 GLU 22 -11.828 7.664 -7.426
175 HG3 GLU 22 HG3 GLU 22 -12.602 6.080 -7.415
176 H VAL 23 H VAL 23 -10.736 8.847 -4.179
177 HA VAL 23 HA VAL 23 -11.011 8.218 -1.311
178 HB VAL 23 HB VAL 23 -8.877 9.766 -2.744
179 HG11 VAL 23 HG11 VAL 23 -9.995 10.282 -0.055
180 HG12 VAL 23 HG12 VAL 23 -8.237 10.261 -0.195
181 HG13 VAL 23 HG13 VAL 23 -9.186 11.375 -1.178
182 HG21 VAL 23 HG21 VAL 23 -7.987 8.246 -0.506
183 HG22 VAL 23 HG22 VAL 23 -9.057 7.239 -1.482
184 HG23 VAL 23 HG23 VAL 23 -7.644 7.996 -2.218
185 H THR 24 H THR 24 -12.304 9.507 -0.163
186 HA THR 24 HA THR 24 -13.637 11.704 -1.497
187 HB THR 24 HB THR 24 -14.064 10.864 1.365
188 HG1 THR 24 HG1 THR 24 -15.011 9.102 0.679
189 HG21 THR 24 HG21 THR 24 -15.091 12.967 0.077
190 HG22 THR 24 HG22 THR 24 -16.245 11.739 -0.446
191 HG23 THR 24 HG23 THR 24 -16.007 12.051 1.274
192 H MET 25 H MET 25 -13.090 13.775 -1.320
193 HA MET 25 HA MET 25 -11.546 14.635 1.031
194 HB2 MET 25 HB2 MET 25 -10.063 15.928 -0.293
195 HB3 MET 25 HB3 MET 25 -10.126 14.339 -1.043
196 HG2 MET 25 HG2 MET 25 -12.137 16.044 -2.171
197 HG3 MET 25 HG3 MET 25 -10.559 16.824 -2.246
198 HE1 MET 25 HE1 MET 25 -9.671 16.512 -4.985
199 HE2 MET 25 HE2 MET 25 -8.762 16.319 -3.485
200 HE3 MET 25 HE3 MET 25 -8.596 15.130 -4.776
201 H LYS 26 H LYS 26 -11.831 16.814 1.662
202 HA LYS 26 HA LYS 26 -14.240 18.082 0.529
203 HB2 LYS 26 HB2 LYS 26 -13.327 17.714 3.350
204 HB3 LYS 26 HB3 LYS 26 -14.253 19.153 2.946
205 HG2 LYS 26 HG2 LYS 26 -15.605 16.967 1.794
206 HG3 LYS 26 HG3 LYS 26 -15.174 16.501 3.441
207 HD2 LYS 26 HD2 LYS 26 -16.059 19.016 3.863
208 HD3 LYS 26 HD3 LYS 26 -17.054 18.560 2.478
209 HE2 LYS 26 HE2 LYS 26 -16.800 17.027 5.065
210 HE3 LYS 26 HE3 LYS 26 -18.168 18.033 4.588
211 HZ1 LYS 26 HZ1 LYS 26 -18.678 15.749 4.153
212 HZ2 LYS 26 HZ2 LYS 26 -18.485 16.540 2.669
213 HZ3 LYS 26 HZ3 LYS 26 -17.256 15.539 3.260
214 H LYS 27 H LYS 27 -14.044 20.096 -0.220
215 HA LYS 27 HA LYS 27 -11.706 21.357 -0.779
216 HB2 LYS 27 HB2 LYS 27 -14.025 21.999 -1.554
217 HB3 LYS 27 HB3 LYS 27 -14.215 22.862 -0.034
218 HG2 LYS 27 HG2 LYS 27 -12.241 24.237 -0.621
219 HG3 LYS 27 HG3 LYS 27 -12.189 23.427 -2.188
220 HD2 LYS 27 HD2 LYS 27 -14.612 24.186 -2.466
221 HD3 LYS 27 HD3 LYS 27 -14.312 25.253 -1.092
222 HE2 LYS 27 HE2 LYS 27 -12.447 25.251 -3.430
223 HE3 LYS 27 HE3 LYS 27 -13.970 26.133 -3.518
224 HZ1 LYS 27 HZ1 LYS 27 -11.877 27.343 -2.688
225 HZ2 LYS 27 HZ2 LYS 27 -13.329 27.574 -1.850
226 HZ3 LYS 27 HZ3 LYS 27 -12.153 26.527 -1.232
227 H GLY 28 H GLY 28 -10.102 21.623 0.668
228 HA2 GLY 28 HA2 GLY 28 -9.132 23.217 2.200
229 HA3 GLY 28 HA3 GLY 28 -10.693 23.327 3.000
230 H ASP 29 H ASP 29 -9.345 20.259 2.039
231 HA ASP 29 HA ASP 29 -8.785 19.667 4.872
232 HB2 ASP 29 HB2 ASP 29 -9.951 17.717 4.783
233 HB3 ASP 29 HB3 ASP 29 -10.818 18.553 3.498
234 H ILE 30 H ILE 30 -7.355 17.653 5.078
235 HA ILE 30 HA ILE 30 -5.234 17.772 3.034
236 HB ILE 30 HB ILE 30 -5.084 18.193 5.888
237 HG12 ILE 30 HG12 ILE 30 -4.064 19.474 3.892
238 HG13 ILE 30 HG13 ILE 30 -3.082 19.284 5.340
239 HG21 ILE 30 HG21 ILE 30 -4.544 15.856 6.060
240 HG22 ILE 30 HG22 ILE 30 -3.372 15.990 4.748
241 HG23 ILE 30 HG23 ILE 30 -3.071 16.801 6.285
242 HD11 ILE 30 HD11 ILE 30 -2.133 18.830 2.918
243 HD12 ILE 30 HD12 ILE 30 -1.605 17.900 4.320
244 HD13 ILE 30 HD13 ILE 30 -2.814 17.232 3.223
245 H LEU 31 H LEU 31 -4.297 15.871 2.377
246 HA LEU 31 HA LEU 31 -5.311 13.383 3.570
247 HB2 LEU 31 HB2 LEU 31 -4.981 12.750 0.919
248 HB3 LEU 31 HB3 LEU 31 -6.516 13.041 1.734
249 HG LEU 31 HG LEU 31 -5.038 15.332 0.509
250 HD11 LEU 31 HD11 LEU 31 -6.700 13.296 -0.959
251 HD12 LEU 31 HD12 LEU 31 -6.355 14.911 -1.578
252 HD13 LEU 31 HD13 LEU 31 -5.036 13.777 -1.292
253 HD21 LEU 31 HD21 LEU 31 -7.607 15.789 0.034
254 HD22 LEU 31 HD22 LEU 31 -7.796 14.691 1.401
255 HD23 LEU 31 HD23 LEU 31 -6.860 16.174 1.585
256 H THR 32 H THR 32 -3.985 11.484 3.054
257 HA THR 32 HA THR 32 -1.151 12.223 2.957
258 HB THR 32 HB THR 32 -2.368 9.574 3.758
259 HG1 THR 32 HG1 THR 32 -1.780 10.388 5.913
260 HG21 THR 32 HG21 THR 32 0.234 10.267 4.845
261 HG22 THR 32 HG22 THR 32 -0.284 8.802 4.010
262 HG23 THR 32 HG23 THR 32 0.248 10.204 3.082
263 H LEU 33 H LEU 33 -0.352 12.207 0.951
264 HA LEU 33 HA LEU 33 -1.367 10.756 -1.218
265 HB2 LEU 33 HB2 LEU 33 1.100 12.282 -0.644
266 HB3 LEU 33 HB3 LEU 33 1.171 11.147 -1.989
267 HG LEU 33 HG LEU 33 0.615 13.554 -2.552
268 HD11 LEU 33 HD11 LEU 33 0.105 11.404 -3.899
269 HD12 LEU 33 HD12 LEU 33 -1.568 11.713 -3.437
270 HD13 LEU 33 HD13 LEU 33 -0.672 12.917 -4.364
271 HD21 LEU 33 HD21 LEU 33 -1.775 14.164 -2.281
272 HD22 LEU 33 HD22 LEU 33 -1.977 12.760 -1.234
273 HD23 LEU 33 HD23 LEU 33 -0.896 14.068 -0.755
274 H LEU 34 H LEU 34 -0.647 8.892 -2.273
275 HA LEU 34 HA LEU 34 1.064 7.120 -0.657
276 HB2 LEU 34 HB2 LEU 34 -1.445 6.502 -2.192
277 HB3 LEU 34 HB3 LEU 34 -0.305 5.250 -1.702
278 HG LEU 34 HG LEU 34 -1.947 7.027 0.096
279 HD11 LEU 34 HD11 LEU 34 -3.134 5.103 0.681
280 HD12 LEU 34 HD12 LEU 34 -2.968 4.994 -1.071
281 HD13 LEU 34 HD13 LEU 34 -1.925 4.030 -0.024
282 HD21 LEU 34 HD21 LEU 34 -0.737 5.079 1.645
283 HD22 LEU 34 HD22 LEU 34 0.555 5.643 0.584
284 HD23 LEU 34 HD23 LEU 34 -0.318 6.792 1.598
285 H ASN 35 H ASN 35 -0.301 7.346 -3.949
286 HA ASN 35 HA ASN 35 2.126 6.170 -5.038
287 HB2 ASN 35 HB2 ASN 35 -0.028 5.392 -5.899
288 HB3 ASN 35 HB3 ASN 35 -0.440 7.032 -6.393
289 HD21 ASN 35 HD21 ASN 35 2.625 5.305 -6.689
290 HD22 ASN 35 HD22 ASN 35 2.697 5.368 -8.414
291 H SER 36 H SER 36 0.149 8.927 -6.127
292 HA SER 36 HA SER 36 0.710 11.019 -6.835
293 HB2 SER 36 HB2 SER 36 2.695 10.394 -4.834
294 HB3 SER 36 HB3 SER 36 3.410 11.366 -6.120
295 HG SER 36 HG SER 36 2.227 13.019 -5.537
296 H THR 37 H THR 37 1.514 8.402 -8.221
297 HA THR 37 HA THR 37 3.631 9.411 -9.978
298 HB THR 37 HB THR 37 2.390 6.655 -9.859
299 HG1 THR 37 HG1 THR 37 4.993 7.442 -9.027
300 HG21 THR 37 HG21 THR 37 3.316 6.411 -11.882
301 HG22 THR 37 HG22 THR 37 4.177 7.945 -11.758
302 HG23 THR 37 HG23 THR 37 4.876 6.483 -11.062
303 H ASN 38 H ASN 38 0.256 8.455 -9.968
304 HA ASN 38 HA ASN 38 0.046 8.954 -12.842
305 HB2 ASN 38 HB2 ASN 38 -1.049 6.942 -12.120
306 HB3 ASN 38 HB3 ASN 38 -1.897 7.799 -10.836
307 HD21 ASN 38 HD21 ASN 38 -1.405 8.565 -14.259
308 HD22 ASN 38 HD22 ASN 38 -3.084 8.670 -14.654
309 H LYS 39 H LYS 39 0.045 11.122 -13.155
310 HA LYS 39 HA LYS 39 -0.910 13.128 -11.562
311 HB2 LYS 39 HB2 LYS 39 0.326 13.665 -13.539
312 HB3 LYS 39 HB3 LYS 39 -0.888 12.924 -14.573
313 HG2 LYS 39 HG2 LYS 39 -2.489 14.668 -13.910
314 HG3 LYS 39 HG3 LYS 39 -1.230 15.426 -12.932
315 HD2 LYS 39 HD2 LYS 39 -0.844 16.632 -14.794
316 HD3 LYS 39 HD3 LYS 39 0.038 15.196 -15.318
317 HE2 LYS 39 HE2 LYS 39 -2.668 14.738 -15.932
318 HE3 LYS 39 HE3 LYS 39 -2.319 16.392 -16.434
319 HZ1 LYS 39 HZ1 LYS 39 -0.180 15.143 -17.382
320 HZ2 LYS 39 HZ2 LYS 39 -1.302 13.881 -17.486
321 HZ3 LYS 39 HZ3 LYS 39 -1.600 15.346 -18.278
322 H ASP 40 H ASP 40 -2.748 11.417 -14.086
323 HA ASP 40 HA ASP 40 -5.160 12.712 -13.897
324 HB2 ASP 40 HB2 ASP 40 -4.767 11.000 -15.567
325 HB3 ASP 40 HB3 ASP 40 -4.654 9.761 -14.320
326 H TRP 41 H TRP 41 -4.049 9.972 -11.924
327 HA TRP 41 HA TRP 41 -5.933 10.803 -9.839
328 HB2 TRP 41 HB2 TRP 41 -5.719 8.058 -11.058
329 HB3 TRP 41 HB3 TRP 41 -6.340 8.294 -9.426
330 HD1 TRP 41 HD1 TRP 41 -7.291 8.697 -13.074
331 HE1 TRP 41 HE1 TRP 41 -9.775 9.351 -13.230
332 HE3 TRP 41 HE3 TRP 41 -8.207 9.596 -8.125
333 HZ2 TRP 41 HZ2 TRP 41 -11.849 10.144 -11.487
334 HZ3 TRP 41 HZ3 TRP 41 -10.468 10.299 -7.453
335 HH2 TRP 41 HH2 TRP 41 -12.249 10.567 -9.101
336 H TRP 42 H TRP 42 -4.792 11.185 -8.069
337 HA TRP 42 HA TRP 42 -2.254 9.780 -7.668
338 HB2 TRP 42 HB2 TRP 42 -3.409 12.333 -6.577
339 HB3 TRP 42 HB3 TRP 42 -2.048 11.547 -5.781
340 HD1 TRP 42 HD1 TRP 42 -0.827 10.648 -8.788
341 HE1 TRP 42 HE1 TRP 42 0.512 12.452 -10.043
342 HE3 TRP 42 HE3 TRP 42 -2.550 14.789 -6.335
343 HZ2 TRP 42 HZ2 TRP 42 0.799 15.260 -9.999
344 HZ3 TRP 42 HZ3 TRP 42 -1.692 16.997 -7.002
345 HH2 TRP 42 HH2 TRP 42 -0.052 17.225 -8.796
346 H LYS 43 H LYS 43 -2.541 7.901 -6.635
347 HA LYS 43 HA LYS 43 -4.628 7.261 -4.891
348 HB2 LYS 43 HB2 LYS 43 -3.286 5.545 -5.964
349 HB3 LYS 43 HB3 LYS 43 -1.852 6.080 -5.096
350 HG2 LYS 43 HG2 LYS 43 -3.544 5.569 -3.040
351 HG3 LYS 43 HG3 LYS 43 -4.059 4.362 -4.221
352 HD2 LYS 43 HD2 LYS 43 -1.143 4.683 -3.802
353 HD3 LYS 43 HD3 LYS 43 -2.065 3.939 -2.493
354 HE2 LYS 43 HE2 LYS 43 -2.061 2.017 -3.603
355 HE3 LYS 43 HE3 LYS 43 -2.953 2.783 -4.916
356 HZ1 LYS 43 HZ1 LYS 43 -0.063 3.210 -4.802
357 HZ2 LYS 43 HZ2 LYS 43 -0.609 1.687 -5.296
358 HZ3 LYS 43 HZ3 LYS 43 -1.082 3.071 -6.146
359 H VAL 44 H VAL 44 -4.961 7.524 -2.758
360 HA VAL 44 HA VAL 44 -2.755 8.413 -1.054
361 HB VAL 44 HB VAL 44 -3.965 10.261 -0.127
362 HG11 VAL 44 HG11 VAL 44 -3.626 11.752 -1.820
363 HG12 VAL 44 HG12 VAL 44 -2.808 10.349 -2.506
364 HG13 VAL 44 HG13 VAL 44 -4.447 10.751 -3.017
365 HG21 VAL 44 HG21 VAL 44 -6.218 9.472 -1.973
366 HG22 VAL 44 HG22 VAL 44 -6.212 9.364 -0.212
367 HG23 VAL 44 HG23 VAL 44 -6.172 10.942 -0.999
368 H GLU 45 H GLU 45 -3.758 8.723 1.298
369 HA GLU 45 HA GLU 45 -5.565 6.455 1.807
370 HB2 GLU 45 HB2 GLU 45 -3.012 6.171 2.333
371 HB3 GLU 45 HB3 GLU 45 -3.389 7.152 3.742
372 HG2 GLU 45 HG2 GLU 45 -4.292 5.432 4.805
373 HG3 GLU 45 HG3 GLU 45 -5.299 5.016 3.419
374 H VAL 46 H VAL 46 -7.341 7.054 2.842
375 HA VAL 46 HA VAL 46 -7.193 9.189 4.843
376 HB VAL 46 HB VAL 46 -9.466 9.993 3.945
377 HG11 VAL 46 HG11 VAL 46 -7.244 10.636 2.056
378 HG12 VAL 46 HG12 VAL 46 -8.427 11.708 2.806
379 HG13 VAL 46 HG13 VAL 46 -7.094 11.060 3.761
380 HG21 VAL 46 HG21 VAL 46 -8.471 8.984 1.310
381 HG22 VAL 46 HG22 VAL 46 -9.490 7.963 2.326
382 HG23 VAL 46 HG23 VAL 46 -10.087 9.524 1.763
383 H ASN 47 H ASN 47 -8.295 8.731 6.647
384 HA ASN 47 HA ASN 47 -9.357 7.368 8.161
385 HB2 ASN 47 HB2 ASN 47 -11.836 6.990 7.353
386 HB3 ASN 47 HB3 ASN 47 -11.262 8.608 7.747
387 HD21 ASN 47 HD21 ASN 47 -12.133 6.414 5.194
388 HD22 ASN 47 HD22 ASN 47 -12.267 7.602 3.946
389 H ASP 48 H ASP 48 -7.777 5.635 7.359
390 HA ASP 48 HA ASP 48 -7.323 3.514 6.598
391 HB2 ASP 48 HB2 ASP 48 -9.041 3.476 8.717
392 HB3 ASP 48 HB3 ASP 48 -9.920 2.498 7.546
393 H ARG 49 H ARG 49 -8.522 5.107 4.582
394 HA ARG 49 HA ARG 49 -9.661 2.985 2.941
395 HB2 ARG 49 HB2 ARG 49 -11.186 5.218 3.985
396 HB3 ARG 49 HB3 ARG 49 -11.169 5.227 2.227
397 HG2 ARG 49 HG2 ARG 49 -11.876 2.783 3.822
398 HG3 ARG 49 HG3 ARG 49 -13.070 3.989 3.336
399 HD2 ARG 49 HD2 ARG 49 -11.508 3.331 1.059
400 HD3 ARG 49 HD3 ARG 49 -12.006 1.824 1.829
401 HE ARG 49 HE ARG 49 -14.135 3.732 1.505
402 HH11 ARG 49 HH11 ARG 49 -12.356 1.132 0.023
403 HH12 ARG 49 HH12 ARG 49 -13.635 0.702 -1.063
404 HH21 ARG 49 HH21 ARG 49 -15.827 3.175 0.079
405 HH22 ARG 49 HH22 ARG 49 -15.608 1.865 -1.031
406 H GLN 50 H GLN 50 -7.648 3.070 1.862
407 HA GLN 50 HA GLN 50 -6.897 5.548 0.540
408 HB2 GLN 50 HB2 GLN 50 -4.911 4.318 -0.192
409 HB3 GLN 50 HB3 GLN 50 -5.139 4.177 1.546
410 HG2 GLN 50 HG2 GLN 50 -4.673 2.015 1.077
411 HG3 GLN 50 HG3 GLN 50 -6.418 1.975 0.826
412 HE21 GLN 50 HE21 GLN 50 -3.522 2.862 -1.032
413 HE22 GLN 50 HE22 GLN 50 -3.975 2.012 -2.466
414 H GLY 51 H GLY 51 -6.953 5.912 -1.647
415 HA2 GLY 51 HA2 GLY 51 -7.766 3.801 -3.464
416 HA3 GLY 51 HA3 GLY 51 -8.958 5.069 -3.222
417 H PHE 52 H PHE 52 -8.896 6.693 -4.616
418 HA PHE 52 HA PHE 52 -6.331 7.570 -5.702
419 HB2 PHE 52 HB2 PHE 52 -8.613 6.461 -7.297
420 HB3 PHE 52 HB3 PHE 52 -7.594 7.716 -7.994
421 HD1 PHE 52 HD1 PHE 52 -5.014 7.263 -7.834
422 HD2 PHE 52 HD2 PHE 52 -8.021 4.260 -7.591
423 HE1 PHE 52 HE1 PHE 52 -3.363 5.560 -8.490
424 HE2 PHE 52 HE2 PHE 52 -6.375 2.553 -8.245
425 HZ PHE 52 HZ PHE 52 -4.042 3.202 -8.695
426 H VAL 53 H VAL 53 -6.189 9.710 -5.626
427 HA VAL 53 HA VAL 53 -8.679 11.270 -5.425
428 HB VAL 53 HB VAL 53 -6.484 11.243 -3.723
429 HG11 VAL 53 HG11 VAL 53 -6.457 13.818 -5.293
430 HG12 VAL 53 HG12 VAL 53 -5.454 13.415 -3.899
431 HG13 VAL 53 HG13 VAL 53 -5.239 12.549 -5.421
432 HG21 VAL 53 HG21 VAL 53 -9.043 12.348 -3.859
433 HG22 VAL 53 HG22 VAL 53 -7.977 12.299 -2.455
434 HG23 VAL 53 HG23 VAL 53 -7.970 13.706 -3.519
435 HA PRO 54 HA PRO 54 -7.735 13.156 -9.298
436 HB2 PRO 54 HB2 PRO 54 -9.287 15.369 -9.049
437 HB3 PRO 54 HB3 PRO 54 -9.950 13.761 -9.363
438 HG2 PRO 54 HG2 PRO 54 -9.754 15.257 -6.778
439 HG3 PRO 54 HG3 PRO 54 -11.104 14.303 -7.418
440 HD2 PRO 54 HD2 PRO 54 -9.393 13.338 -5.554
441 HD3 PRO 54 HD3 PRO 54 -10.159 12.301 -6.775
442 H ALA 55 H ALA 55 -5.822 14.077 -9.675
443 HA ALA 55 HA ALA 55 -4.455 15.772 -7.902
444 HB1 ALA 55 HB1 ALA 55 -2.839 16.061 -9.645
445 HB2 ALA 55 HB2 ALA 55 -3.405 14.392 -9.690
446 HB3 ALA 55 HB3 ALA 55 -4.000 15.557 -10.873
447 H ALA 56 H ALA 56 -6.063 16.557 -10.989
448 HA ALA 56 HA ALA 56 -5.682 19.270 -11.052
449 HB1 ALA 56 HB1 ALA 56 -7.720 19.416 -12.391
450 HB2 ALA 56 HB2 ALA 56 -6.747 18.021 -12.857
451 HB3 ALA 56 HB3 ALA 56 -8.187 17.799 -11.864
452 H TYR 57 H TYR 57 -7.968 17.456 -9.102
453 HA TYR 57 HA TYR 57 -9.127 19.923 -8.049
454 HB2 TYR 57 HB2 TYR 57 -9.862 17.014 -7.725
455 HB3 TYR 57 HB3 TYR 57 -10.632 18.300 -6.802
456 HD1 TYR 57 HD1 TYR 57 -11.184 20.406 -8.594
457 HD2 TYR 57 HD2 TYR 57 -11.247 16.226 -9.385
458 HE1 TYR 57 HE1 TYR 57 -12.769 20.785 -10.435
459 HE2 TYR 57 HE2 TYR 57 -12.832 16.593 -11.230
460 HH TYR 57 HH TYR 57 -13.489 18.440 -12.753
461 H VAL 58 H VAL 58 -6.431 19.503 -7.422
462 HA VAL 58 HA VAL 58 -6.612 19.411 -4.516
463 HB VAL 58 HB VAL 58 -5.798 17.136 -5.739
464 HG11 VAL 58 HG11 VAL 58 -3.832 18.488 -6.652
465 HG12 VAL 58 HG12 VAL 58 -3.211 18.468 -5.001
466 HG13 VAL 58 HG13 VAL 58 -3.465 16.952 -5.866
467 HG21 VAL 58 HG21 VAL 58 -4.918 16.470 -3.614
468 HG22 VAL 58 HG22 VAL 58 -4.624 18.146 -3.153
469 HG23 VAL 58 HG23 VAL 58 -6.277 17.556 -3.325
470 H LYS 59 H LYS 59 -4.438 20.045 -3.531
471 HA LYS 59 HA LYS 59 -2.693 21.616 -5.208
472 HB2 LYS 59 HB2 LYS 59 -4.918 22.855 -3.892
473 HB3 LYS 59 HB3 LYS 59 -3.427 23.430 -3.159
474 HG2 LYS 59 HG2 LYS 59 -2.938 23.518 -5.891
475 HG3 LYS 59 HG3 LYS 59 -4.600 24.085 -5.712
476 HD2 LYS 59 HD2 LYS 59 -2.308 25.137 -4.064
477 HD3 LYS 59 HD3 LYS 59 -2.816 25.865 -5.589
478 HE2 LYS 59 HE2 LYS 59 -4.619 25.455 -3.207
479 HE3 LYS 59 HE3 LYS 59 -3.778 26.961 -3.572
480 HZ1 LYS 59 HZ1 LYS 59 -6.051 27.008 -4.376
481 HZ2 LYS 59 HZ2 LYS 59 -4.967 27.070 -5.675
482 HZ3 LYS 59 HZ3 LYS 59 -5.778 25.629 -5.318
483 H LYS 60 H LYS 60 -0.755 21.066 -4.483
484 HA LYS 60 HA LYS 60 -0.263 19.944 -1.943
485 HB2 LYS 60 HB2 LYS 60 1.099 19.864 -4.206
486 HB3 LYS 60 HB3 LYS 60 1.937 21.238 -3.496
487 HG2 LYS 60 HG2 LYS 60 1.649 18.533 -2.203
488 HG3 LYS 60 HG3 LYS 60 3.074 19.101 -3.075
489 HD2 LYS 60 HD2 LYS 60 2.669 21.133 -1.306
490 HD3 LYS 60 HD3 LYS 60 2.136 19.736 -0.367
491 HE2 LYS 60 HE2 LYS 60 4.218 18.854 -0.252
492 HE3 LYS 60 HE3 LYS 60 4.662 19.417 -1.862
493 HZ1 LYS 60 HZ1 LYS 60 5.046 21.599 -1.014
494 HZ2 LYS 60 HZ2 LYS 60 4.446 21.184 0.513
495 HZ3 LYS 60 HZ3 LYS 60 5.897 20.510 -0.037
496 H LEU 61 H LEU 61 -0.993 21.321 -0.329
497 HA LEU 61 HA LEU 61 0.545 23.814 -0.005
498 HB2 LEU 61 HB2 LEU 61 -2.179 23.231 1.138
499 HB3 LEU 61 HB3 LEU 61 -1.312 24.765 1.175
500 HG LEU 61 HG LEU 61 -2.172 23.504 -1.412
501 HD11 LEU 61 HD11 LEU 61 -3.953 25.556 -0.843
502 HD12 LEU 61 HD12 LEU 61 -4.299 23.827 -0.861
503 HD13 LEU 61 HD13 LEU 61 -3.858 24.622 0.650
504 HD21 LEU 61 HD21 LEU 61 -0.697 25.208 -1.893
505 HD22 LEU 61 HD22 LEU 61 -2.242 26.060 -1.921
506 HD23 LEU 61 HD23 LEU 61 -1.196 26.177 -0.506
507 H ASP 62 H ASP 62 1.857 21.711 0.867
508 HA ASP 62 HA ASP 62 1.828 22.055 3.745
509 HB2 ASP 62 HB2 ASP 62 0.455 19.896 2.721
510 HB3 ASP 62 HB3 ASP 62 2.041 19.213 3.067
Start of MODEL 7
1 H1 MET 1 H MET 1 1.776 -0.504 -3.776
2 HA MET 1 HA MET 1 -0.739 0.825 -4.531
3 HB2 MET 1 HB2 MET 1 0.318 0.356 -1.739
4 HB3 MET 1 HB3 MET 1 -1.036 1.411 -2.121
5 HG2 MET 1 HG2 MET 1 -2.396 -0.375 -2.770
6 HG3 MET 1 HG3 MET 1 -1.028 -1.476 -2.914
7 HE1 MET 1 HE1 MET 1 -3.891 -1.742 -1.462
8 HE2 MET 1 HE2 MET 1 -3.827 -1.771 0.301
9 HE3 MET 1 HE3 MET 1 -3.881 -0.230 -0.555
10 H ASP 2 H ASP 2 1.727 1.613 -2.108
11 HA ASP 2 HA ASP 2 2.124 4.186 -3.472
12 HB2 ASP 2 HB2 ASP 2 3.277 4.620 -1.098
13 HB3 ASP 2 HB3 ASP 2 1.547 4.829 -1.357
14 H GLU 3 H GLU 3 4.203 2.446 -1.187
15 HA GLU 3 HA GLU 3 6.465 2.110 -1.212
16 HB2 GLU 3 HB2 GLU 3 5.256 0.512 -3.077
17 HB3 GLU 3 HB3 GLU 3 6.505 1.295 -4.035
18 HG2 GLU 3 HG2 GLU 3 7.826 0.550 -1.730
19 HG3 GLU 3 HG3 GLU 3 6.726 -0.793 -2.040
20 H THR 4 H THR 4 5.701 4.774 -1.878
21 HA THR 4 HA THR 4 7.715 5.528 -3.885
22 HB THR 4 HB THR 4 5.381 7.114 -2.799
23 HG1 THR 4 HG1 THR 4 5.842 5.591 -5.099
24 HG21 THR 4 HG21 THR 4 7.693 7.867 -4.536
25 HG22 THR 4 HG22 THR 4 6.119 8.608 -4.823
26 HG23 THR 4 HG23 THR 4 6.906 8.787 -3.254
27 H GLY 5 H GLY 5 6.341 7.314 -1.136
28 HA2 GLY 5 HA2 GLY 5 8.582 7.226 0.537
29 HA3 GLY 5 HA3 GLY 5 8.765 8.616 -0.522
30 H LYS 6 H LYS 6 7.332 10.360 -0.340
31 HA LYS 6 HA LYS 6 5.224 10.319 1.624
32 HB2 LYS 6 HB2 LYS 6 7.888 11.406 2.248
33 HB3 LYS 6 HB3 LYS 6 6.553 12.495 2.599
34 HG2 LYS 6 HG2 LYS 6 6.364 11.435 4.539
35 HG3 LYS 6 HG3 LYS 6 5.703 10.078 3.625
36 HD2 LYS 6 HD2 LYS 6 7.399 8.892 4.475
37 HD3 LYS 6 HD3 LYS 6 8.415 9.755 3.318
38 HE2 LYS 6 HE2 LYS 6 9.579 10.442 5.097
39 HE3 LYS 6 HE3 LYS 6 8.226 11.530 5.405
40 HZ1 LYS 6 HZ1 LYS 6 7.382 9.247 6.542
41 HZ2 LYS 6 HZ2 LYS 6 9.046 9.160 6.834
42 HZ3 LYS 6 HZ3 LYS 6 8.162 10.498 7.373
43 H GLU 7 H GLU 7 3.868 12.148 1.518
44 HA GLU 7 HA GLU 7 4.371 14.487 0.088
45 HB2 GLU 7 HB2 GLU 7 3.747 12.196 -1.574
46 HB3 GLU 7 HB3 GLU 7 2.549 13.467 -1.767
47 HG2 GLU 7 HG2 GLU 7 5.017 14.766 -1.817
48 HG3 GLU 7 HG3 GLU 7 5.230 13.308 -2.784
49 H LEU 8 H LEU 8 2.662 15.921 0.200
50 HA LEU 8 HA LEU 8 0.108 14.898 1.223
51 HB2 LEU 8 HB2 LEU 8 2.036 16.403 2.695
52 HB3 LEU 8 HB3 LEU 8 0.598 17.393 2.460
53 HG LEU 8 HG LEU 8 -0.773 15.801 3.594
54 HD11 LEU 8 HD11 LEU 8 0.051 13.724 2.831
55 HD12 LEU 8 HD12 LEU 8 1.655 14.030 3.496
56 HD13 LEU 8 HD13 LEU 8 0.294 13.735 4.578
57 HD21 LEU 8 HD21 LEU 8 -0.118 16.525 5.592
58 HD22 LEU 8 HD22 LEU 8 1.364 15.571 5.527
59 HD23 LEU 8 HD23 LEU 8 1.318 17.178 4.803
60 H VAL 9 H VAL 9 -1.702 16.235 0.816
61 HA VAL 9 HA VAL 9 -1.317 18.608 -0.827
62 HB VAL 9 HB VAL 9 -2.793 17.853 -2.605
63 HG11 VAL 9 HG11 VAL 9 -0.422 17.508 -2.929
64 HG12 VAL 9 HG12 VAL 9 -0.503 15.959 -2.091
65 HG13 VAL 9 HG13 VAL 9 -1.317 16.166 -3.642
66 HG21 VAL 9 HG21 VAL 9 -4.223 16.324 -1.468
67 HG22 VAL 9 HG22 VAL 9 -3.387 15.417 -2.729
68 HG23 VAL 9 HG23 VAL 9 -2.869 15.275 -1.049
69 H LEU 10 H LEU 10 -3.488 19.631 -1.349
70 HA LEU 10 HA LEU 10 -5.324 19.233 0.923
71 HB2 LEU 10 HB2 LEU 10 -4.266 21.691 -0.383
72 HB3 LEU 10 HB3 LEU 10 -5.894 21.728 0.292
73 HG LEU 10 HG LEU 10 -4.101 22.619 1.792
74 HD11 LEU 10 HD11 LEU 10 -5.359 20.201 3.030
75 HD12 LEU 10 HD12 LEU 10 -5.100 21.802 3.722
76 HD13 LEU 10 HD13 LEU 10 -6.342 21.563 2.493
77 HD21 LEU 10 HD21 LEU 10 -2.599 21.099 2.886
78 HD22 LEU 10 HD22 LEU 10 -3.294 19.724 2.028
79 HD23 LEU 10 HD23 LEU 10 -2.382 20.947 1.143
80 H ALA 11 H ALA 11 -7.518 19.247 0.545
81 HA ALA 11 HA ALA 11 -8.379 18.434 -2.037
82 HB1 ALA 11 HB1 ALA 11 -9.636 17.477 -0.363
83 HB2 ALA 11 HB2 ALA 11 -9.738 18.974 0.565
84 HB3 ALA 11 HB3 ALA 11 -10.703 18.775 -0.898
85 H LEU 12 H LEU 12 -8.431 19.829 -3.685
86 HA LEU 12 HA LEU 12 -8.978 22.627 -3.309
87 HB2 LEU 12 HB2 LEU 12 -7.408 21.590 -5.023
88 HB3 LEU 12 HB3 LEU 12 -8.857 21.166 -5.932
89 HG LEU 12 HG LEU 12 -9.421 23.551 -6.120
90 HD11 LEU 12 HD11 LEU 12 -7.027 24.833 -5.522
91 HD12 LEU 12 HD12 LEU 12 -8.551 24.962 -4.643
92 HD13 LEU 12 HD13 LEU 12 -7.338 23.786 -4.137
93 HD21 LEU 12 HD21 LEU 12 -8.122 22.460 -7.879
94 HD22 LEU 12 HD22 LEU 12 -7.657 24.151 -7.695
95 HD23 LEU 12 HD23 LEU 12 -6.628 22.878 -7.041
96 H TYR 13 H TYR 13 -10.773 19.797 -4.215
97 HA TYR 13 HA TYR 13 -13.204 21.425 -4.347
98 HB2 TYR 13 HB2 TYR 13 -12.720 21.114 -6.659
99 HB3 TYR 13 HB3 TYR 13 -12.311 19.419 -6.417
100 HD1 TYR 13 HD1 TYR 13 -13.830 18.068 -7.503
101 HD2 TYR 13 HD2 TYR 13 -15.259 21.509 -5.448
102 HE1 TYR 13 HE1 TYR 13 -16.141 17.430 -8.053
103 HE2 TYR 13 HE2 TYR 13 -17.574 20.880 -5.991
104 HH TYR 13 HH TYR 13 -18.403 17.818 -7.233
105 H ASP 14 H ASP 14 -14.889 20.560 -3.287
106 HA ASP 14 HA ASP 14 -14.532 18.353 -1.584
107 HB2 ASP 14 HB2 ASP 14 -16.302 20.395 -1.670
108 HB3 ASP 14 HB3 ASP 14 -17.311 19.091 -2.290
109 H TYR 15 H TYR 15 -13.997 16.478 -2.625
110 HA TYR 15 HA TYR 15 -15.796 15.477 -4.708
111 HB2 TYR 15 HB2 TYR 15 -13.051 15.427 -4.502
112 HB3 TYR 15 HB3 TYR 15 -13.499 13.802 -3.996
113 HD1 TYR 15 HD1 TYR 15 -14.833 12.360 -5.550
114 HD2 TYR 15 HD2 TYR 15 -13.167 16.077 -6.778
115 HE1 TYR 15 HE1 TYR 15 -15.098 11.695 -7.903
116 HE2 TYR 15 HE2 TYR 15 -13.429 15.423 -9.134
117 HH TYR 15 HH TYR 15 -14.720 12.237 -10.024
118 H GLN 16 H GLN 16 -17.225 13.908 -4.340
119 HA GLN 16 HA GLN 16 -17.277 12.679 -1.687
120 HB2 GLN 16 HB2 GLN 16 -19.309 13.206 -3.802
121 HB3 GLN 16 HB3 GLN 16 -19.574 11.842 -2.725
122 HG2 GLN 16 HG2 GLN 16 -20.631 14.051 -2.078
123 HG3 GLN 16 HG3 GLN 16 -19.706 13.209 -0.835
124 HE21 GLN 16 HE21 GLN 16 -20.119 16.084 -2.549
125 HE22 GLN 16 HE22 GLN 16 -18.722 16.921 -1.973
126 H GLU 17 H GLU 17 -16.625 11.940 -4.981
127 HA GLU 17 HA GLU 17 -15.921 10.044 -6.023
128 HB2 GLU 17 HB2 GLU 17 -15.719 8.827 -3.267
129 HB3 GLU 17 HB3 GLU 17 -14.882 8.306 -4.722
130 HG2 GLU 17 HG2 GLU 17 -14.471 10.944 -3.334
131 HG3 GLU 17 HG3 GLU 17 -13.425 9.534 -3.180
132 H LYS 18 H LYS 18 -16.341 7.342 -5.429
133 HA LYS 18 HA LYS 18 -18.981 6.714 -4.689
134 HB2 LYS 18 HB2 LYS 18 -18.635 7.697 -7.397
135 HB3 LYS 18 HB3 LYS 18 -19.260 6.053 -7.389
136 HG2 LYS 18 HG2 LYS 18 -21.281 6.756 -6.821
137 HG3 LYS 18 HG3 LYS 18 -20.641 7.659 -5.446
138 HD2 LYS 18 HD2 LYS 18 -21.512 9.385 -6.663
139 HD3 LYS 18 HD3 LYS 18 -19.891 9.330 -7.358
140 HE2 LYS 18 HE2 LYS 18 -21.755 7.519 -8.671
141 HE3 LYS 18 HE3 LYS 18 -22.266 9.204 -8.752
142 HZ1 LYS 18 HZ1 LYS 18 -20.093 7.887 -10.090
143 HZ2 LYS 18 HZ2 LYS 18 -20.881 9.334 -10.475
144 HZ3 LYS 18 HZ3 LYS 18 -19.626 9.330 -9.340
145 H SER 19 H SER 19 -16.171 5.918 -6.641
146 HA SER 19 HA SER 19 -16.716 3.067 -6.457
147 HB2 SER 19 HB2 SER 19 -15.133 4.768 -8.168
148 HB3 SER 19 HB3 SER 19 -14.137 3.467 -7.517
149 HG SER 19 HG SER 19 -15.650 3.234 -9.539
150 HA PRO 20 HA PRO 20 -14.186 2.182 -2.985
151 HB2 PRO 20 HB2 PRO 20 -13.024 -0.163 -3.707
152 HB3 PRO 20 HB3 PRO 20 -14.733 -0.030 -3.278
153 HG2 PRO 20 HG2 PRO 20 -13.462 -0.123 -5.986
154 HG3 PRO 20 HG3 PRO 20 -14.920 -0.949 -5.406
155 HD2 PRO 20 HD2 PRO 20 -15.021 1.306 -6.901
156 HD3 PRO 20 HD3 PRO 20 -16.237 0.924 -5.666
157 H ARG 21 H ARG 21 -12.689 2.365 -6.126
158 HA ARG 21 HA ARG 21 -10.006 2.468 -4.997
159 HB2 ARG 21 HB2 ARG 21 -9.221 2.498 -7.276
160 HB3 ARG 21 HB3 ARG 21 -10.445 1.246 -7.118
161 HG2 ARG 21 HG2 ARG 21 -11.482 3.857 -7.948
162 HG3 ARG 21 HG3 ARG 21 -10.368 3.104 -9.091
163 HD2 ARG 21 HD2 ARG 21 -12.920 1.953 -7.980
164 HD3 ARG 21 HD3 ARG 21 -12.585 2.408 -9.650
165 HE ARG 21 HE ARG 21 -10.708 0.528 -9.124
166 HH11 ARG 21 HH11 ARG 21 -14.172 0.625 -8.792
167 HH12 ARG 21 HH12 ARG 21 -14.376 -1.075 -9.057
168 HH21 ARG 21 HH21 ARG 21 -10.963 -1.711 -9.475
169 HH22 ARG 21 HH22 ARG 21 -12.550 -2.403 -9.445
170 H GLU 22 H GLU 22 -12.238 4.569 -4.709
171 HA GLU 22 HA GLU 22 -10.690 6.877 -5.684
172 HB2 GLU 22 HB2 GLU 22 -13.630 6.465 -5.246
173 HB3 GLU 22 HB3 GLU 22 -12.949 8.085 -5.222
174 HG2 GLU 22 HG2 GLU 22 -12.049 7.709 -7.484
175 HG3 GLU 22 HG3 GLU 22 -12.826 6.127 -7.503
176 H VAL 23 H VAL 23 -10.752 8.813 -4.294
177 HA VAL 23 HA VAL 23 -10.888 8.105 -1.435
178 HB VAL 23 HB VAL 23 -8.795 9.670 -2.915
179 HG11 VAL 23 HG11 VAL 23 -8.061 9.986 -0.330
180 HG12 VAL 23 HG12 VAL 23 -8.916 11.206 -1.274
181 HG13 VAL 23 HG13 VAL 23 -9.813 10.136 -0.196
182 HG21 VAL 23 HG21 VAL 23 -7.477 7.938 -2.438
183 HG22 VAL 23 HG22 VAL 23 -7.946 7.965 -0.738
184 HG23 VAL 23 HG23 VAL 23 -8.925 7.082 -1.909
185 H THR 24 H THR 24 -12.548 9.147 -0.560
186 HA THR 24 HA THR 24 -13.662 11.529 -1.671
187 HB THR 24 HB THR 24 -14.203 10.250 1.016
188 HG1 THR 24 HG1 THR 24 -15.257 8.828 -0.128
189 HG21 THR 24 HG21 THR 24 -14.998 12.745 0.041
190 HG22 THR 24 HG22 THR 24 -16.395 11.693 -0.189
191 HG23 THR 24 HG23 THR 24 -15.681 11.874 1.414
192 H MET 25 H MET 25 -13.084 13.567 -1.320
193 HA MET 25 HA MET 25 -11.663 14.228 1.168
194 HB2 MET 25 HB2 MET 25 -10.085 15.590 0.017
195 HB3 MET 25 HB3 MET 25 -10.109 14.037 -0.808
196 HG2 MET 25 HG2 MET 25 -12.014 15.879 -1.957
197 HG3 MET 25 HG3 MET 25 -10.381 16.541 -1.955
198 HE1 MET 25 HE1 MET 25 -9.832 16.396 -4.755
199 HE2 MET 25 HE2 MET 25 -8.722 16.138 -3.409
200 HE3 MET 25 HE3 MET 25 -8.706 15.039 -4.789
201 H LYS 26 H LYS 26 -11.931 16.375 1.919
202 HA LYS 26 HA LYS 26 -14.299 17.721 0.796
203 HB2 LYS 26 HB2 LYS 26 -13.286 17.465 3.617
204 HB3 LYS 26 HB3 LYS 26 -14.403 18.746 3.163
205 HG2 LYS 26 HG2 LYS 26 -15.471 16.346 2.149
206 HG3 LYS 26 HG3 LYS 26 -14.950 16.020 3.804
207 HD2 LYS 26 HD2 LYS 26 -16.429 17.522 4.709
208 HD3 LYS 26 HD3 LYS 26 -16.465 18.525 3.258
209 HE2 LYS 26 HE2 LYS 26 -18.162 17.363 2.354
210 HE3 LYS 26 HE3 LYS 26 -17.506 15.813 2.878
211 HZ1 LYS 26 HZ1 LYS 26 -19.713 16.806 3.887
212 HZ2 LYS 26 HZ2 LYS 26 -18.648 15.879 4.819
213 HZ3 LYS 26 HZ3 LYS 26 -18.620 17.567 4.931
214 H LYS 27 H LYS 27 -14.078 19.723 0.032
215 HA LYS 27 HA LYS 27 -11.739 20.967 -0.542
216 HB2 LYS 27 HB2 LYS 27 -14.075 21.631 -1.271
217 HB3 LYS 27 HB3 LYS 27 -14.211 22.510 0.246
218 HG2 LYS 27 HG2 LYS 27 -12.267 23.872 -0.390
219 HG3 LYS 27 HG3 LYS 27 -12.191 23.014 -1.930
220 HD2 LYS 27 HD2 LYS 27 -14.680 24.435 -1.033
221 HD3 LYS 27 HD3 LYS 27 -13.386 25.279 -1.886
222 HE2 LYS 27 HE2 LYS 27 -14.218 22.756 -3.127
223 HE3 LYS 27 HE3 LYS 27 -15.476 23.991 -3.077
224 HZ1 LYS 27 HZ1 LYS 27 -12.984 23.941 -4.575
225 HZ2 LYS 27 HZ2 LYS 27 -14.477 24.631 -4.976
226 HZ3 LYS 27 HZ3 LYS 27 -13.426 25.439 -3.924
227 H GLY 28 H GLY 28 -10.111 21.240 0.871
228 HA2 GLY 28 HA2 GLY 28 -9.128 22.836 2.400
229 HA3 GLY 28 HA3 GLY 28 -10.669 22.902 3.242
230 H ASP 29 H ASP 29 -9.220 19.902 2.179
231 HA ASP 29 HA ASP 29 -8.560 19.271 4.980
232 HB2 ASP 29 HB2 ASP 29 -9.779 17.365 4.964
233 HB3 ASP 29 HB3 ASP 29 -10.661 18.159 3.662
234 H ILE 30 H ILE 30 -6.999 17.474 5.207
235 HA ILE 30 HA ILE 30 -5.027 17.555 3.021
236 HB ILE 30 HB ILE 30 -4.765 17.862 5.886
237 HG12 ILE 30 HG12 ILE 30 -3.843 19.231 3.889
238 HG13 ILE 30 HG13 ILE 30 -2.815 19.015 5.302
239 HG21 ILE 30 HG21 ILE 30 -4.192 15.529 5.935
240 HG22 ILE 30 HG22 ILE 30 -3.088 15.729 4.574
241 HG23 ILE 30 HG23 ILE 30 -2.718 16.478 6.127
242 HD11 ILE 30 HD11 ILE 30 -1.857 18.689 2.907
243 HD12 ILE 30 HD12 ILE 30 -1.385 17.597 4.209
244 HD13 ILE 30 HD13 ILE 30 -2.603 17.096 3.036
245 H LEU 31 H LEU 31 -4.120 15.682 2.257
246 HA LEU 31 HA LEU 31 -5.097 13.151 3.392
247 HB2 LEU 31 HB2 LEU 31 -4.834 12.606 0.718
248 HB3 LEU 31 HB3 LEU 31 -6.349 12.887 1.573
249 HG LEU 31 HG LEU 31 -4.873 15.201 0.391
250 HD11 LEU 31 HD11 LEU 31 -5.216 13.201 -1.258
251 HD12 LEU 31 HD12 LEU 31 -6.895 13.741 -1.241
252 HD13 LEU 31 HD13 LEU 31 -5.619 14.846 -1.750
253 HD21 LEU 31 HD21 LEU 31 -7.712 15.190 0.067
254 HD22 LEU 31 HD22 LEU 31 -7.314 14.800 1.740
255 HD23 LEU 31 HD23 LEU 31 -6.705 16.286 1.012
256 H THR 32 H THR 32 -3.785 11.272 2.785
257 HA THR 32 HA THR 32 -0.953 12.012 2.646
258 HB THR 32 HB THR 32 -2.000 9.261 3.279
259 HG1 THR 32 HG1 THR 32 -1.838 11.549 4.937
260 HG21 THR 32 HG21 THR 32 0.101 8.872 4.222
261 HG22 THR 32 HG22 THR 32 0.472 9.820 2.782
262 HG23 THR 32 HG23 THR 32 0.459 10.592 4.368
263 H LEU 33 H LEU 33 -0.122 12.003 0.662
264 HA LEU 33 HA LEU 33 -1.213 10.652 -1.549
265 HB2 LEU 33 HB2 LEU 33 1.287 12.129 -0.970
266 HB3 LEU 33 HB3 LEU 33 1.302 11.053 -2.366
267 HG LEU 33 HG LEU 33 0.776 13.476 -2.830
268 HD11 LEU 33 HD11 LEU 33 -1.507 11.736 -3.665
269 HD12 LEU 33 HD12 LEU 33 -0.615 12.939 -4.597
270 HD13 LEU 33 HD13 LEU 33 0.131 11.387 -4.216
271 HD21 LEU 33 HD21 LEU 33 -1.776 12.719 -1.413
272 HD22 LEU 33 HD22 LEU 33 -0.631 13.977 -0.947
273 HD23 LEU 33 HD23 LEU 33 -1.578 14.151 -2.424
274 H LEU 34 H LEU 34 -0.571 8.799 -2.647
275 HA LEU 34 HA LEU 34 1.168 6.970 -1.126
276 HB2 LEU 34 HB2 LEU 34 -1.368 6.423 -2.642
277 HB3 LEU 34 HB3 LEU 34 -0.233 5.146 -2.210
278 HG LEU 34 HG LEU 34 -1.778 6.900 -0.302
279 HD11 LEU 34 HD11 LEU 34 -2.083 4.100 -1.288
280 HD12 LEU 34 HD12 LEU 34 -2.593 4.514 0.349
281 HD13 LEU 34 HD13 LEU 34 -3.307 5.343 -1.035
282 HD21 LEU 34 HD21 LEU 34 0.288 4.763 0.191
283 HD22 LEU 34 HD22 LEU 34 0.353 6.457 0.677
284 HD23 LEU 34 HD23 LEU 34 -0.816 5.369 1.425
285 H ASN 35 H ASN 35 -0.237 7.330 -4.389
286 HA ASN 35 HA ASN 35 2.172 6.175 -5.547
287 HB2 ASN 35 HB2 ASN 35 0.011 5.405 -6.393
288 HB3 ASN 35 HB3 ASN 35 -0.423 7.054 -6.834
289 HD21 ASN 35 HD21 ASN 35 2.650 5.362 -7.231
290 HD22 ASN 35 HD22 ASN 35 2.690 5.472 -8.955
291 H SER 36 H SER 36 0.162 8.954 -6.515
292 HA SER 36 HA SER 36 0.701 11.066 -7.176
293 HB2 SER 36 HB2 SER 36 2.750 10.385 -5.253
294 HB3 SER 36 HB3 SER 36 3.411 11.414 -6.522
295 HG SER 36 HG SER 36 1.566 12.815 -6.112
296 H THR 37 H THR 37 1.474 8.494 -8.658
297 HA THR 37 HA THR 37 3.542 9.563 -10.439
298 HB THR 37 HB THR 37 2.323 6.795 -10.366
299 HG1 THR 37 HG1 THR 37 4.973 7.448 -9.631
300 HG21 THR 37 HG21 THR 37 3.120 6.899 -12.512
301 HG22 THR 37 HG22 THR 37 4.336 8.114 -12.118
302 HG23 THR 37 HG23 THR 37 4.598 6.428 -11.673
303 H ASN 38 H ASN 38 0.173 8.597 -10.361
304 HA ASN 38 HA ASN 38 -0.116 9.156 -13.217
305 HB2 ASN 38 HB2 ASN 38 -1.198 7.134 -12.541
306 HB3 ASN 38 HB3 ASN 38 -1.978 7.933 -11.179
307 HD21 ASN 38 HD21 ASN 38 -1.661 8.892 -14.570
308 HD22 ASN 38 HD22 ASN 38 -3.358 8.995 -14.880
309 H LYS 39 H LYS 39 -0.126 11.330 -13.482
310 HA LYS 39 HA LYS 39 -1.047 13.297 -11.817
311 HB2 LYS 39 HB2 LYS 39 0.150 13.882 -13.805
312 HB3 LYS 39 HB3 LYS 39 -1.086 13.169 -14.832
313 HG2 LYS 39 HG2 LYS 39 -2.665 14.895 -14.147
314 HG3 LYS 39 HG3 LYS 39 -1.437 15.606 -13.098
315 HD2 LYS 39 HD2 LYS 39 -0.208 15.380 -15.589
316 HD3 LYS 39 HD3 LYS 39 -1.848 15.931 -15.942
317 HE2 LYS 39 HE2 LYS 39 -1.443 17.647 -14.068
318 HE3 LYS 39 HE3 LYS 39 0.262 17.241 -14.258
319 HZ1 LYS 39 HZ1 LYS 39 -0.468 19.182 -15.584
320 HZ2 LYS 39 HZ2 LYS 39 0.197 17.942 -16.522
321 HZ3 LYS 39 HZ3 LYS 39 -1.480 18.162 -16.478
322 H ASP 40 H ASP 40 -2.933 11.646 -14.346
323 HA ASP 40 HA ASP 40 -5.341 12.933 -14.080
324 HB2 ASP 40 HB2 ASP 40 -5.152 9.942 -14.416
325 HB3 ASP 40 HB3 ASP 40 -6.368 11.034 -15.071
326 H TRP 41 H TRP 41 -4.149 10.198 -12.159
327 HA TRP 41 HA TRP 41 -5.986 10.976 -10.020
328 HB2 TRP 41 HB2 TRP 41 -5.869 8.266 -11.326
329 HB3 TRP 41 HB3 TRP 41 -6.425 8.460 -9.666
330 HD1 TRP 41 HD1 TRP 41 -7.464 9.129 -13.271
331 HE1 TRP 41 HE1 TRP 41 -9.952 9.786 -13.311
332 HE3 TRP 41 HE3 TRP 41 -8.267 9.579 -8.242
333 HZ2 TRP 41 HZ2 TRP 41 -11.986 10.413 -11.457
334 HZ3 TRP 41 HZ3 TRP 41 -10.511 10.211 -7.458
335 HH2 TRP 41 HH2 TRP 41 -12.331 10.620 -9.033
336 H TRP 42 H TRP 42 -4.801 11.270 -8.263
337 HA TRP 42 HA TRP 42 -2.273 9.817 -7.980
338 HB2 TRP 42 HB2 TRP 42 -3.361 12.336 -6.744
339 HB3 TRP 42 HB3 TRP 42 -1.967 11.509 -6.054
340 HD1 TRP 42 HD1 TRP 42 -0.842 10.730 -9.103
341 HE1 TRP 42 HE1 TRP 42 0.419 12.586 -10.364
342 HE3 TRP 42 HE3 TRP 42 -2.563 14.787 -6.511
343 HZ2 TRP 42 HZ2 TRP 42 0.653 15.398 -10.272
344 HZ3 TRP 42 HZ3 TRP 42 -1.771 17.024 -7.161
345 HH2 TRP 42 HH2 TRP 42 -0.196 17.321 -9.002
346 H LYS 43 H LYS 43 -2.536 7.915 -6.989
347 HA LYS 43 HA LYS 43 -4.591 7.210 -5.243
348 HB2 LYS 43 HB2 LYS 43 -3.287 5.504 -6.318
349 HB3 LYS 43 HB3 LYS 43 -1.807 6.084 -5.565
350 HG2 LYS 43 HG2 LYS 43 -3.019 5.536 -3.341
351 HG3 LYS 43 HG3 LYS 43 -4.061 4.540 -4.360
352 HD2 LYS 43 HD2 LYS 43 -1.129 4.260 -4.716
353 HD3 LYS 43 HD3 LYS 43 -1.833 3.601 -3.238
354 HE2 LYS 43 HE2 LYS 43 -2.466 1.805 -4.380
355 HE3 LYS 43 HE3 LYS 43 -3.523 2.827 -5.353
356 HZ1 LYS 43 HZ1 LYS 43 -0.729 2.861 -6.116
357 HZ2 LYS 43 HZ2 LYS 43 -1.513 1.380 -6.349
358 HZ3 LYS 43 HZ3 LYS 43 -2.115 2.781 -7.082
359 H VAL 44 H VAL 44 -4.934 7.454 -3.114
360 HA VAL 44 HA VAL 44 -2.735 8.280 -1.376
361 HB VAL 44 HB VAL 44 -3.935 10.138 -0.427
362 HG11 VAL 44 HG11 VAL 44 -3.450 11.647 -2.058
363 HG12 VAL 44 HG12 VAL 44 -2.687 10.227 -2.773
364 HG13 VAL 44 HG13 VAL 44 -4.289 10.731 -3.310
365 HG21 VAL 44 HG21 VAL 44 -6.201 9.346 -0.608
366 HG22 VAL 44 HG22 VAL 44 -6.078 10.910 -1.415
367 HG23 VAL 44 HG23 VAL 44 -6.130 9.427 -2.368
368 H GLU 45 H GLU 45 -3.593 8.450 0.969
369 HA GLU 45 HA GLU 45 -5.567 6.311 1.428
370 HB2 GLU 45 HB2 GLU 45 -3.436 5.367 1.940
371 HB3 GLU 45 HB3 GLU 45 -2.941 6.801 2.829
372 HG2 GLU 45 HG2 GLU 45 -4.573 6.322 4.558
373 HG3 GLU 45 HG3 GLU 45 -5.139 4.918 3.656
374 H VAL 46 H VAL 46 -7.252 6.913 2.608
375 HA VAL 46 HA VAL 46 -6.927 8.994 4.643
376 HB VAL 46 HB VAL 46 -9.169 9.954 3.885
377 HG11 VAL 46 HG11 VAL 46 -7.092 10.467 1.809
378 HG12 VAL 46 HG12 VAL 46 -8.099 11.606 2.703
379 HG13 VAL 46 HG13 VAL 46 -6.727 10.831 3.496
380 HG21 VAL 46 HG21 VAL 46 -9.548 7.979 2.309
381 HG22 VAL 46 HG22 VAL 46 -9.924 9.588 1.694
382 HG23 VAL 46 HG23 VAL 46 -8.425 8.791 1.217
383 H ASN 47 H ASN 47 -7.959 8.527 6.483
384 HA ASN 47 HA ASN 47 -9.010 7.164 8.007
385 HB2 ASN 47 HB2 ASN 47 -11.540 6.929 7.312
386 HB3 ASN 47 HB3 ASN 47 -10.871 8.504 7.727
387 HD21 ASN 47 HD21 ASN 47 -11.961 6.437 5.151
388 HD22 ASN 47 HD22 ASN 47 -12.101 7.672 3.950
389 H ASP 48 H ASP 48 -7.564 5.379 7.101
390 HA ASP 48 HA ASP 48 -7.246 3.262 6.268
391 HB2 ASP 48 HB2 ASP 48 -8.892 3.240 8.437
392 HB3 ASP 48 HB3 ASP 48 -9.873 2.366 7.264
393 H ARG 49 H ARG 49 -8.455 5.005 4.358
394 HA ARG 49 HA ARG 49 -9.735 2.993 2.677
395 HB2 ARG 49 HB2 ARG 49 -11.112 5.255 3.845
396 HB3 ARG 49 HB3 ARG 49 -11.134 5.345 2.089
397 HG2 ARG 49 HG2 ARG 49 -11.938 2.873 3.592
398 HG3 ARG 49 HG3 ARG 49 -13.074 4.160 3.184
399 HD2 ARG 49 HD2 ARG 49 -11.657 3.582 0.828
400 HD3 ARG 49 HD3 ARG 49 -12.074 2.026 1.545
401 HE ARG 49 HE ARG 49 -14.291 2.444 1.104
402 HH11 ARG 49 HH11 ARG 49 -12.434 5.353 0.643
403 HH12 ARG 49 HH12 ARG 49 -13.738 6.224 -0.094
404 HH21 ARG 49 HH21 ARG 49 -16.015 3.580 0.136
405 HH22 ARG 49 HH22 ARG 49 -15.775 5.215 -0.381
406 H GLN 50 H GLN 50 -7.710 3.029 1.584
407 HA GLN 50 HA GLN 50 -6.928 5.507 0.270
408 HB2 GLN 50 HB2 GLN 50 -4.921 4.370 -0.366
409 HB3 GLN 50 HB3 GLN 50 -5.239 3.984 1.320
410 HG2 GLN 50 HG2 GLN 50 -4.827 1.887 0.666
411 HG3 GLN 50 HG3 GLN 50 -6.496 1.932 0.103
412 HE21 GLN 50 HE21 GLN 50 -3.169 2.521 -0.918
413 HE22 GLN 50 HE22 GLN 50 -3.410 2.084 -2.572
414 H GLY 51 H GLY 51 -6.846 5.794 -1.961
415 HA2 GLY 51 HA2 GLY 51 -7.704 3.722 -3.766
416 HA3 GLY 51 HA3 GLY 51 -8.927 4.957 -3.506
417 H PHE 52 H PHE 52 -8.894 6.651 -4.822
418 HA PHE 52 HA PHE 52 -6.356 7.526 -5.981
419 HB2 PHE 52 HB2 PHE 52 -8.795 6.690 -7.545
420 HB3 PHE 52 HB3 PHE 52 -7.567 7.757 -8.221
421 HD1 PHE 52 HD1 PHE 52 -8.637 4.562 -8.359
422 HD2 PHE 52 HD2 PHE 52 -5.060 6.722 -7.546
423 HE1 PHE 52 HE1 PHE 52 -7.306 2.601 -9.020
424 HE2 PHE 52 HE2 PHE 52 -3.724 4.765 -8.207
425 HZ PHE 52 HZ PHE 52 -4.847 2.701 -8.945
426 H VAL 53 H VAL 53 -6.154 9.661 -5.866
427 HA VAL 53 HA VAL 53 -8.585 11.270 -5.449
428 HB VAL 53 HB VAL 53 -6.359 11.125 -3.847
429 HG11 VAL 53 HG11 VAL 53 -5.059 12.312 -5.602
430 HG12 VAL 53 HG12 VAL 53 -6.139 13.693 -5.412
431 HG13 VAL 53 HG13 VAL 53 -5.125 13.174 -4.065
432 HG21 VAL 53 HG21 VAL 53 -7.634 12.407 -2.530
433 HG22 VAL 53 HG22 VAL 53 -7.683 13.718 -3.707
434 HG23 VAL 53 HG23 VAL 53 -8.811 12.369 -3.843
435 HA PRO 54 HA PRO 54 -7.833 13.227 -9.333
436 HB2 PRO 54 HB2 PRO 54 -9.393 15.418 -8.961
437 HB3 PRO 54 HB3 PRO 54 -10.055 13.812 -9.287
438 HG2 PRO 54 HG2 PRO 54 -9.758 15.244 -6.675
439 HG3 PRO 54 HG3 PRO 54 -11.127 14.293 -7.280
440 HD2 PRO 54 HD2 PRO 54 -9.327 13.299 -5.517
441 HD3 PRO 54 HD3 PRO 54 -10.136 12.285 -6.729
442 H ALA 55 H ALA 55 -5.960 14.191 -9.786
443 HA ALA 55 HA ALA 55 -4.522 15.846 -8.029
444 HB1 ALA 55 HB1 ALA 55 -3.522 14.541 -9.882
445 HB2 ALA 55 HB2 ALA 55 -4.222 15.688 -11.025
446 HB3 ALA 55 HB3 ALA 55 -3.011 16.229 -9.863
447 H ALA 56 H ALA 56 -6.218 16.723 -11.047
448 HA ALA 56 HA ALA 56 -5.887 19.442 -10.997
449 HB1 ALA 56 HB1 ALA 56 -6.954 18.249 -12.840
450 HB2 ALA 56 HB2 ALA 56 -8.378 17.965 -11.840
451 HB3 ALA 56 HB3 ALA 56 -7.941 19.609 -12.305
452 H TYR 57 H TYR 57 -8.101 17.503 -9.089
453 HA TYR 57 HA TYR 57 -9.304 19.898 -7.925
454 HB2 TYR 57 HB2 TYR 57 -9.956 16.960 -7.675
455 HB3 TYR 57 HB3 TYR 57 -10.757 18.206 -6.724
456 HD1 TYR 57 HD1 TYR 57 -11.149 16.210 -9.490
457 HD2 TYR 57 HD2 TYR 57 -11.549 20.284 -8.330
458 HE1 TYR 57 HE1 TYR 57 -12.752 16.567 -11.320
459 HE2 TYR 57 HE2 TYR 57 -13.155 20.652 -10.157
460 HH TYR 57 HH TYR 57 -14.842 18.792 -11.527
461 H VAL 58 H VAL 58 -6.589 19.532 -7.356
462 HA VAL 58 HA VAL 58 -6.717 19.324 -4.454
463 HB VAL 58 HB VAL 58 -5.863 17.121 -5.774
464 HG11 VAL 58 HG11 VAL 58 -3.528 17.009 -5.952
465 HG12 VAL 58 HG12 VAL 58 -3.954 18.562 -6.673
466 HG13 VAL 58 HG13 VAL 58 -3.299 18.499 -5.036
467 HG21 VAL 58 HG21 VAL 58 -4.660 18.066 -3.177
468 HG22 VAL 58 HG22 VAL 58 -6.303 17.445 -3.335
469 HG23 VAL 58 HG23 VAL 58 -4.927 16.401 -3.693
470 H LYS 59 H LYS 59 -4.541 19.979 -3.481
471 HA LYS 59 HA LYS 59 -2.880 21.672 -5.127
472 HB2 LYS 59 HB2 LYS 59 -5.062 22.767 -3.536
473 HB3 LYS 59 HB3 LYS 59 -3.504 23.447 -3.087
474 HG2 LYS 59 HG2 LYS 59 -4.523 23.343 -5.915
475 HG3 LYS 59 HG3 LYS 59 -4.753 24.720 -4.834
476 HD2 LYS 59 HD2 LYS 59 -2.146 24.510 -4.547
477 HD3 LYS 59 HD3 LYS 59 -2.260 23.693 -6.107
478 HE2 LYS 59 HE2 LYS 59 -2.350 25.671 -7.111
479 HE3 LYS 59 HE3 LYS 59 -3.859 26.013 -6.267
480 HZ1 LYS 59 HZ1 LYS 59 -2.802 27.239 -4.676
481 HZ2 LYS 59 HZ2 LYS 59 -1.327 26.427 -4.846
482 HZ3 LYS 59 HZ3 LYS 59 -1.802 27.570 -6.000
483 H LYS 60 H LYS 60 -0.910 21.143 -4.476
484 HA LYS 60 HA LYS 60 -0.325 19.924 -2.000
485 HB2 LYS 60 HB2 LYS 60 0.980 19.992 -4.303
486 HB3 LYS 60 HB3 LYS 60 1.806 21.342 -3.538
487 HG2 LYS 60 HG2 LYS 60 1.610 18.555 -2.414
488 HG3 LYS 60 HG3 LYS 60 3.010 19.233 -3.248
489 HD2 LYS 60 HD2 LYS 60 2.614 21.123 -1.366
490 HD3 LYS 60 HD3 LYS 60 2.019 19.700 -0.507
491 HE2 LYS 60 HE2 LYS 60 4.117 19.127 -0.062
492 HE3 LYS 60 HE3 LYS 60 4.413 18.942 -1.790
493 HZ1 LYS 60 HZ1 LYS 60 4.681 21.530 -1.639
494 HZ2 LYS 60 HZ2 LYS 60 5.054 21.188 -0.024
495 HZ3 LYS 60 HZ3 LYS 60 5.970 20.498 -1.268
496 H LEU 61 H LEU 61 -1.056 21.215 -0.315
497 HA LEU 61 HA LEU 61 0.467 23.702 0.106
498 HB2 LEU 61 HB2 LEU 61 -2.261 23.120 1.232
499 HB3 LEU 61 HB3 LEU 61 -1.390 24.652 1.250
500 HG LEU 61 HG LEU 61 -2.209 23.408 -1.348
501 HD11 LEU 61 HD11 LEU 61 -4.364 23.612 -0.866
502 HD12 LEU 61 HD12 LEU 61 -3.996 24.290 0.720
503 HD13 LEU 61 HD13 LEU 61 -4.113 25.349 -0.686
504 HD21 LEU 61 HD21 LEU 61 -1.703 25.416 -2.243
505 HD22 LEU 61 HD22 LEU 61 -2.297 26.311 -0.844
506 HD23 LEU 61 HD23 LEU 61 -0.699 25.568 -0.801
507 H ASP 62 H ASP 62 1.792 21.623 0.931
508 HA ASP 62 HA ASP 62 2.712 20.518 2.699
509 HB2 ASP 62 HB2 ASP 62 1.915 23.180 3.711
510 HB3 ASP 62 HB3 ASP 62 2.268 21.971 4.942
Start of MODEL 8
1 H1 MET 1 H MET 1 0.018 4.464 3.212
2 HA MET 1 HA MET 1 2.308 3.026 3.261
3 HB2 MET 1 HB2 MET 1 0.762 1.981 0.901
4 HB3 MET 1 HB3 MET 1 2.280 1.389 1.563
5 HG2 MET 1 HG2 MET 1 1.007 0.721 3.618
6 HG3 MET 1 HG3 MET 1 -0.470 1.105 2.736
7 HE1 MET 1 HE1 MET 1 -1.461 -0.786 0.665
8 HE2 MET 1 HE2 MET 1 -0.318 0.440 0.116
9 HE3 MET 1 HE3 MET 1 -0.097 -1.246 -0.354
10 H ASP 2 H ASP 2 3.290 2.982 0.723
11 HA ASP 2 HA ASP 2 2.521 5.233 -0.838
12 HB2 ASP 2 HB2 ASP 2 4.944 6.277 -0.355
13 HB3 ASP 2 HB3 ASP 2 3.504 6.767 0.534
14 H GLU 3 H GLU 3 5.783 4.051 -0.080
15 HA GLU 3 HA GLU 3 7.400 3.158 -1.418
16 HB2 GLU 3 HB2 GLU 3 5.140 1.466 -1.450
17 HB3 GLU 3 HB3 GLU 3 5.754 1.503 -3.097
18 HG2 GLU 3 HG2 GLU 3 7.995 0.915 -2.223
19 HG3 GLU 3 HG3 GLU 3 7.284 0.753 -0.618
20 H THR 4 H THR 4 6.025 5.573 -2.380
21 HA THR 4 HA THR 4 7.130 5.610 -5.025
22 HB THR 4 HB THR 4 4.199 6.261 -4.925
23 HG1 THR 4 HG1 THR 4 3.840 4.134 -5.758
24 HG21 THR 4 HG21 THR 4 4.313 6.285 -7.237
25 HG22 THR 4 HG22 THR 4 5.900 6.916 -6.796
26 HG23 THR 4 HG23 THR 4 5.726 5.230 -7.282
27 H GLY 5 H GLY 5 7.451 7.031 -2.513
28 HA2 GLY 5 HA2 GLY 5 8.146 9.240 -2.157
29 HA3 GLY 5 HA3 GLY 5 7.238 9.732 -3.579
30 H LYS 6 H LYS 6 7.212 9.366 -0.165
31 HA LYS 6 HA LYS 6 4.384 9.669 0.188
32 HB2 LYS 6 HB2 LYS 6 4.994 10.062 2.578
33 HB3 LYS 6 HB3 LYS 6 5.631 8.562 1.917
34 HG2 LYS 6 HG2 LYS 6 7.612 10.480 1.462
35 HG3 LYS 6 HG3 LYS 6 7.025 10.774 3.100
36 HD2 LYS 6 HD2 LYS 6 7.522 7.955 2.331
37 HD3 LYS 6 HD3 LYS 6 8.936 8.990 2.544
38 HE2 LYS 6 HE2 LYS 6 8.577 8.052 4.657
39 HE3 LYS 6 HE3 LYS 6 7.879 9.667 4.771
40 HZ1 LYS 6 HZ1 LYS 6 5.693 8.631 4.273
41 HZ2 LYS 6 HZ2 LYS 6 6.423 7.109 4.400
42 HZ3 LYS 6 HZ3 LYS 6 6.366 8.135 5.744
43 H GLU 7 H GLU 7 3.314 11.482 -0.209
44 HA GLU 7 HA GLU 7 4.529 14.039 0.563
45 HB2 GLU 7 HB2 GLU 7 4.266 13.231 -2.084
46 HB3 GLU 7 HB3 GLU 7 2.878 14.278 -1.822
47 HG2 GLU 7 HG2 GLU 7 5.464 15.284 -0.831
48 HG3 GLU 7 HG3 GLU 7 5.290 15.162 -2.581
49 H LEU 8 H LEU 8 2.764 15.834 0.340
50 HA LEU 8 HA LEU 8 0.175 14.772 1.246
51 HB2 LEU 8 HB2 LEU 8 2.077 16.279 2.758
52 HB3 LEU 8 HB3 LEU 8 0.619 17.244 2.534
53 HG LEU 8 HG LEU 8 -0.723 15.614 3.639
54 HD11 LEU 8 HD11 LEU 8 0.379 13.538 4.575
55 HD12 LEU 8 HD12 LEU 8 0.112 13.562 2.832
56 HD13 LEU 8 HD13 LEU 8 1.722 13.872 3.483
57 HD21 LEU 8 HD21 LEU 8 -0.054 16.515 5.552
58 HD22 LEU 8 HD22 LEU 8 1.209 15.290 5.663
59 HD23 LEU 8 HD23 LEU 8 1.545 16.834 4.880
60 H VAL 9 H VAL 9 -1.641 16.048 0.781
61 HA VAL 9 HA VAL 9 -1.252 18.466 -0.805
62 HB VAL 9 HB VAL 9 -2.688 17.730 -2.611
63 HG11 VAL 9 HG11 VAL 9 -0.421 15.822 -2.052
64 HG12 VAL 9 HG12 VAL 9 -1.225 15.993 -3.612
65 HG13 VAL 9 HG13 VAL 9 -0.334 17.351 -2.926
66 HG21 VAL 9 HG21 VAL 9 -2.901 15.216 -0.984
67 HG22 VAL 9 HG22 VAL 9 -4.193 16.225 -1.633
68 HG23 VAL 9 HG23 VAL 9 -3.224 15.228 -2.718
69 H LEU 10 H LEU 10 -3.420 19.490 -1.331
70 HA LEU 10 HA LEU 10 -5.279 19.053 0.914
71 HB2 LEU 10 HB2 LEU 10 -4.211 21.536 -0.337
72 HB3 LEU 10 HB3 LEU 10 -5.843 21.558 0.328
73 HG LEU 10 HG LEU 10 -4.066 22.424 1.857
74 HD11 LEU 10 HD11 LEU 10 -5.067 21.556 3.768
75 HD12 LEU 10 HD12 LEU 10 -6.304 21.351 2.528
76 HD13 LEU 10 HD13 LEU 10 -5.326 19.974 3.033
77 HD21 LEU 10 HD21 LEU 10 -3.248 19.530 2.060
78 HD22 LEU 10 HD22 LEU 10 -2.342 20.758 1.175
79 HD23 LEU 10 HD23 LEU 10 -2.552 20.904 2.920
80 H ALA 11 H ALA 11 -7.471 19.088 0.513
81 HA ALA 11 HA ALA 11 -8.301 18.317 -2.095
82 HB1 ALA 11 HB1 ALA 11 -9.692 18.813 0.500
83 HB2 ALA 11 HB2 ALA 11 -10.638 18.636 -0.978
84 HB3 ALA 11 HB3 ALA 11 -9.576 17.331 -0.450
85 H LEU 12 H LEU 12 -8.333 19.743 -3.716
86 HA LEU 12 HA LEU 12 -8.880 22.534 -3.297
87 HB2 LEU 12 HB2 LEU 12 -7.294 21.540 -5.012
88 HB3 LEU 12 HB3 LEU 12 -8.729 21.107 -5.939
89 HG LEU 12 HG LEU 12 -9.317 23.480 -6.124
90 HD11 LEU 12 HD11 LEU 12 -6.983 24.819 -5.467
91 HD12 LEU 12 HD12 LEU 12 -8.513 24.876 -4.592
92 HD13 LEU 12 HD13 LEU 12 -7.260 23.734 -4.105
93 HD21 LEU 12 HD21 LEU 12 -7.046 24.110 -7.359
94 HD22 LEU 12 HD22 LEU 12 -6.752 22.387 -7.128
95 HD23 LEU 12 HD23 LEU 12 -8.180 22.927 -8.011
96 H TYR 13 H TYR 13 -10.671 19.725 -4.278
97 HA TYR 13 HA TYR 13 -13.098 21.361 -4.401
98 HB2 TYR 13 HB2 TYR 13 -12.596 21.087 -6.712
99 HB3 TYR 13 HB3 TYR 13 -12.188 19.389 -6.496
100 HD1 TYR 13 HD1 TYR 13 -13.703 18.010 -7.544
101 HD2 TYR 13 HD2 TYR 13 -15.140 21.506 -5.590
102 HE1 TYR 13 HE1 TYR 13 -16.008 17.380 -8.125
103 HE2 TYR 13 HE2 TYR 13 -17.449 20.885 -6.165
104 HH TYR 13 HH TYR 13 -18.772 19.294 -7.009
105 H ASP 14 H ASP 14 -14.789 20.486 -3.361
106 HA ASP 14 HA ASP 14 -14.456 18.252 -1.693
107 HB2 ASP 14 HB2 ASP 14 -16.227 20.297 -1.777
108 HB3 ASP 14 HB3 ASP 14 -17.228 18.995 -2.414
109 H TYR 15 H TYR 15 -13.914 16.389 -2.751
110 HA TYR 15 HA TYR 15 -15.700 15.418 -4.860
111 HB2 TYR 15 HB2 TYR 15 -12.954 15.381 -4.654
112 HB3 TYR 15 HB3 TYR 15 -13.394 13.744 -4.181
113 HD1 TYR 15 HD1 TYR 15 -14.726 12.331 -5.766
114 HD2 TYR 15 HD2 TYR 15 -13.065 16.075 -6.916
115 HE1 TYR 15 HE1 TYR 15 -14.987 11.713 -8.133
116 HE2 TYR 15 HE2 TYR 15 -13.323 15.469 -9.286
117 HH TYR 15 HH TYR 15 -15.212 12.905 -10.332
118 H GLN 16 H GLN 16 -17.117 13.831 -4.519
119 HA GLN 16 HA GLN 16 -17.139 12.541 -1.891
120 HB2 GLN 16 HB2 GLN 16 -19.156 13.647 -3.483
121 HB3 GLN 16 HB3 GLN 16 -19.403 11.909 -3.583
122 HG2 GLN 16 HG2 GLN 16 -18.955 12.336 -0.899
123 HG3 GLN 16 HG3 GLN 16 -19.900 13.741 -1.390
124 HE21 GLN 16 HE21 GLN 16 -20.440 11.209 0.210
125 HE22 GLN 16 HE22 GLN 16 -21.915 10.608 -0.458
126 H GLU 17 H GLU 17 -16.522 11.897 -5.205
127 HA GLU 17 HA GLU 17 -15.839 10.029 -6.310
128 HB2 GLU 17 HB2 GLU 17 -15.653 8.709 -3.601
129 HB3 GLU 17 HB3 GLU 17 -14.813 8.242 -5.074
130 HG2 GLU 17 HG2 GLU 17 -14.391 10.817 -3.574
131 HG3 GLU 17 HG3 GLU 17 -13.353 9.395 -3.480
132 H LYS 18 H LYS 18 -16.405 7.638 -6.644
133 HA LYS 18 HA LYS 18 -18.995 6.835 -5.628
134 HB2 LYS 18 HB2 LYS 18 -18.561 7.588 -8.516
135 HB3 LYS 18 HB3 LYS 18 -19.867 6.528 -8.003
136 HG2 LYS 18 HG2 LYS 18 -19.443 9.373 -7.111
137 HG3 LYS 18 HG3 LYS 18 -20.646 8.810 -8.274
138 HD2 LYS 18 HD2 LYS 18 -20.967 7.231 -5.967
139 HD3 LYS 18 HD3 LYS 18 -20.792 8.897 -5.411
140 HE2 LYS 18 HE2 LYS 18 -22.543 9.558 -7.053
141 HE3 LYS 18 HE3 LYS 18 -22.776 7.850 -7.426
142 HZ1 LYS 18 HZ1 LYS 18 -22.899 8.478 -4.613
143 HZ2 LYS 18 HZ2 LYS 18 -24.120 9.204 -5.531
144 HZ3 LYS 18 HZ3 LYS 18 -23.930 7.523 -5.556
145 H SER 19 H SER 19 -16.147 5.903 -5.787
146 HA SER 19 HA SER 19 -16.760 3.159 -6.497
147 HB2 SER 19 HB2 SER 19 -15.261 4.858 -8.262
148 HB3 SER 19 HB3 SER 19 -14.204 3.593 -7.635
149 HG SER 19 HG SER 19 -16.312 3.418 -9.379
150 HA PRO 20 HA PRO 20 -14.132 2.226 -3.111
151 HB2 PRO 20 HB2 PRO 20 -13.056 -0.147 -3.874
152 HB3 PRO 20 HB3 PRO 20 -14.744 0.027 -3.380
153 HG2 PRO 20 HG2 PRO 20 -13.581 -0.097 -6.135
154 HG3 PRO 20 HG3 PRO 20 -15.035 -0.887 -5.498
155 HD2 PRO 20 HD2 PRO 20 -15.139 1.369 -6.991
156 HD3 PRO 20 HD3 PRO 20 -16.315 1.018 -5.709
157 H ARG 21 H ARG 21 -12.736 2.301 -6.315
158 HA ARG 21 HA ARG 21 -10.016 2.348 -5.296
159 HB2 ARG 21 HB2 ARG 21 -9.317 2.033 -7.464
160 HB3 ARG 21 HB3 ARG 21 -10.914 1.303 -7.540
161 HG2 ARG 21 HG2 ARG 21 -11.690 3.651 -8.294
162 HG3 ARG 21 HG3 ARG 21 -9.980 3.917 -8.641
163 HD2 ARG 21 HD2 ARG 21 -10.029 2.602 -10.454
164 HD3 ARG 21 HD3 ARG 21 -10.995 1.370 -9.644
165 HE ARG 21 HE ARG 21 -11.956 3.526 -11.303
166 HH11 ARG 21 HH11 ARG 21 -12.752 1.177 -8.859
167 HH12 ARG 21 HH12 ARG 21 -14.445 1.178 -9.225
168 HH21 ARG 21 HH21 ARG 21 -14.184 3.535 -11.794
169 HH22 ARG 21 HH22 ARG 21 -15.259 2.518 -10.895
170 H GLU 22 H GLU 22 -12.233 4.522 -4.994
171 HA GLU 22 HA GLU 22 -10.593 6.786 -5.921
172 HB2 GLU 22 HB2 GLU 22 -13.556 6.483 -5.521
173 HB3 GLU 22 HB3 GLU 22 -12.805 8.073 -5.524
174 HG2 GLU 22 HG2 GLU 22 -11.956 7.691 -7.767
175 HG3 GLU 22 HG3 GLU 22 -12.653 6.072 -7.767
176 H VAL 23 H VAL 23 -10.693 8.737 -4.516
177 HA VAL 23 HA VAL 23 -10.856 7.995 -1.667
178 HB VAL 23 HB VAL 23 -8.743 9.557 -3.117
179 HG11 VAL 23 HG11 VAL 23 -9.818 10.078 -0.436
180 HG12 VAL 23 HG12 VAL 23 -8.065 9.892 -0.509
181 HG13 VAL 23 HG13 VAL 23 -8.864 11.113 -1.500
182 HG21 VAL 23 HG21 VAL 23 -8.057 7.806 -0.871
183 HG22 VAL 23 HG22 VAL 23 -8.844 6.985 -2.219
184 HG23 VAL 23 HG23 VAL 23 -7.362 7.903 -2.489
185 H THR 24 H THR 24 -12.537 9.019 -0.810
186 HA THR 24 HA THR 24 -13.631 11.420 -1.901
187 HB THR 24 HB THR 24 -14.221 10.036 0.723
188 HG1 THR 24 HG1 THR 24 -14.845 8.719 -0.950
189 HG21 THR 24 HG21 THR 24 -15.569 11.732 1.242
190 HG22 THR 24 HG22 THR 24 -14.979 12.609 -0.170
191 HG23 THR 24 HG23 THR 24 -16.401 11.574 -0.305
192 H MET 25 H MET 25 -12.977 13.431 -1.547
193 HA MET 25 HA MET 25 -11.619 14.048 0.991
194 HB2 MET 25 HB2 MET 25 -10.034 15.433 -0.115
195 HB3 MET 25 HB3 MET 25 -10.058 13.907 -0.988
196 HG2 MET 25 HG2 MET 25 -11.949 15.820 -2.068
197 HG3 MET 25 HG3 MET 25 -10.295 16.430 -2.072
198 HE1 MET 25 HE1 MET 25 -8.725 16.080 -3.574
199 HE2 MET 25 HE2 MET 25 -8.681 14.956 -4.932
200 HE3 MET 25 HE3 MET 25 -9.817 16.305 -4.941
201 H LYS 26 H LYS 26 -11.870 16.201 1.764
202 HA LYS 26 HA LYS 26 -14.244 17.558 0.668
203 HB2 LYS 26 HB2 LYS 26 -13.412 16.895 3.413
204 HB3 LYS 26 HB3 LYS 26 -14.008 18.536 3.206
205 HG2 LYS 26 HG2 LYS 26 -15.730 16.654 1.872
206 HG3 LYS 26 HG3 LYS 26 -15.514 16.222 3.570
207 HD2 LYS 26 HD2 LYS 26 -15.996 19.080 2.998
208 HD3 LYS 26 HD3 LYS 26 -17.351 17.987 2.707
209 HE2 LYS 26 HE2 LYS 26 -16.050 17.384 5.211
210 HE3 LYS 26 HE3 LYS 26 -16.545 19.075 5.150
211 HZ1 LYS 26 HZ1 LYS 26 -18.202 16.652 5.043
212 HZ2 LYS 26 HZ2 LYS 26 -18.426 18.067 5.944
213 HZ3 LYS 26 HZ3 LYS 26 -18.756 18.059 4.285
214 H LYS 27 H LYS 27 -14.013 19.572 -0.059
215 HA LYS 27 HA LYS 27 -11.679 20.835 -0.589
216 HB2 LYS 27 HB2 LYS 27 -14.007 21.521 -1.310
217 HB3 LYS 27 HB3 LYS 27 -14.157 22.350 0.234
218 HG2 LYS 27 HG2 LYS 27 -12.207 23.734 -0.346
219 HG3 LYS 27 HG3 LYS 27 -12.130 22.931 -1.917
220 HD2 LYS 27 HD2 LYS 27 -13.290 24.954 -2.286
221 HD3 LYS 27 HD3 LYS 27 -14.525 23.692 -2.265
222 HE2 LYS 27 HE2 LYS 27 -15.282 25.601 -0.989
223 HE3 LYS 27 HE3 LYS 27 -15.002 24.236 0.091
224 HZ1 LYS 27 HZ1 LYS 27 -12.638 25.744 -0.129
225 HZ2 LYS 27 HZ2 LYS 27 -13.912 26.791 0.251
226 HZ3 LYS 27 HZ3 LYS 27 -13.585 25.460 1.244
227 H GLY 28 H GLY 28 -10.053 21.064 0.834
228 HA2 GLY 28 HA2 GLY 28 -9.060 22.607 2.405
229 HA3 GLY 28 HA3 GLY 28 -10.607 22.681 3.236
230 H ASP 29 H ASP 29 -9.139 19.698 2.126
231 HA ASP 29 HA ASP 29 -8.530 19.001 4.921
232 HB2 ASP 29 HB2 ASP 29 -9.771 17.109 4.859
233 HB3 ASP 29 HB3 ASP 29 -10.630 17.936 3.563
234 H ILE 30 H ILE 30 -6.930 17.295 5.173
235 HA ILE 30 HA ILE 30 -4.960 17.359 2.991
236 HB ILE 30 HB ILE 30 -4.728 17.593 5.871
237 HG12 ILE 30 HG12 ILE 30 -3.805 19.027 3.912
238 HG13 ILE 30 HG13 ILE 30 -2.798 18.793 5.337
239 HG21 ILE 30 HG21 ILE 30 -4.131 15.268 5.855
240 HG22 ILE 30 HG22 ILE 30 -3.030 15.515 4.500
241 HG23 ILE 30 HG23 ILE 30 -2.664 16.223 6.073
242 HD11 ILE 30 HD11 ILE 30 -1.784 18.541 2.964
243 HD12 ILE 30 HD12 ILE 30 -1.335 17.406 4.237
244 HD13 ILE 30 HD13 ILE 30 -2.523 16.941 3.020
245 H LEU 31 H LEU 31 -4.054 15.496 2.201
246 HA LEU 31 HA LEU 31 -5.046 12.949 3.285
247 HB2 LEU 31 HB2 LEU 31 -4.794 12.433 0.613
248 HB3 LEU 31 HB3 LEU 31 -6.307 12.746 1.461
249 HG LEU 31 HG LEU 31 -4.775 15.037 0.312
250 HD11 LEU 31 HD11 LEU 31 -6.760 13.522 -1.340
251 HD12 LEU 31 HD12 LEU 31 -5.588 14.739 -1.844
252 HD13 LEU 31 HD13 LEU 31 -5.043 13.125 -1.389
253 HD21 LEU 31 HD21 LEU 31 -6.603 16.145 0.903
254 HD22 LEU 31 HD22 LEU 31 -7.610 15.066 -0.062
255 HD23 LEU 31 HD23 LEU 31 -7.243 14.664 1.616
256 H THR 32 H THR 32 -3.735 11.081 2.671
257 HA THR 32 HA THR 32 -0.902 11.816 2.529
258 HB THR 32 HB THR 32 -1.891 9.041 3.110
259 HG1 THR 32 HG1 THR 32 -3.005 10.276 4.599
260 HG21 THR 32 HG21 THR 32 0.181 8.725 4.123
261 HG22 THR 32 HG22 THR 32 0.575 9.751 2.743
262 HG23 THR 32 HG23 THR 32 0.442 10.454 4.355
263 H LEU 33 H LEU 33 -0.024 11.779 0.569
264 HA LEU 33 HA LEU 33 -1.141 10.445 -1.656
265 HB2 LEU 33 HB2 LEU 33 1.367 11.925 -1.089
266 HB3 LEU 33 HB3 LEU 33 1.340 10.883 -2.510
267 HG LEU 33 HG LEU 33 0.816 13.310 -2.916
268 HD11 LEU 33 HD11 LEU 33 -1.608 11.889 -3.771
269 HD12 LEU 33 HD12 LEU 33 -0.378 12.719 -4.724
270 HD13 LEU 33 HD13 LEU 33 -0.089 11.077 -4.149
271 HD21 LEU 33 HD21 LEU 33 -1.688 12.560 -1.413
272 HD22 LEU 33 HD22 LEU 33 -0.511 13.798 -0.974
273 HD23 LEU 33 HD23 LEU 33 -1.514 14.005 -2.410
274 H LEU 34 H LEU 34 -0.558 8.572 -2.710
275 HA LEU 34 HA LEU 34 1.236 6.770 -1.220
276 HB2 LEU 34 HB2 LEU 34 -1.460 6.405 -2.300
277 HB3 LEU 34 HB3 LEU 34 -0.338 5.112 -2.717
278 HG LEU 34 HG LEU 34 -0.286 5.822 0.116
279 HD11 LEU 34 HD11 LEU 34 -2.600 6.254 -0.085
280 HD12 LEU 34 HD12 LEU 34 -2.840 4.877 -1.160
281 HD13 LEU 34 HD13 LEU 34 -2.458 4.612 0.541
282 HD21 LEU 34 HD21 LEU 34 0.835 3.867 -0.683
283 HD22 LEU 34 HD22 LEU 34 -0.537 3.346 0.295
284 HD23 LEU 34 HD23 LEU 34 -0.632 3.280 -1.465
285 H ASN 35 H ASN 35 -0.200 7.089 -4.474
286 HA ASN 35 HA ASN 35 2.187 5.932 -5.655
287 HB2 ASN 35 HB2 ASN 35 0.004 5.235 -6.509
288 HB3 ASN 35 HB3 ASN 35 -0.383 6.902 -6.924
289 HD21 ASN 35 HD21 ASN 35 2.636 5.123 -7.353
290 HD22 ASN 35 HD22 ASN 35 2.679 5.263 -9.075
291 H SER 36 H SER 36 0.252 8.786 -6.559
292 HA SER 36 HA SER 36 0.847 10.889 -7.199
293 HB2 SER 36 HB2 SER 36 2.889 10.121 -5.290
294 HB3 SER 36 HB3 SER 36 3.552 11.183 -6.532
295 HG SER 36 HG SER 36 2.319 12.004 -4.483
296 H THR 37 H THR 37 1.574 8.314 -8.709
297 HA THR 37 HA THR 37 3.670 9.363 -10.468
298 HB THR 37 HB THR 37 2.393 6.621 -10.443
299 HG1 THR 37 HG1 THR 37 4.719 7.694 -9.247
300 HG21 THR 37 HG21 THR 37 3.290 7.301 -12.642
301 HG22 THR 37 HG22 THR 37 4.854 7.611 -11.889
302 HG23 THR 37 HG23 THR 37 4.203 5.972 -11.928
303 H ASN 38 H ASN 38 0.281 8.471 -10.415
304 HA ASN 38 HA ASN 38 0.019 9.075 -13.266
305 HB2 ASN 38 HB2 ASN 38 -1.092 7.053 -12.589
306 HB3 ASN 38 HB3 ASN 38 -1.905 7.881 -11.264
307 HD21 ASN 38 HD21 ASN 38 -1.457 8.752 -14.667
308 HD22 ASN 38 HD22 ASN 38 -3.140 8.896 -15.030
309 H LYS 39 H LYS 39 0.060 11.257 -13.484
310 HA LYS 39 HA LYS 39 -0.852 13.206 -11.789
311 HB2 LYS 39 HB2 LYS 39 0.396 13.809 -13.741
312 HB3 LYS 39 HB3 LYS 39 -0.836 13.145 -14.807
313 HG2 LYS 39 HG2 LYS 39 -2.398 14.888 -14.054
314 HG3 LYS 39 HG3 LYS 39 -1.121 15.571 -13.045
315 HD2 LYS 39 HD2 LYS 39 0.075 15.359 -15.518
316 HD3 LYS 39 HD3 LYS 39 -1.581 15.826 -15.913
317 HE2 LYS 39 HE2 LYS 39 -1.341 17.659 -14.194
318 HE3 LYS 39 HE3 LYS 39 0.376 17.265 -14.132
319 HZ1 LYS 39 HZ1 LYS 39 0.745 18.140 -16.172
320 HZ2 LYS 39 HZ2 LYS 39 -0.789 17.742 -16.765
321 HZ3 LYS 39 HZ3 LYS 39 -0.594 19.088 -15.759
322 H ASP 40 H ASP 40 -2.719 11.628 -14.376
323 HA ASP 40 HA ASP 40 -5.107 12.960 -14.138
324 HB2 ASP 40 HB2 ASP 40 -4.715 11.289 -15.866
325 HB3 ASP 40 HB3 ASP 40 -4.683 10.010 -14.655
326 H TRP 41 H TRP 41 -4.038 10.137 -12.265
327 HA TRP 41 HA TRP 41 -5.900 10.923 -10.146
328 HB2 TRP 41 HB2 TRP 41 -5.775 8.233 -11.492
329 HB3 TRP 41 HB3 TRP 41 -6.362 8.401 -9.839
330 HD1 TRP 41 HD1 TRP 41 -7.350 9.058 -13.447
331 HE1 TRP 41 HE1 TRP 41 -9.824 9.765 -13.524
332 HE3 TRP 41 HE3 TRP 41 -8.190 9.623 -8.435
333 HZ2 TRP 41 HZ2 TRP 41 -11.861 10.471 -11.702
334 HZ3 TRP 41 HZ3 TRP 41 -10.428 10.317 -7.686
335 HH2 TRP 41 HH2 TRP 41 -12.224 10.732 -9.287
336 H TRP 42 H TRP 42 -4.753 11.189 -8.360
337 HA TRP 42 HA TRP 42 -2.242 9.717 -8.035
338 HB2 TRP 42 HB2 TRP 42 -3.355 12.219 -6.791
339 HB3 TRP 42 HB3 TRP 42 -1.992 11.373 -6.065
340 HD1 TRP 42 HD1 TRP 42 -0.770 10.632 -9.089
341 HE1 TRP 42 HE1 TRP 42 0.549 12.498 -10.275
342 HE3 TRP 42 HE3 TRP 42 -2.541 14.660 -6.485
343 HZ2 TRP 42 HZ2 TRP 42 0.805 15.305 -10.126
344 HZ3 TRP 42 HZ3 TRP 42 -1.708 16.900 -7.069
345 HH2 TRP 42 HH2 TRP 42 -0.070 17.214 -8.851
346 H LYS 43 H LYS 43 -2.488 7.814 -7.053
347 HA LYS 43 HA LYS 43 -4.606 7.086 -5.374
348 HB2 LYS 43 HB2 LYS 43 -3.242 5.424 -6.505
349 HB3 LYS 43 HB3 LYS 43 -1.823 5.926 -5.595
350 HG2 LYS 43 HG2 LYS 43 -3.489 5.318 -3.570
351 HG3 LYS 43 HG3 LYS 43 -4.068 4.197 -4.805
352 HD2 LYS 43 HD2 LYS 43 -1.157 4.311 -4.619
353 HD3 LYS 43 HD3 LYS 43 -1.931 3.778 -3.125
354 HE2 LYS 43 HE2 LYS 43 -1.889 1.755 -4.108
355 HE3 LYS 43 HE3 LYS 43 -3.318 2.345 -4.956
356 HZ1 LYS 43 HZ1 LYS 43 -2.217 2.035 -6.836
357 HZ2 LYS 43 HZ2 LYS 43 -1.134 3.255 -6.386
358 HZ3 LYS 43 HZ3 LYS 43 -0.792 1.641 -6.013
359 H VAL 44 H VAL 44 -5.022 7.436 -3.290
360 HA VAL 44 HA VAL 44 -2.840 8.082 -1.456
361 HB VAL 44 HB VAL 44 -3.893 10.042 -0.569
362 HG11 VAL 44 HG11 VAL 44 -2.613 10.020 -2.893
363 HG12 VAL 44 HG12 VAL 44 -4.168 10.623 -3.466
364 HG13 VAL 44 HG13 VAL 44 -3.290 11.499 -2.212
365 HG21 VAL 44 HG21 VAL 44 -5.964 10.964 -1.525
366 HG22 VAL 44 HG22 VAL 44 -6.111 9.538 -2.552
367 HG23 VAL 44 HG23 VAL 44 -6.217 9.377 -0.799
368 H GLU 45 H GLU 45 -3.659 8.192 0.845
369 HA GLU 45 HA GLU 45 -5.859 6.265 1.216
370 HB2 GLU 45 HB2 GLU 45 -3.873 5.124 1.817
371 HB3 GLU 45 HB3 GLU 45 -3.232 6.524 2.665
372 HG2 GLU 45 HG2 GLU 45 -4.669 6.227 4.484
373 HG3 GLU 45 HG3 GLU 45 -5.726 5.142 3.582
374 H VAL 46 H VAL 46 -7.488 6.867 2.498
375 HA VAL 46 HA VAL 46 -7.084 8.974 4.481
376 HB VAL 46 HB VAL 46 -9.262 10.048 3.704
377 HG11 VAL 46 HG11 VAL 46 -8.105 11.621 2.491
378 HG12 VAL 46 HG12 VAL 46 -6.782 10.791 3.310
379 HG13 VAL 46 HG13 VAL 46 -7.153 10.413 1.627
380 HG21 VAL 46 HG21 VAL 46 -9.795 8.106 2.165
381 HG22 VAL 46 HG22 VAL 46 -10.002 9.720 1.485
382 HG23 VAL 46 HG23 VAL 46 -8.579 8.764 1.071
383 H ASN 47 H ASN 47 -8.108 8.527 6.324
384 HA ASN 47 HA ASN 47 -9.224 7.200 7.837
385 HB2 ASN 47 HB2 ASN 47 -11.771 7.196 7.228
386 HB3 ASN 47 HB3 ASN 47 -10.964 8.715 7.604
387 HD21 ASN 47 HD21 ASN 47 -12.202 6.689 5.039
388 HD22 ASN 47 HD22 ASN 47 -12.328 7.937 3.852
389 H ASP 48 H ASP 48 -7.986 5.297 6.983
390 HA ASP 48 HA ASP 48 -7.840 3.179 6.099
391 HB2 ASP 48 HB2 ASP 48 -9.555 3.280 8.220
392 HB3 ASP 48 HB3 ASP 48 -10.561 2.502 7.002
393 H ARG 49 H ARG 49 -8.794 5.041 4.180
394 HA ARG 49 HA ARG 49 -10.198 3.196 2.420
395 HB2 ARG 49 HB2 ARG 49 -11.438 5.525 3.618
396 HB3 ARG 49 HB3 ARG 49 -11.416 5.650 1.864
397 HG2 ARG 49 HG2 ARG 49 -12.437 3.227 3.319
398 HG3 ARG 49 HG3 ARG 49 -13.462 4.592 2.870
399 HD2 ARG 49 HD2 ARG 49 -12.004 3.911 0.569
400 HD3 ARG 49 HD3 ARG 49 -12.555 2.389 1.268
401 HE ARG 49 HE ARG 49 -14.719 2.960 0.745
402 HH11 ARG 49 HH11 ARG 49 -12.650 5.734 0.362
403 HH12 ARG 49 HH12 ARG 49 -13.862 6.694 -0.419
404 HH21 ARG 49 HH21 ARG 49 -16.324 4.214 -0.283
405 HH22 ARG 49 HH22 ARG 49 -15.952 5.829 -0.784
406 H GLN 50 H GLN 50 -8.220 3.091 1.303
407 HA GLN 50 HA GLN 50 -7.263 5.565 0.064
408 HB2 GLN 50 HB2 GLN 50 -5.242 4.409 -0.431
409 HB3 GLN 50 HB3 GLN 50 -5.669 3.994 1.224
410 HG2 GLN 50 HG2 GLN 50 -5.746 1.835 0.745
411 HG3 GLN 50 HG3 GLN 50 -6.809 2.112 -0.633
412 HE21 GLN 50 HE21 GLN 50 -3.460 3.045 0.071
413 HE22 GLN 50 HE22 GLN 50 -2.783 2.341 -1.354
414 H GLY 51 H GLY 51 -6.821 5.642 -2.218
415 HA2 GLY 51 HA2 GLY 51 -7.674 3.625 -4.016
416 HA3 GLY 51 HA3 GLY 51 -8.941 4.828 -3.826
417 H PHE 52 H PHE 52 -8.868 6.574 -5.086
418 HA PHE 52 HA PHE 52 -6.303 7.464 -6.168
419 HB2 PHE 52 HB2 PHE 52 -8.633 6.470 -7.768
420 HB3 PHE 52 HB3 PHE 52 -7.610 7.743 -8.424
421 HD1 PHE 52 HD1 PHE 52 -5.027 7.242 -8.315
422 HD2 PHE 52 HD2 PHE 52 -8.086 4.284 -8.208
423 HE1 PHE 52 HE1 PHE 52 -3.415 5.551 -9.087
424 HE2 PHE 52 HE2 PHE 52 -6.479 2.589 -8.978
425 HZ PHE 52 HZ PHE 52 -4.139 3.221 -9.419
426 H VAL 53 H VAL 53 -6.118 9.593 -5.983
427 HA VAL 53 HA VAL 53 -8.572 11.185 -5.646
428 HB VAL 53 HB VAL 53 -6.375 11.040 -3.990
429 HG11 VAL 53 HG11 VAL 53 -5.192 13.128 -4.140
430 HG12 VAL 53 HG12 VAL 53 -5.065 12.293 -5.688
431 HG13 VAL 53 HG13 VAL 53 -6.186 13.641 -5.503
432 HG21 VAL 53 HG21 VAL 53 -7.751 13.597 -3.809
433 HG22 VAL 53 HG22 VAL 53 -8.856 12.240 -4.027
434 HG23 VAL 53 HG23 VAL 53 -7.722 12.245 -2.677
435 HA PRO 54 HA PRO 54 -7.717 13.196 -9.480
436 HB2 PRO 54 HB2 PRO 54 -9.278 15.387 -9.120
437 HB3 PRO 54 HB3 PRO 54 -9.937 13.787 -9.481
438 HG2 PRO 54 HG2 PRO 54 -9.700 15.188 -6.846
439 HG3 PRO 54 HG3 PRO 54 -11.056 14.248 -7.495
440 HD2 PRO 54 HD2 PRO 54 -9.303 13.228 -5.701
441 HD3 PRO 54 HD3 PRO 54 -10.086 12.231 -6.945
442 H ALA 55 H ALA 55 -5.811 14.136 -9.851
443 HA ALA 55 HA ALA 55 -4.421 15.773 -8.046
444 HB1 ALA 55 HB1 ALA 55 -4.037 15.653 -11.034
445 HB2 ALA 55 HB2 ALA 55 -2.855 16.162 -9.828
446 HB3 ALA 55 HB3 ALA 55 -3.383 14.480 -9.890
447 H ALA 56 H ALA 56 -6.054 16.683 -11.088
448 HA ALA 56 HA ALA 56 -5.703 19.399 -11.020
449 HB1 ALA 56 HB1 ALA 56 -7.740 19.588 -12.353
450 HB2 ALA 56 HB2 ALA 56 -6.758 18.222 -12.882
451 HB3 ALA 56 HB3 ALA 56 -8.197 17.946 -11.899
452 H TYR 57 H TYR 57 -7.961 17.469 -9.152
453 HA TYR 57 HA TYR 57 -9.154 19.869 -7.988
454 HB2 TYR 57 HB2 TYR 57 -9.842 16.938 -7.781
455 HB3 TYR 57 HB3 TYR 57 -10.633 18.176 -6.812
456 HD1 TYR 57 HD1 TYR 57 -11.032 16.234 -9.615
457 HD2 TYR 57 HD2 TYR 57 -11.393 20.291 -8.385
458 HE1 TYR 57 HE1 TYR 57 -12.620 16.642 -11.449
459 HE2 TYR 57 HE2 TYR 57 -12.983 20.710 -10.214
460 HH TYR 57 HH TYR 57 -13.864 19.879 -12.114
461 H VAL 58 H VAL 58 -6.457 19.491 -7.381
462 HA VAL 58 HA VAL 58 -6.628 19.225 -4.482
463 HB VAL 58 HB VAL 58 -5.722 17.068 -5.839
464 HG11 VAL 58 HG11 VAL 58 -3.187 18.470 -5.051
465 HG12 VAL 58 HG12 VAL 58 -3.385 16.998 -6.002
466 HG13 VAL 58 HG13 VAL 58 -3.830 18.559 -6.691
467 HG21 VAL 58 HG21 VAL 58 -4.541 17.967 -3.216
468 HG22 VAL 58 HG22 VAL 58 -6.184 17.348 -3.392
469 HG23 VAL 58 HG23 VAL 58 -4.806 16.313 -3.768
470 H LYS 59 H LYS 59 -4.469 19.883 -3.466
471 HA LYS 59 HA LYS 59 -2.833 21.662 -5.050
472 HB2 LYS 59 HB2 LYS 59 -5.014 22.650 -3.370
473 HB3 LYS 59 HB3 LYS 59 -3.458 23.362 -2.968
474 HG2 LYS 59 HG2 LYS 59 -4.443 23.261 -5.795
475 HG3 LYS 59 HG3 LYS 59 -4.921 24.553 -4.692
476 HD2 LYS 59 HD2 LYS 59 -2.541 25.071 -4.311
477 HD3 LYS 59 HD3 LYS 59 -2.098 23.816 -5.470
478 HE2 LYS 59 HE2 LYS 59 -2.082 26.100 -6.433
479 HE3 LYS 59 HE3 LYS 59 -3.191 25.003 -7.252
480 HZ1 LYS 59 HZ1 LYS 59 -4.072 26.864 -5.123
481 HZ2 LYS 59 HZ2 LYS 59 -4.063 27.292 -6.760
482 HZ3 LYS 59 HZ3 LYS 59 -5.033 26.014 -6.225
483 H LYS 60 H LYS 60 -0.855 21.122 -4.427
484 HA LYS 60 HA LYS 60 -0.243 19.825 -2.000
485 HB2 LYS 60 HB2 LYS 60 1.051 19.987 -4.301
486 HB3 LYS 60 HB3 LYS 60 1.860 21.327 -3.498
487 HG2 LYS 60 HG2 LYS 60 1.658 18.633 -2.205
488 HG3 LYS 60 HG3 LYS 60 2.932 19.008 -3.368
489 HD2 LYS 60 HD2 LYS 60 2.667 21.102 -1.395
490 HD3 LYS 60 HD3 LYS 60 2.944 19.536 -0.630
491 HE2 LYS 60 HE2 LYS 60 5.109 20.072 -1.004
492 HE3 LYS 60 HE3 LYS 60 4.762 19.395 -2.594
493 HZ1 LYS 60 HZ1 LYS 60 4.014 21.926 -2.948
494 HZ2 LYS 60 HZ2 LYS 60 5.257 22.146 -1.820
495 HZ3 LYS 60 HZ3 LYS 60 5.572 21.358 -3.284
496 H LEU 61 H LEU 61 -0.988 21.047 -0.267
497 HA LEU 61 HA LEU 61 0.532 23.517 0.255
498 HB2 LEU 61 HB2 LEU 61 -2.219 22.936 1.319
499 HB3 LEU 61 HB3 LEU 61 -1.336 24.460 1.373
500 HG LEU 61 HG LEU 61 -2.124 23.271 -1.259
501 HD11 LEU 61 HD11 LEU 61 -4.039 25.196 -0.581
502 HD12 LEU 61 HD12 LEU 61 -4.286 23.465 -0.809
503 HD13 LEU 61 HD13 LEU 61 -3.944 24.103 0.799
504 HD21 LEU 61 HD21 LEU 61 -2.293 25.770 -1.747
505 HD22 LEU 61 HD22 LEU 61 -1.480 26.007 -0.200
506 HD23 LEU 61 HD23 LEU 61 -0.681 25.104 -1.488
507 H ASP 62 H ASP 62 1.839 21.433 1.048
508 HA ASP 62 HA ASP 62 2.716 20.267 2.799
509 HB2 ASP 62 HB2 ASP 62 1.911 22.896 3.848
510 HB3 ASP 62 HB3 ASP 62 2.135 21.656 5.079
Start of MODEL 9
1 H1 MET 1 H MET 1 1.041 0.962 0.579
2 HA MET 1 HA MET 1 2.783 -0.346 -0.961
3 HB2 MET 1 HB2 MET 1 0.811 1.064 -2.700
4 HB3 MET 1 HB3 MET 1 2.495 1.034 -3.205
5 HG2 MET 1 HG2 MET 1 2.367 -1.085 -3.858
6 HG3 MET 1 HG3 MET 1 1.553 -1.577 -2.375
7 HE1 MET 1 HE1 MET 1 -2.182 -0.718 -3.200
8 HE2 MET 1 HE2 MET 1 -1.155 -1.646 -2.107
9 HE3 MET 1 HE3 MET 1 -0.955 0.101 -2.234
10 H ASP 2 H ASP 2 1.732 2.919 -1.867
11 HA ASP 2 HA ASP 2 2.602 4.981 -1.395
12 HB2 ASP 2 HB2 ASP 2 3.333 5.252 0.703
13 HB3 ASP 2 HB3 ASP 2 3.273 3.501 0.885
14 H GLU 3 H GLU 3 4.986 2.370 -1.636
15 HA GLU 3 HA GLU 3 6.970 2.208 -2.750
16 HB2 GLU 3 HB2 GLU 3 5.111 2.623 -4.572
17 HB3 GLU 3 HB3 GLU 3 5.960 4.147 -4.788
18 HG2 GLU 3 HG2 GLU 3 7.686 1.780 -4.740
19 HG3 GLU 3 HG3 GLU 3 6.552 1.847 -6.087
20 H THR 4 H THR 4 7.626 3.657 -0.801
21 HA THR 4 HA THR 4 8.703 5.509 0.051
22 HB THR 4 HB THR 4 10.515 4.223 -0.978
23 HG1 THR 4 HG1 THR 4 11.880 5.832 -0.640
24 HG21 THR 4 HG21 THR 4 11.374 5.072 -3.222
25 HG22 THR 4 HG22 THR 4 9.918 4.078 -3.258
26 HG23 THR 4 HG23 THR 4 9.794 5.830 -3.419
27 H GLY 5 H GLY 5 6.394 6.359 -1.242
28 HA2 GLY 5 HA2 GLY 5 7.283 8.991 -2.195
29 HA3 GLY 5 HA3 GLY 5 6.148 8.079 -3.179
30 H LYS 6 H LYS 6 6.572 9.283 0.142
31 HA LYS 6 HA LYS 6 3.658 9.506 0.383
32 HB2 LYS 6 HB2 LYS 6 5.726 8.771 2.189
33 HB3 LYS 6 HB3 LYS 6 5.013 10.266 2.783
34 HG2 LYS 6 HG2 LYS 6 3.482 8.967 3.739
35 HG3 LYS 6 HG3 LYS 6 2.810 8.773 2.118
36 HD2 LYS 6 HD2 LYS 6 3.188 6.587 2.299
37 HD3 LYS 6 HD3 LYS 6 4.918 6.938 2.283
38 HE2 LYS 6 HE2 LYS 6 4.510 5.636 4.220
39 HE3 LYS 6 HE3 LYS 6 4.751 7.293 4.771
40 HZ1 LYS 6 HZ1 LYS 6 2.636 7.461 5.472
41 HZ2 LYS 6 HZ2 LYS 6 2.007 6.539 4.200
42 HZ3 LYS 6 HZ3 LYS 6 2.710 5.772 5.534
43 H GLU 7 H GLU 7 2.774 11.398 -0.092
44 HA GLU 7 HA GLU 7 4.232 13.852 0.618
45 HB2 GLU 7 HB2 GLU 7 2.516 14.219 -1.688
46 HB3 GLU 7 HB3 GLU 7 4.211 14.634 -1.478
47 HG2 GLU 7 HG2 GLU 7 3.215 11.882 -2.169
48 HG3 GLU 7 HG3 GLU 7 3.769 13.069 -3.348
49 H LEU 8 H LEU 8 2.521 15.781 0.178
50 HA LEU 8 HA LEU 8 -0.056 15.001 1.349
51 HB2 LEU 8 HB2 LEU 8 2.031 16.498 2.627
52 HB3 LEU 8 HB3 LEU 8 0.606 17.514 2.422
53 HG LEU 8 HG LEU 8 -0.728 16.055 3.738
54 HD11 LEU 8 HD11 LEU 8 0.304 13.972 4.727
55 HD12 LEU 8 HD12 LEU 8 -0.081 13.908 3.007
56 HD13 LEU 8 HD13 LEU 8 1.586 14.148 3.529
57 HD21 LEU 8 HD21 LEU 8 0.741 15.850 5.846
58 HD22 LEU 8 HD22 LEU 8 1.980 16.645 4.875
59 HD23 LEU 8 HD23 LEU 8 0.443 17.455 5.179
60 H VAL 9 H VAL 9 -1.801 16.330 0.829
61 HA VAL 9 HA VAL 9 -1.352 18.645 -0.878
62 HB VAL 9 HB VAL 9 -2.826 17.861 -2.654
63 HG11 VAL 9 HG11 VAL 9 -0.452 17.507 -2.946
64 HG12 VAL 9 HG12 VAL 9 -0.544 15.975 -2.077
65 HG13 VAL 9 HG13 VAL 9 -1.343 16.152 -3.640
66 HG21 VAL 9 HG21 VAL 9 -2.961 15.364 -0.985
67 HG22 VAL 9 HG22 VAL 9 -4.289 16.362 -1.577
68 HG23 VAL 9 HG23 VAL 9 -3.358 15.375 -2.704
69 H LEU 10 H LEU 10 -3.475 19.715 -1.437
70 HA LEU 10 HA LEU 10 -5.348 19.411 0.816
71 HB2 LEU 10 HB2 LEU 10 -4.244 21.794 -0.579
72 HB3 LEU 10 HB3 LEU 10 -5.888 21.884 0.049
73 HG LEU 10 HG LEU 10 -4.018 22.792 1.519
74 HD11 LEU 10 HD11 LEU 10 -5.226 20.913 3.306
75 HD12 LEU 10 HD12 LEU 10 -5.560 22.632 3.102
76 HD13 LEU 10 HD13 LEU 10 -6.412 21.446 2.114
77 HD21 LEU 10 HD21 LEU 10 -2.438 20.954 1.158
78 HD22 LEU 10 HD22 LEU 10 -2.812 21.166 2.868
79 HD23 LEU 10 HD23 LEU 10 -3.549 19.845 1.961
80 H ALA 11 H ALA 11 -7.523 19.348 0.422
81 HA ALA 11 HA ALA 11 -8.367 18.483 -2.149
82 HB1 ALA 11 HB1 ALA 11 -10.667 18.611 -1.112
83 HB2 ALA 11 HB2 ALA 11 -9.502 17.579 -0.282
84 HB3 ALA 11 HB3 ALA 11 -9.876 19.179 0.358
85 H LEU 12 H LEU 12 -8.427 19.858 -3.814
86 HA LEU 12 HA LEU 12 -9.020 22.650 -3.484
87 HB2 LEU 12 HB2 LEU 12 -7.438 21.625 -5.184
88 HB3 LEU 12 HB3 LEU 12 -8.876 21.133 -6.077
89 HG LEU 12 HG LEU 12 -8.455 24.011 -5.370
90 HD11 LEU 12 HD11 LEU 12 -6.432 22.849 -6.570
91 HD12 LEU 12 HD12 LEU 12 -7.485 22.959 -7.980
92 HD13 LEU 12 HD13 LEU 12 -7.023 24.421 -7.109
93 HD21 LEU 12 HD21 LEU 12 -10.321 22.457 -6.901
94 HD22 LEU 12 HD22 LEU 12 -10.370 24.169 -6.482
95 HD23 LEU 12 HD23 LEU 12 -9.522 23.641 -7.935
96 H TYR 13 H TYR 13 -10.778 19.781 -4.351
97 HA TYR 13 HA TYR 13 -13.231 21.377 -4.499
98 HB2 TYR 13 HB2 TYR 13 -12.747 21.025 -6.806
99 HB3 TYR 13 HB3 TYR 13 -12.321 19.339 -6.531
100 HD1 TYR 13 HD1 TYR 13 -15.288 21.409 -5.579
101 HD2 TYR 13 HD2 TYR 13 -13.828 17.961 -7.600
102 HE1 TYR 13 HE1 TYR 13 -17.598 20.746 -6.104
103 HE2 TYR 13 HE2 TYR 13 -16.134 17.289 -8.132
104 HH TYR 13 HH TYR 13 -18.283 17.813 -7.989
105 H ASP 14 H ASP 14 -14.903 20.512 -3.419
106 HA ASP 14 HA ASP 14 -14.512 18.340 -1.676
107 HB2 ASP 14 HB2 ASP 14 -16.316 20.365 -1.814
108 HB3 ASP 14 HB3 ASP 14 -17.306 19.014 -2.359
109 H TYR 15 H TYR 15 -13.943 16.470 -2.727
110 HA TYR 15 HA TYR 15 -15.753 15.411 -4.766
111 HB2 TYR 15 HB2 TYR 15 -13.006 15.393 -4.576
112 HB3 TYR 15 HB3 TYR 15 -13.435 13.770 -4.047
113 HD1 TYR 15 HD1 TYR 15 -13.187 16.035 -6.859
114 HD2 TYR 15 HD2 TYR 15 -14.720 12.278 -5.577
115 HE1 TYR 15 HE1 TYR 15 -13.455 15.350 -9.206
116 HE2 TYR 15 HE2 TYR 15 -14.991 11.582 -7.920
117 HH TYR 15 HH TYR 15 -14.445 12.081 -10.064
118 H GLN 16 H GLN 16 -17.139 13.800 -4.386
119 HA GLN 16 HA GLN 16 -17.155 12.610 -1.710
120 HB2 GLN 16 HB2 GLN 16 -19.180 13.674 -3.274
121 HB3 GLN 16 HB3 GLN 16 -19.403 11.937 -3.439
122 HG2 GLN 16 HG2 GLN 16 -20.210 11.742 -1.379
123 HG3 GLN 16 HG3 GLN 16 -18.924 12.732 -0.692
124 HE21 GLN 16 HE21 GLN 16 -19.410 14.707 -0.009
125 HE22 GLN 16 HE22 GLN 16 -20.897 15.534 -0.308
126 H GLU 17 H GLU 17 -16.511 11.860 -4.992
127 HA GLU 17 HA GLU 17 -15.814 9.961 -6.034
128 HB2 GLU 17 HB2 GLU 17 -15.620 8.742 -3.278
129 HB3 GLU 17 HB3 GLU 17 -14.778 8.225 -4.732
130 HG2 GLU 17 HG2 GLU 17 -14.372 10.856 -3.329
131 HG3 GLU 17 HG3 GLU 17 -13.323 9.446 -3.187
132 H LYS 18 H LYS 18 -16.352 7.548 -6.276
133 HA LYS 18 HA LYS 18 -18.925 6.742 -5.234
134 HB2 LYS 18 HB2 LYS 18 -18.790 8.127 -7.705
135 HB3 LYS 18 HB3 LYS 18 -19.127 6.441 -8.076
136 HG2 LYS 18 HG2 LYS 18 -21.259 6.970 -7.716
137 HG3 LYS 18 HG3 LYS 18 -20.842 6.937 -6.001
138 HD2 LYS 18 HD2 LYS 18 -21.927 8.999 -6.336
139 HD3 LYS 18 HD3 LYS 18 -20.206 9.387 -6.269
140 HE2 LYS 18 HE2 LYS 18 -20.079 9.769 -8.559
141 HE3 LYS 18 HE3 LYS 18 -21.546 8.851 -8.893
142 HZ1 LYS 18 HZ1 LYS 18 -21.679 11.373 -9.020
143 HZ2 LYS 18 HZ2 LYS 18 -22.887 10.582 -8.138
144 HZ3 LYS 18 HZ3 LYS 18 -21.619 11.358 -7.329
145 H SER 19 H SER 19 -16.070 5.842 -5.401
146 HA SER 19 HA SER 19 -16.655 3.080 -6.072
147 HB2 SER 19 HB2 SER 19 -15.163 4.777 -7.850
148 HB3 SER 19 HB3 SER 19 -14.104 3.520 -7.212
149 HG SER 19 HG SER 19 -16.422 3.281 -8.772
150 HA PRO 20 HA PRO 20 -14.022 2.219 -2.670
151 HB2 PRO 20 HB2 PRO 20 -12.918 -0.151 -3.402
152 HB3 PRO 20 HB3 PRO 20 -14.609 0.010 -2.912
153 HG2 PRO 20 HG2 PRO 20 -13.440 -0.135 -5.664
154 HG3 PRO 20 HG3 PRO 20 -14.886 -0.933 -5.019
155 HD2 PRO 20 HD2 PRO 20 -15.013 1.303 -6.541
156 HD3 PRO 20 HD3 PRO 20 -16.187 0.954 -5.256
157 H ARG 21 H ARG 21 -12.625 2.281 -5.872
158 HA ARG 21 HA ARG 21 -9.907 2.384 -4.840
159 HB2 ARG 21 HB2 ARG 21 -9.187 2.022 -6.995
160 HB3 ARG 21 HB3 ARG 21 -10.767 1.252 -7.054
161 HG2 ARG 21 HG2 ARG 21 -11.586 3.569 -7.879
162 HG3 ARG 21 HG3 ARG 21 -9.881 3.842 -8.244
163 HD2 ARG 21 HD2 ARG 21 -9.916 2.451 -10.002
164 HD3 ARG 21 HD3 ARG 21 -10.884 1.250 -9.149
165 HE ARG 21 HE ARG 21 -11.841 3.341 -10.890
166 HH11 ARG 21 HH11 ARG 21 -12.643 1.091 -8.358
167 HH12 ARG 21 HH12 ARG 21 -14.336 1.079 -8.726
168 HH21 ARG 21 HH21 ARG 21 -14.068 3.334 -11.385
169 HH22 ARG 21 HH22 ARG 21 -15.145 2.355 -10.448
170 H GLU 22 H GLU 22 -12.133 4.526 -4.569
171 HA GLU 22 HA GLU 22 -10.541 6.790 -5.578
172 HB2 GLU 22 HB2 GLU 22 -13.497 6.448 -5.163
173 HB3 GLU 22 HB3 GLU 22 -12.775 8.050 -5.204
174 HG2 GLU 22 HG2 GLU 22 -11.912 7.618 -7.439
175 HG3 GLU 22 HG3 GLU 22 -12.606 5.998 -7.400
176 H VAL 23 H VAL 23 -10.637 8.769 -4.229
177 HA VAL 23 HA VAL 23 -10.808 8.115 -1.359
178 HB VAL 23 HB VAL 23 -8.702 9.683 -2.826
179 HG11 VAL 23 HG11 VAL 23 -9.755 10.126 -0.128
180 HG12 VAL 23 HG12 VAL 23 -8.005 9.922 -0.204
181 HG13 VAL 23 HG13 VAL 23 -8.788 11.182 -1.158
182 HG21 VAL 23 HG21 VAL 23 -8.825 7.076 -1.890
183 HG22 VAL 23 HG22 VAL 23 -7.372 7.955 -2.365
184 HG23 VAL 23 HG23 VAL 23 -7.873 7.929 -0.674
185 H THR 24 H THR 24 -12.472 9.180 -0.522
186 HA THR 24 HA THR 24 -13.569 11.539 -1.697
187 HB THR 24 HB THR 24 -14.140 10.261 0.984
188 HG1 THR 24 HG1 THR 24 -15.270 8.917 -0.181
189 HG21 THR 24 HG21 THR 24 -16.318 11.773 -0.100
190 HG22 THR 24 HG22 THR 24 -15.494 11.968 1.447
191 HG23 THR 24 HG23 THR 24 -14.890 12.802 0.016
192 H MET 25 H MET 25 -13.033 13.593 -1.357
193 HA MET 25 HA MET 25 -11.597 14.290 1.114
194 HB2 MET 25 HB2 MET 25 -10.057 15.673 -0.068
195 HB3 MET 25 HB3 MET 25 -10.060 14.109 -0.872
196 HG2 MET 25 HG2 MET 25 -12.003 15.929 -2.014
197 HG3 MET 25 HG3 MET 25 -10.365 16.578 -2.063
198 HE1 MET 25 HE1 MET 25 -9.880 16.313 -4.941
199 HE2 MET 25 HE2 MET 25 -8.805 16.204 -3.548
200 HE3 MET 25 HE3 MET 25 -8.709 14.999 -4.832
201 H LYS 26 H LYS 26 -11.888 16.436 1.856
202 HA LYS 26 HA LYS 26 -14.289 17.741 0.756
203 HB2 LYS 26 HB2 LYS 26 -13.617 16.941 3.413
204 HB3 LYS 26 HB3 LYS 26 -13.714 18.697 3.374
205 HG2 LYS 26 HG2 LYS 26 -15.918 17.466 1.958
206 HG3 LYS 26 HG3 LYS 26 -15.821 16.928 3.636
207 HD2 LYS 26 HD2 LYS 26 -15.411 19.801 3.310
208 HD3 LYS 26 HD3 LYS 26 -16.997 19.252 2.763
209 HE2 LYS 26 HE2 LYS 26 -16.854 17.918 5.077
210 HE3 LYS 26 HE3 LYS 26 -15.823 19.289 5.483
211 HZ1 LYS 26 HZ1 LYS 26 -18.585 19.210 5.499
212 HZ2 LYS 26 HZ2 LYS 26 -17.599 20.567 5.721
213 HZ3 LYS 26 HZ3 LYS 26 -18.170 20.179 4.176
214 H LYS 27 H LYS 27 -14.064 19.700 -0.095
215 HA LYS 27 HA LYS 27 -11.763 20.982 -0.684
216 HB2 LYS 27 HB2 LYS 27 -14.106 21.607 -1.410
217 HB3 LYS 27 HB3 LYS 27 -14.256 22.492 0.103
218 HG2 LYS 27 HG2 LYS 27 -12.330 23.881 -0.546
219 HG3 LYS 27 HG3 LYS 27 -12.257 23.022 -2.086
220 HD2 LYS 27 HD2 LYS 27 -14.790 24.353 -1.198
221 HD3 LYS 27 HD3 LYS 27 -13.505 25.288 -1.965
222 HE2 LYS 27 HE2 LYS 27 -13.570 23.694 -3.872
223 HE3 LYS 27 HE3 LYS 27 -14.955 22.907 -3.117
224 HZ1 LYS 27 HZ1 LYS 27 -16.070 25.131 -3.192
225 HZ2 LYS 27 HZ2 LYS 27 -14.798 25.675 -4.166
226 HZ3 LYS 27 HZ3 LYS 27 -15.797 24.419 -4.702
227 H GLY 28 H GLY 28 -10.119 21.361 0.672
228 HA2 GLY 28 HA2 GLY 28 -9.140 22.960 2.180
229 HA3 GLY 28 HA3 GLY 28 -10.677 23.036 3.029
230 H ASP 29 H ASP 29 -9.424 19.957 2.058
231 HA ASP 29 HA ASP 29 -8.772 19.383 4.874
232 HB2 ASP 29 HB2 ASP 29 -9.880 17.565 2.728
233 HB3 ASP 29 HB3 ASP 29 -9.326 17.003 4.302
234 H ILE 30 H ILE 30 -7.383 17.183 4.860
235 HA ILE 30 HA ILE 30 -5.200 17.522 2.916
236 HB ILE 30 HB ILE 30 -5.073 17.929 5.770
237 HG12 ILE 30 HG12 ILE 30 -4.081 19.256 3.800
238 HG13 ILE 30 HG13 ILE 30 -3.084 19.064 5.237
239 HG21 ILE 30 HG21 ILE 30 -4.466 15.607 5.938
240 HG22 ILE 30 HG22 ILE 30 -3.288 15.781 4.636
241 HG23 ILE 30 HG23 ILE 30 -3.025 16.594 6.179
242 HD11 ILE 30 HD11 ILE 30 -2.756 17.006 3.161
243 HD12 ILE 30 HD12 ILE 30 -2.209 18.630 2.745
244 HD13 ILE 30 HD13 ILE 30 -1.554 17.815 4.166
245 H LEU 31 H LEU 31 -4.273 15.673 2.169
246 HA LEU 31 HA LEU 31 -5.136 13.130 3.368
247 HB2 LEU 31 HB2 LEU 31 -4.858 12.545 0.699
248 HB3 LEU 31 HB3 LEU 31 -6.380 12.765 1.562
249 HG LEU 31 HG LEU 31 -5.028 15.128 0.327
250 HD11 LEU 31 HD11 LEU 31 -5.318 13.059 -1.272
251 HD12 LEU 31 HD12 LEU 31 -7.003 13.579 -1.270
252 HD13 LEU 31 HD13 LEU 31 -5.739 14.688 -1.800
253 HD21 LEU 31 HD21 LEU 31 -6.991 16.154 0.684
254 HD22 LEU 31 HD22 LEU 31 -7.932 14.749 0.183
255 HD23 LEU 31 HD23 LEU 31 -7.283 14.837 1.821
256 H THR 32 H THR 32 -3.748 11.297 2.810
257 HA THR 32 HA THR 32 -0.951 12.150 2.633
258 HB THR 32 HB THR 32 -1.825 9.356 3.309
259 HG1 THR 32 HG1 THR 32 -1.805 11.642 5.002
260 HG21 THR 32 HG21 THR 32 0.497 10.975 4.345
261 HG22 THR 32 HG22 THR 32 0.256 9.231 4.452
262 HG23 THR 32 HG23 THR 32 0.590 9.981 2.891
263 H LEU 33 H LEU 33 -0.131 12.130 0.643
264 HA LEU 33 HA LEU 33 -1.173 10.690 -1.531
265 HB2 LEU 33 HB2 LEU 33 1.277 12.261 -0.991
266 HB3 LEU 33 HB3 LEU 33 1.324 11.157 -2.364
267 HG LEU 33 HG LEU 33 0.714 13.558 -2.867
268 HD11 LEU 33 HD11 LEU 33 -1.523 11.781 -3.709
269 HD12 LEU 33 HD12 LEU 33 -0.568 12.922 -4.656
270 HD13 LEU 33 HD13 LEU 33 0.125 11.371 -4.183
271 HD21 LEU 33 HD21 LEU 33 -0.726 14.016 -0.991
272 HD22 LEU 33 HD22 LEU 33 -1.657 14.155 -2.482
273 HD23 LEU 33 HD23 LEU 33 -1.824 12.721 -1.469
274 H LEU 34 H LEU 34 -0.518 8.816 -2.559
275 HA LEU 34 HA LEU 34 1.310 7.091 -1.021
276 HB2 LEU 34 HB2 LEU 34 -1.373 6.612 -2.131
277 HB3 LEU 34 HB3 LEU 34 -0.202 5.322 -2.403
278 HG LEU 34 HG LEU 34 -0.629 6.407 0.354
279 HD11 LEU 34 HD11 LEU 34 -2.792 5.838 0.204
280 HD12 LEU 34 HD12 LEU 34 -2.547 4.887 -1.261
281 HD13 LEU 34 HD13 LEU 34 -2.186 4.186 0.316
282 HD21 LEU 34 HD21 LEU 34 -0.114 3.958 0.839
283 HD22 LEU 34 HD22 LEU 34 0.357 3.842 -0.857
284 HD23 LEU 34 HD23 LEU 34 1.206 4.951 0.219
285 H ASN 35 H ASN 35 -0.160 7.289 -4.269
286 HA ASN 35 HA ASN 35 2.240 6.151 -5.441
287 HB2 ASN 35 HB2 ASN 35 0.063 5.388 -6.254
288 HB3 ASN 35 HB3 ASN 35 -0.359 7.035 -6.714
289 HD21 ASN 35 HD21 ASN 35 2.690 5.301 -7.116
290 HD22 ASN 35 HD22 ASN 35 2.717 5.391 -8.841
291 H SER 36 H SER 36 0.238 8.933 -6.417
292 HA SER 36 HA SER 36 0.783 11.030 -7.118
293 HB2 SER 36 HB2 SER 36 2.856 10.361 -5.203
294 HB3 SER 36 HB3 SER 36 3.480 11.411 -6.476
295 HG SER 36 HG SER 36 2.576 12.926 -5.330
296 H THR 37 H THR 37 1.555 8.433 -8.559
297 HA THR 37 HA THR 37 3.623 9.472 -10.357
298 HB THR 37 HB THR 37 2.400 6.708 -10.231
299 HG1 THR 37 HG1 THR 37 3.811 7.397 -8.443
300 HG21 THR 37 HG21 THR 37 3.317 6.387 -12.237
301 HG22 THR 37 HG22 THR 37 4.001 8.013 -12.231
302 HG23 THR 37 HG23 THR 37 4.900 6.675 -11.514
303 H ASN 38 H ASN 38 0.252 8.514 -10.266
304 HA ASN 38 HA ASN 38 -0.034 9.035 -13.130
305 HB2 ASN 38 HB2 ASN 38 -1.115 7.020 -12.418
306 HB3 ASN 38 HB3 ASN 38 -1.906 7.846 -11.079
307 HD21 ASN 38 HD21 ASN 38 -1.560 8.746 -14.483
308 HD22 ASN 38 HD22 ASN 38 -3.254 8.839 -14.810
309 H LYS 39 H LYS 39 -0.056 11.202 -13.434
310 HA LYS 39 HA LYS 39 -0.983 13.188 -11.785
311 HB2 LYS 39 HB2 LYS 39 0.237 13.756 -13.764
312 HB3 LYS 39 HB3 LYS 39 -0.986 13.032 -14.799
313 HG2 LYS 39 HG2 LYS 39 -2.569 14.764 -14.183
314 HG3 LYS 39 HG3 LYS 39 -1.388 15.472 -13.079
315 HD2 LYS 39 HD2 LYS 39 -0.369 16.566 -14.737
316 HD3 LYS 39 HD3 LYS 39 -0.305 15.120 -15.746
317 HE2 LYS 39 HE2 LYS 39 -2.863 15.616 -16.060
318 HE3 LYS 39 HE3 LYS 39 -2.388 17.249 -15.597
319 HZ1 LYS 39 HZ1 LYS 39 -2.355 16.912 -18.007
320 HZ2 LYS 39 HZ2 LYS 39 -0.820 17.296 -17.408
321 HZ3 LYS 39 HZ3 LYS 39 -1.189 15.699 -17.828
322 H ASP 40 H ASP 40 -2.840 11.499 -14.309
323 HA ASP 40 HA ASP 40 -5.251 12.793 -14.092
324 HB2 ASP 40 HB2 ASP 40 -5.058 9.797 -14.383
325 HB3 ASP 40 HB3 ASP 40 -6.267 10.879 -15.066
326 H TRP 41 H TRP 41 -4.079 10.088 -12.115
327 HA TRP 41 HA TRP 41 -5.946 10.894 -10.013
328 HB2 TRP 41 HB2 TRP 41 -5.799 8.165 -11.274
329 HB3 TRP 41 HB3 TRP 41 -6.375 8.381 -9.623
330 HD1 TRP 41 HD1 TRP 41 -7.376 8.989 -13.250
331 HE1 TRP 41 HE1 TRP 41 -9.867 9.632 -13.329
332 HE3 TRP 41 HE3 TRP 41 -8.239 9.510 -8.238
333 HZ2 TRP 41 HZ2 TRP 41 -11.925 10.275 -11.508
334 HZ3 TRP 41 HZ3 TRP 41 -10.496 10.142 -7.489
335 HH2 TRP 41 HH2 TRP 41 -12.300 10.517 -9.092
336 H TRP 42 H TRP 42 -4.784 11.225 -8.246
337 HA TRP 42 HA TRP 42 -2.246 9.806 -7.911
338 HB2 TRP 42 HB2 TRP 42 -3.398 12.310 -6.704
339 HB3 TRP 42 HB3 TRP 42 -2.004 11.509 -5.984
340 HD1 TRP 42 HD1 TRP 42 -0.804 10.736 -9.004
341 HE1 TRP 42 HE1 TRP 42 0.449 12.607 -10.250
342 HE3 TRP 42 HE3 TRP 42 -2.648 14.775 -6.470
343 HZ2 TRP 42 HZ2 TRP 42 0.632 15.423 -10.169
344 HZ3 TRP 42 HZ3 TRP 42 -1.883 17.023 -7.116
345 HH2 TRP 42 HH2 TRP 42 -0.276 17.338 -8.927
346 H LYS 43 H LYS 43 -2.462 7.914 -6.898
347 HA LYS 43 HA LYS 43 -4.544 7.192 -5.172
348 HB2 LYS 43 HB2 LYS 43 -3.196 5.516 -6.285
349 HB3 LYS 43 HB3 LYS 43 -1.754 6.061 -5.441
350 HG2 LYS 43 HG2 LYS 43 -3.383 5.484 -3.354
351 HG3 LYS 43 HG3 LYS 43 -3.914 4.294 -4.544
352 HD2 LYS 43 HD2 LYS 43 -0.999 4.598 -4.297
353 HD3 LYS 43 HD3 LYS 43 -1.808 3.955 -2.866
354 HE2 LYS 43 HE2 LYS 43 -1.110 2.142 -4.312
355 HE3 LYS 43 HE3 LYS 43 -2.870 2.234 -4.267
356 HZ1 LYS 43 HZ1 LYS 43 -2.807 3.423 -6.385
357 HZ2 LYS 43 HZ2 LYS 43 -1.123 3.271 -6.433
358 HZ3 LYS 43 HZ3 LYS 43 -2.099 1.891 -6.513
359 H VAL 44 H VAL 44 -4.907 7.502 -3.064
360 HA VAL 44 HA VAL 44 -2.700 8.284 -1.311
361 HB VAL 44 HB VAL 44 -3.845 10.175 -0.390
362 HG11 VAL 44 HG11 VAL 44 -2.650 10.228 -2.755
363 HG12 VAL 44 HG12 VAL 44 -4.262 10.715 -3.280
364 HG13 VAL 44 HG13 VAL 44 -3.408 11.662 -2.062
365 HG21 VAL 44 HG21 VAL 44 -6.099 9.503 -2.280
366 HG22 VAL 44 HG22 VAL 44 -6.127 9.371 -0.522
367 HG23 VAL 44 HG23 VAL 44 -6.006 10.957 -1.285
368 H GLU 45 H GLU 45 -3.530 8.442 1.027
369 HA GLU 45 HA GLU 45 -5.546 6.341 1.483
370 HB2 GLU 45 HB2 GLU 45 -3.441 5.371 2.024
371 HB3 GLU 45 HB3 GLU 45 -2.920 6.812 2.885
372 HG2 GLU 45 HG2 GLU 45 -4.400 6.384 4.682
373 HG3 GLU 45 HG3 GLU 45 -5.235 5.121 3.780
374 H VAL 46 H VAL 46 -7.216 6.919 2.704
375 HA VAL 46 HA VAL 46 -6.893 9.059 4.678
376 HB VAL 46 HB VAL 46 -9.177 9.941 3.939
377 HG11 VAL 46 HG11 VAL 46 -8.183 11.572 2.629
378 HG12 VAL 46 HG12 VAL 46 -6.813 10.923 3.530
379 HG13 VAL 46 HG13 VAL 46 -7.083 10.429 1.859
380 HG21 VAL 46 HG21 VAL 46 -8.430 8.694 1.305
381 HG22 VAL 46 HG22 VAL 46 -9.564 7.940 2.426
382 HG23 VAL 46 HG23 VAL 46 -9.925 9.524 1.739
383 H ASN 47 H ASN 47 -7.770 8.518 6.565
384 HA ASN 47 HA ASN 47 -8.744 7.138 8.126
385 HB2 ASN 47 HB2 ASN 47 -11.315 6.997 7.636
386 HB3 ASN 47 HB3 ASN 47 -10.573 8.557 7.981
387 HD21 ASN 47 HD21 ASN 47 -11.846 6.479 5.481
388 HD22 ASN 47 HD22 ASN 47 -12.084 7.719 4.301
389 H ASP 48 H ASP 48 -7.444 5.308 7.194
390 HA ASP 48 HA ASP 48 -7.227 3.197 6.317
391 HB2 ASP 48 HB2 ASP 48 -9.714 3.158 7.996
392 HB3 ASP 48 HB3 ASP 48 -9.189 1.698 7.162
393 H ARG 49 H ARG 49 -8.379 5.034 4.457
394 HA ARG 49 HA ARG 49 -9.765 3.114 2.748
395 HB2 ARG 49 HB2 ARG 49 -11.034 5.390 3.987
396 HB3 ARG 49 HB3 ARG 49 -11.039 5.567 2.237
397 HG2 ARG 49 HG2 ARG 49 -11.914 3.003 3.498
398 HG3 ARG 49 HG3 ARG 49 -13.014 4.379 3.398
399 HD2 ARG 49 HD2 ARG 49 -11.719 3.997 0.873
400 HD3 ARG 49 HD3 ARG 49 -12.428 2.474 1.407
401 HE ARG 49 HE ARG 49 -14.444 4.187 1.812
402 HH11 ARG 49 HH11 ARG 49 -12.339 3.695 -0.918
403 HH12 ARG 49 HH12 ARG 49 -13.524 4.181 -2.085
404 HH21 ARG 49 HH21 ARG 49 -16.012 4.830 0.285
405 HH22 ARG 49 HH22 ARG 49 -15.612 4.828 -1.399
406 H GLN 50 H GLN 50 -7.730 3.083 1.657
407 HA GLN 50 HA GLN 50 -6.897 5.550 0.339
408 HB2 GLN 50 HB2 GLN 50 -4.856 4.504 -0.115
409 HB3 GLN 50 HB3 GLN 50 -5.299 3.875 1.466
410 HG2 GLN 50 HG2 GLN 50 -4.889 1.869 0.606
411 HG3 GLN 50 HG3 GLN 50 -6.428 2.051 -0.235
412 HE21 GLN 50 HE21 GLN 50 -2.966 2.655 -0.536
413 HE22 GLN 50 HE22 GLN 50 -2.903 2.486 -2.254
414 H GLY 51 H GLY 51 -6.714 5.756 -1.914
415 HA2 GLY 51 HA2 GLY 51 -7.563 3.679 -3.695
416 HA3 GLY 51 HA3 GLY 51 -8.809 4.896 -3.462
417 H PHE 52 H PHE 52 -8.786 6.586 -4.785
418 HA PHE 52 HA PHE 52 -6.255 7.511 -5.909
419 HB2 PHE 52 HB2 PHE 52 -8.566 6.425 -7.483
420 HB3 PHE 52 HB3 PHE 52 -7.549 7.686 -8.173
421 HD1 PHE 52 HD1 PHE 52 -7.983 4.221 -7.784
422 HD2 PHE 52 HD2 PHE 52 -4.979 7.220 -8.095
423 HE1 PHE 52 HE1 PHE 52 -6.357 2.514 -8.491
424 HE2 PHE 52 HE2 PHE 52 -3.349 5.518 -8.803
425 HZ PHE 52 HZ PHE 52 -4.037 3.162 -9.002
426 H VAL 53 H VAL 53 -6.133 9.654 -5.836
427 HA VAL 53 HA VAL 53 -8.634 11.181 -5.530
428 HB VAL 53 HB VAL 53 -6.359 11.162 -3.911
429 HG11 VAL 53 HG11 VAL 53 -5.239 12.567 -5.608
430 HG12 VAL 53 HG12 VAL 53 -6.510 13.774 -5.411
431 HG13 VAL 53 HG13 VAL 53 -5.441 13.391 -4.061
432 HG21 VAL 53 HG21 VAL 53 -7.770 12.207 -2.527
433 HG22 VAL 53 HG22 VAL 53 -8.010 13.548 -3.647
434 HG23 VAL 53 HG23 VAL 53 -8.954 12.069 -3.826
435 HA PRO 54 HA PRO 54 -7.821 13.142 -9.395
436 HB2 PRO 54 HB2 PRO 54 -9.382 15.338 -9.062
437 HB3 PRO 54 HB3 PRO 54 -10.042 13.730 -9.383
438 HG2 PRO 54 HG2 PRO 54 -9.778 15.185 -6.780
439 HG3 PRO 54 HG3 PRO 54 -11.140 14.231 -7.395
440 HD2 PRO 54 HD2 PRO 54 -9.367 13.249 -5.600
441 HD3 PRO 54 HD3 PRO 54 -10.161 12.226 -6.814
442 H ALA 55 H ALA 55 -5.945 14.105 -9.836
443 HA ALA 55 HA ALA 55 -4.527 15.771 -8.072
444 HB1 ALA 55 HB1 ALA 55 -3.491 14.454 -9.887
445 HB2 ALA 55 HB2 ALA 55 -4.191 15.568 -11.061
446 HB3 ALA 55 HB3 ALA 55 -2.997 16.147 -9.900
447 H ALA 56 H ALA 56 -6.198 16.617 -11.111
448 HA ALA 56 HA ALA 56 -5.858 19.336 -11.094
449 HB1 ALA 56 HB1 ALA 56 -8.350 17.856 -11.929
450 HB2 ALA 56 HB2 ALA 56 -7.906 19.492 -12.414
451 HB3 ALA 56 HB3 ALA 56 -6.921 18.122 -12.927
452 H TYR 57 H TYR 57 -8.082 17.427 -9.168
453 HA TYR 57 HA TYR 57 -9.288 19.839 -8.043
454 HB2 TYR 57 HB2 TYR 57 -9.940 16.905 -7.765
455 HB3 TYR 57 HB3 TYR 57 -10.735 18.155 -6.814
456 HD1 TYR 57 HD1 TYR 57 -11.198 16.133 -9.525
457 HD2 TYR 57 HD2 TYR 57 -11.481 20.244 -8.467
458 HE1 TYR 57 HE1 TYR 57 -12.812 16.484 -11.348
459 HE2 TYR 57 HE2 TYR 57 -13.096 20.607 -10.287
460 HH TYR 57 HH TYR 57 -14.634 19.380 -11.656
461 H VAL 58 H VAL 58 -6.572 19.479 -7.463
462 HA VAL 58 HA VAL 58 -6.706 19.346 -4.560
463 HB VAL 58 HB VAL 58 -5.896 17.084 -5.809
464 HG11 VAL 58 HG11 VAL 58 -3.307 18.430 -5.102
465 HG12 VAL 58 HG12 VAL 58 -3.563 16.915 -5.969
466 HG13 VAL 58 HG13 VAL 58 -3.952 18.451 -6.743
467 HG21 VAL 58 HG21 VAL 58 -4.691 18.086 -3.234
468 HG22 VAL 58 HG22 VAL 58 -6.342 17.484 -3.386
469 HG23 VAL 58 HG23 VAL 58 -4.979 16.410 -3.702
470 H LYS 59 H LYS 59 -4.519 19.984 -3.602
471 HA LYS 59 HA LYS 59 -2.818 21.587 -5.297
472 HB2 LYS 59 HB2 LYS 59 -4.983 22.779 -3.764
473 HB3 LYS 59 HB3 LYS 59 -3.417 23.427 -3.296
474 HG2 LYS 59 HG2 LYS 59 -3.540 23.307 -6.138
475 HG3 LYS 59 HG3 LYS 59 -4.996 24.100 -5.534
476 HD2 LYS 59 HD2 LYS 59 -2.185 24.843 -4.729
477 HD3 LYS 59 HD3 LYS 59 -3.116 25.665 -5.983
478 HE2 LYS 59 HE2 LYS 59 -3.826 25.448 -3.060
479 HE3 LYS 59 HE3 LYS 59 -3.263 26.892 -3.900
480 HZ1 LYS 59 HZ1 LYS 59 -5.545 27.163 -3.822
481 HZ2 LYS 59 HZ2 LYS 59 -5.313 26.521 -5.370
482 HZ3 LYS 59 HZ3 LYS 59 -5.869 25.529 -4.118
483 H LYS 60 H LYS 60 -0.865 21.014 -4.628
484 HA LYS 60 HA LYS 60 -0.312 19.873 -2.108
485 HB2 LYS 60 HB2 LYS 60 0.989 19.811 -4.412
486 HB3 LYS 60 HB3 LYS 60 1.857 21.166 -3.702
487 HG2 LYS 60 HG2 LYS 60 1.583 18.431 -2.471
488 HG3 LYS 60 HG3 LYS 60 3.002 19.039 -3.328
489 HD2 LYS 60 HD2 LYS 60 2.668 21.008 -1.523
490 HD3 LYS 60 HD3 LYS 60 2.016 19.645 -0.610
491 HE2 LYS 60 HE2 LYS 60 4.536 19.093 -2.008
492 HE3 LYS 60 HE3 LYS 60 4.652 20.317 -0.745
493 HZ1 LYS 60 HZ1 LYS 60 3.144 18.005 0.049
494 HZ2 LYS 60 HZ2 LYS 60 4.746 17.638 -0.353
495 HZ3 LYS 60 HZ3 LYS 60 4.416 18.790 0.842
496 H LEU 61 H LEU 61 -1.008 21.253 -0.477
497 HA LEU 61 HA LEU 61 0.516 23.759 -0.196
498 HB2 LEU 61 HB2 LEU 61 -2.130 23.077 1.072
499 HB3 LEU 61 HB3 LEU 61 -1.294 24.627 1.136
500 HG LEU 61 HG LEU 61 -2.290 23.434 -1.441
501 HD11 LEU 61 HD11 LEU 61 -3.809 24.610 0.735
502 HD12 LEU 61 HD12 LEU 61 -3.995 25.499 -0.777
503 HD13 LEU 61 HD13 LEU 61 -4.366 23.776 -0.715
504 HD21 LEU 61 HD21 LEU 61 -0.936 25.112 -2.122
505 HD22 LEU 61 HD22 LEU 61 -2.351 26.096 -1.749
506 HD23 LEU 61 HD23 LEU 61 -1.034 25.967 -0.583
507 H ASP 62 H ASP 62 1.881 21.604 0.563
508 HA ASP 62 HA ASP 62 2.959 20.577 2.288
509 HB2 ASP 62 HB2 ASP 62 2.333 23.307 3.218
510 HB3 ASP 62 HB3 ASP 62 2.734 22.158 4.491
Start of MODEL 10
1 H1 MET 1 H MET 1 2.388 0.010 -3.186
2 HA MET 1 HA MET 1 0.677 2.133 -3.858
3 HB2 MET 1 HB2 MET 1 1.098 0.990 -1.095
4 HB3 MET 1 HB3 MET 1 -0.339 1.802 -1.701
5 HG2 MET 1 HG2 MET 1 -0.270 -0.161 -3.464
6 HG3 MET 1 HG3 MET 1 0.624 -0.961 -2.173
7 HE1 MET 1 HE1 MET 1 -0.748 -2.776 -1.716
8 HE2 MET 1 HE2 MET 1 -2.400 -2.785 -1.100
9 HE3 MET 1 HE3 MET 1 -2.102 -2.548 -2.822
10 H ASP 2 H ASP 2 2.598 2.045 -0.868
11 HA ASP 2 HA ASP 2 2.975 4.947 -1.126
12 HB2 ASP 2 HB2 ASP 2 1.838 4.157 0.921
13 HB3 ASP 2 HB3 ASP 2 3.255 3.190 1.321
14 H GLU 3 H GLU 3 4.627 3.701 -2.775
15 HA GLU 3 HA GLU 3 7.229 4.048 -1.489
16 HB2 GLU 3 HB2 GLU 3 6.221 1.515 -2.082
17 HB3 GLU 3 HB3 GLU 3 7.317 1.872 -3.410
18 HG2 GLU 3 HG2 GLU 3 8.952 2.562 -1.502
19 HG3 GLU 3 HG3 GLU 3 7.899 1.559 -0.505
20 H THR 4 H THR 4 5.788 5.781 -3.198
21 HA THR 4 HA THR 4 7.695 5.952 -5.408
22 HB THR 4 HB THR 4 4.897 6.633 -6.120
23 HG1 THR 4 HG1 THR 4 4.181 4.662 -5.895
24 HG21 THR 4 HG21 THR 4 6.204 6.959 -7.949
25 HG22 THR 4 HG22 THR 4 7.402 5.769 -7.440
26 HG23 THR 4 HG23 THR 4 5.894 5.239 -8.186
27 H GLY 5 H GLY 5 7.453 7.416 -2.941
28 HA2 GLY 5 HA2 GLY 5 8.061 9.703 -2.658
29 HA3 GLY 5 HA3 GLY 5 7.120 10.098 -4.089
30 H LYS 6 H LYS 6 7.098 9.723 -0.674
31 HA LYS 6 HA LYS 6 4.203 9.981 -0.488
32 HB2 LYS 6 HB2 LYS 6 4.552 9.783 1.934
33 HB3 LYS 6 HB3 LYS 6 5.322 8.463 1.064
34 HG2 LYS 6 HG2 LYS 6 7.356 10.253 1.212
35 HG3 LYS 6 HG3 LYS 6 6.498 10.574 2.720
36 HD2 LYS 6 HD2 LYS 6 6.584 8.150 3.231
37 HD3 LYS 6 HD3 LYS 6 7.544 7.907 1.770
38 HE2 LYS 6 HE2 LYS 6 9.237 9.472 2.683
39 HE3 LYS 6 HE3 LYS 6 8.295 9.576 4.169
40 HZ1 LYS 6 HZ1 LYS 6 8.635 7.247 4.553
41 HZ2 LYS 6 HZ2 LYS 6 9.426 7.060 3.069
42 HZ3 LYS 6 HZ3 LYS 6 10.141 7.976 4.299
43 H GLU 7 H GLU 7 3.187 11.863 -0.280
44 HA GLU 7 HA GLU 7 4.542 14.132 0.949
45 HB2 GLU 7 HB2 GLU 7 3.912 15.639 -0.906
46 HB3 GLU 7 HB3 GLU 7 5.077 14.417 -1.396
47 HG2 GLU 7 HG2 GLU 7 2.643 13.242 -1.942
48 HG3 GLU 7 HG3 GLU 7 2.399 14.934 -2.375
49 H LEU 8 H LEU 8 2.756 16.107 0.530
50 HA LEU 8 HA LEU 8 0.169 15.015 1.411
51 HB2 LEU 8 HB2 LEU 8 2.008 16.585 2.917
52 HB3 LEU 8 HB3 LEU 8 0.569 17.554 2.608
53 HG LEU 8 HG LEU 8 -0.826 15.958 3.716
54 HD11 LEU 8 HD11 LEU 8 0.240 13.944 4.802
55 HD12 LEU 8 HD12 LEU 8 0.074 13.879 3.048
56 HD13 LEU 8 HD13 LEU 8 1.640 14.240 3.773
57 HD21 LEU 8 HD21 LEU 8 -0.029 17.352 5.351
58 HD22 LEU 8 HD22 LEU 8 0.514 15.792 5.967
59 HD23 LEU 8 HD23 LEU 8 1.645 16.848 5.121
60 H VAL 9 H VAL 9 -1.668 16.284 0.924
61 HA VAL 9 HA VAL 9 -1.292 18.619 -0.785
62 HB VAL 9 HB VAL 9 -2.717 17.798 -2.551
63 HG11 VAL 9 HG11 VAL 9 -0.473 15.906 -1.868
64 HG12 VAL 9 HG12 VAL 9 -1.286 15.955 -3.432
65 HG13 VAL 9 HG13 VAL 9 -0.384 17.359 -2.863
66 HG21 VAL 9 HG21 VAL 9 -4.241 16.380 -1.435
67 HG22 VAL 9 HG22 VAL 9 -3.348 15.342 -2.546
68 HG23 VAL 9 HG23 VAL 9 -2.950 15.344 -0.827
69 H LEU 10 H LEU 10 -3.423 19.663 -1.305
70 HA LEU 10 HA LEU 10 -5.298 19.299 0.940
71 HB2 LEU 10 HB2 LEU 10 -4.204 21.742 -0.370
72 HB3 LEU 10 HB3 LEU 10 -5.828 21.795 0.312
73 HG LEU 10 HG LEU 10 -4.042 22.676 1.811
74 HD11 LEU 10 HD11 LEU 10 -6.277 21.409 2.460
75 HD12 LEU 10 HD12 LEU 10 -5.130 20.277 3.175
76 HD13 LEU 10 HD13 LEU 10 -5.130 21.967 3.678
77 HD21 LEU 10 HD21 LEU 10 -2.502 21.180 2.869
78 HD22 LEU 10 HD22 LEU 10 -3.201 19.791 2.037
79 HD23 LEU 10 HD23 LEU 10 -2.317 21.014 1.123
80 H ALA 11 H ALA 11 -7.475 19.289 0.525
81 HA ALA 11 HA ALA 11 -8.309 18.497 -2.066
82 HB1 ALA 11 HB1 ALA 11 -10.647 19.007 -0.867
83 HB2 ALA 11 HB2 ALA 11 -9.698 17.555 -0.548
84 HB3 ALA 11 HB3 ALA 11 -9.606 18.928 0.555
85 H LEU 12 H LEU 12 -8.387 19.858 -3.733
86 HA LEU 12 HA LEU 12 -8.875 22.675 -3.379
87 HB2 LEU 12 HB2 LEU 12 -7.302 21.670 -5.068
88 HB3 LEU 12 HB3 LEU 12 -8.724 21.138 -5.963
89 HG LEU 12 HG LEU 12 -7.574 23.256 -6.766
90 HD11 LEU 12 HD11 LEU 12 -10.203 22.453 -6.809
91 HD12 LEU 12 HD12 LEU 12 -10.302 24.122 -6.249
92 HD13 LEU 12 HD13 LEU 12 -9.499 23.750 -7.774
93 HD21 LEU 12 HD21 LEU 12 -9.102 24.755 -4.721
94 HD22 LEU 12 HD22 LEU 12 -7.575 24.033 -4.215
95 HD23 LEU 12 HD23 LEU 12 -7.608 25.175 -5.558
96 H TYR 13 H TYR 13 -10.698 19.864 -4.327
97 HA TYR 13 HA TYR 13 -13.116 21.512 -4.415
98 HB2 TYR 13 HB2 TYR 13 -12.609 21.273 -6.738
99 HB3 TYR 13 HB3 TYR 13 -12.249 19.561 -6.550
100 HD1 TYR 13 HD1 TYR 13 -15.143 21.700 -5.525
101 HD2 TYR 13 HD2 TYR 13 -13.801 18.289 -7.685
102 HE1 TYR 13 HE1 TYR 13 -17.471 21.155 -6.099
103 HE2 TYR 13 HE2 TYR 13 -16.125 17.735 -8.266
104 HH TYR 13 HH TYR 13 -18.369 19.210 -8.486
105 H ASP 14 H ASP 14 -14.843 20.600 -3.446
106 HA ASP 14 HA ASP 14 -14.508 18.368 -1.776
107 HB2 ASP 14 HB2 ASP 14 -17.129 19.542 -2.724
108 HB3 ASP 14 HB3 ASP 14 -16.864 18.590 -1.266
109 H TYR 15 H TYR 15 -14.073 16.418 -2.619
110 HA TYR 15 HA TYR 15 -15.774 15.441 -4.813
111 HB2 TYR 15 HB2 TYR 15 -13.026 15.494 -4.652
112 HB3 TYR 15 HB3 TYR 15 -13.403 13.845 -4.167
113 HD1 TYR 15 HD1 TYR 15 -13.989 16.336 -6.864
114 HD2 TYR 15 HD2 TYR 15 -13.924 12.223 -5.776
115 HE1 TYR 15 HE1 TYR 15 -14.266 15.713 -9.227
116 HE2 TYR 15 HE2 TYR 15 -14.199 11.589 -8.136
117 HH TYR 15 HH TYR 15 -14.014 12.396 -10.294
118 H GLN 16 H GLN 16 -17.260 13.983 -4.317
119 HA GLN 16 HA GLN 16 -17.103 12.598 -1.750
120 HB2 GLN 16 HB2 GLN 16 -19.316 13.152 -3.698
121 HB3 GLN 16 HB3 GLN 16 -19.492 11.878 -2.499
122 HG2 GLN 16 HG2 GLN 16 -20.492 13.984 -1.767
123 HG3 GLN 16 HG3 GLN 16 -19.181 13.466 -0.708
124 HE21 GLN 16 HE21 GLN 16 -19.329 15.234 -3.783
125 HE22 GLN 16 HE22 GLN 16 -18.400 16.587 -3.245
126 H GLU 17 H GLU 17 -15.711 11.962 -4.462
127 HA GLU 17 HA GLU 17 -15.226 10.130 -5.752
128 HB2 GLU 17 HB2 GLU 17 -14.522 8.234 -4.493
129 HB3 GLU 17 HB3 GLU 17 -14.201 9.652 -3.505
130 HG2 GLU 17 HG2 GLU 17 -16.023 9.202 -2.084
131 HG3 GLU 17 HG3 GLU 17 -16.692 8.008 -3.195
132 H LYS 18 H LYS 18 -15.978 7.430 -5.460
133 HA LYS 18 HA LYS 18 -18.771 7.062 -5.291
134 HB2 LYS 18 HB2 LYS 18 -17.753 8.077 -7.816
135 HB3 LYS 18 HB3 LYS 18 -18.548 6.521 -8.017
136 HG2 LYS 18 HG2 LYS 18 -20.566 7.414 -7.765
137 HG3 LYS 18 HG3 LYS 18 -20.076 8.310 -6.326
138 HD2 LYS 18 HD2 LYS 18 -19.298 10.131 -7.597
139 HD3 LYS 18 HD3 LYS 18 -19.302 9.194 -9.093
140 HE2 LYS 18 HE2 LYS 18 -21.871 9.563 -7.634
141 HE3 LYS 18 HE3 LYS 18 -21.217 10.926 -8.540
142 HZ1 LYS 18 HZ1 LYS 18 -22.217 10.006 -10.286
143 HZ2 LYS 18 HZ2 LYS 18 -20.989 8.842 -10.267
144 HZ3 LYS 18 HZ3 LYS 18 -22.464 8.529 -9.499
145 H SER 19 H SER 19 -15.779 6.014 -6.861
146 HA SER 19 HA SER 19 -16.625 3.225 -6.704
147 HB2 SER 19 HB2 SER 19 -14.881 4.716 -8.413
148 HB3 SER 19 HB3 SER 19 -13.946 3.437 -7.637
149 HG SER 19 HG SER 19 -16.451 2.952 -8.857
150 HA PRO 20 HA PRO 20 -14.310 2.133 -3.143
151 HB2 PRO 20 HB2 PRO 20 -13.196 -0.243 -3.841
152 HB3 PRO 20 HB3 PRO 20 -14.923 -0.050 -3.515
153 HG2 PRO 20 HG2 PRO 20 -13.491 -0.143 -6.142
154 HG3 PRO 20 HG3 PRO 20 -15.013 -0.921 -5.669
155 HD2 PRO 20 HD2 PRO 20 -14.934 1.364 -7.120
156 HD3 PRO 20 HD3 PRO 20 -16.238 1.008 -5.969
157 H ARG 21 H ARG 21 -12.606 2.276 -6.186
158 HA ARG 21 HA ARG 21 -10.004 2.295 -4.872
159 HB2 ARG 21 HB2 ARG 21 -9.060 1.943 -6.947
160 HB3 ARG 21 HB3 ARG 21 -10.623 1.166 -7.155
161 HG2 ARG 21 HG2 ARG 21 -11.410 3.390 -8.122
162 HG3 ARG 21 HG3 ARG 21 -9.699 3.816 -8.207
163 HD2 ARG 21 HD2 ARG 21 -10.564 2.878 -10.321
164 HD3 ARG 21 HD3 ARG 21 -9.254 1.921 -9.630
165 HE ARG 21 HE ARG 21 -10.712 0.175 -9.370
166 HH11 ARG 21 HH11 ARG 21 -12.516 3.095 -9.954
167 HH12 ARG 21 HH12 ARG 21 -14.035 2.279 -10.117
168 HH21 ARG 21 HH21 ARG 21 -12.706 -0.911 -9.583
169 HH22 ARG 21 HH22 ARG 21 -14.143 0.000 -9.905
170 H GLU 22 H GLU 22 -12.187 4.474 -4.793
171 HA GLU 22 HA GLU 22 -10.499 6.713 -5.691
172 HB2 GLU 22 HB2 GLU 22 -13.471 6.396 -5.436
173 HB3 GLU 22 HB3 GLU 22 -12.747 7.997 -5.378
174 HG2 GLU 22 HG2 GLU 22 -11.681 7.523 -7.576
175 HG3 GLU 22 HG3 GLU 22 -12.595 6.017 -7.636
176 H VAL 23 H VAL 23 -10.652 8.697 -4.338
177 HA VAL 23 HA VAL 23 -10.875 8.005 -1.480
178 HB VAL 23 HB VAL 23 -8.793 9.585 -2.937
179 HG11 VAL 23 HG11 VAL 23 -9.901 10.170 -0.248
180 HG12 VAL 23 HG12 VAL 23 -8.149 10.233 -0.442
181 HG13 VAL 23 HG13 VAL 23 -9.184 11.254 -1.440
182 HG21 VAL 23 HG21 VAL 23 -7.934 8.153 -0.603
183 HG22 VAL 23 HG22 VAL 23 -8.907 7.102 -1.632
184 HG23 VAL 23 HG23 VAL 23 -7.484 7.909 -2.290
185 H THR 24 H THR 24 -12.133 9.264 -0.250
186 HA THR 24 HA THR 24 -13.555 11.454 -1.525
187 HB THR 24 HB THR 24 -13.967 10.511 1.306
188 HG1 THR 24 HG1 THR 24 -14.476 8.654 0.406
189 HG21 THR 24 HG21 THR 24 -15.052 12.617 0.091
190 HG22 THR 24 HG22 THR 24 -16.155 11.377 -0.507
191 HG23 THR 24 HG23 THR 24 -15.960 11.621 1.229
192 H MET 25 H MET 25 -12.940 13.499 -1.343
193 HA MET 25 HA MET 25 -11.477 14.323 1.074
194 HB2 MET 25 HB2 MET 25 -9.971 15.645 -0.185
195 HB3 MET 25 HB3 MET 25 -10.027 14.086 -0.996
196 HG2 MET 25 HG2 MET 25 -12.016 15.862 -2.073
197 HG3 MET 25 HG3 MET 25 -10.418 16.602 -2.123
198 HE1 MET 25 HE1 MET 25 -8.719 16.204 -3.480
199 HE2 MET 25 HE2 MET 25 -8.570 15.040 -4.797
200 HE3 MET 25 HE3 MET 25 -9.698 16.388 -4.935
201 H LYS 26 H LYS 26 -11.737 16.534 1.691
202 HA LYS 26 HA LYS 26 -14.164 17.783 0.578
203 HB2 LYS 26 HB2 LYS 26 -13.320 17.268 3.370
204 HB3 LYS 26 HB3 LYS 26 -14.062 18.832 3.062
205 HG2 LYS 26 HG2 LYS 26 -15.771 17.145 1.775
206 HG3 LYS 26 HG3 LYS 26 -15.255 16.166 3.151
207 HD2 LYS 26 HD2 LYS 26 -16.848 17.259 4.288
208 HD3 LYS 26 HD3 LYS 26 -15.709 18.607 4.308
209 HE2 LYS 26 HE2 LYS 26 -16.805 19.730 2.620
210 HE3 LYS 26 HE3 LYS 26 -17.522 18.259 1.964
211 HZ1 LYS 26 HZ1 LYS 26 -18.760 18.249 4.234
212 HZ2 LYS 26 HZ2 LYS 26 -18.403 19.903 4.232
213 HZ3 LYS 26 HZ3 LYS 26 -19.314 19.232 2.973
214 H LYS 27 H LYS 27 -13.953 19.783 -0.193
215 HA LYS 27 HA LYS 27 -11.645 21.074 -0.732
216 HB2 LYS 27 HB2 LYS 27 -13.965 21.727 -1.474
217 HB3 LYS 27 HB3 LYS 27 -14.154 22.552 0.068
218 HG2 LYS 27 HG2 LYS 27 -12.207 23.965 -0.490
219 HG3 LYS 27 HG3 LYS 27 -12.131 23.183 -2.071
220 HD2 LYS 27 HD2 LYS 27 -13.715 24.528 -2.867
221 HD3 LYS 27 HD3 LYS 27 -14.805 24.095 -1.547
222 HE2 LYS 27 HE2 LYS 27 -13.975 25.824 -0.169
223 HE3 LYS 27 HE3 LYS 27 -12.584 26.095 -1.217
224 HZ1 LYS 27 HZ1 LYS 27 -13.817 27.729 -2.070
225 HZ2 LYS 27 HZ2 LYS 27 -14.676 26.513 -2.874
226 HZ3 LYS 27 HZ3 LYS 27 -15.259 27.136 -1.413
227 H GLY 28 H GLY 28 -10.021 21.326 0.694
228 HA2 GLY 28 HA2 GLY 28 -9.014 22.865 2.242
229 HA3 GLY 28 HA3 GLY 28 -10.571 23.016 3.042
230 H ASP 29 H ASP 29 -9.056 19.992 2.063
231 HA ASP 29 HA ASP 29 -8.549 19.371 4.893
232 HB2 ASP 29 HB2 ASP 29 -9.844 17.515 4.893
233 HB3 ASP 29 HB3 ASP 29 -10.667 18.312 3.555
234 H ILE 30 H ILE 30 -6.931 17.765 5.268
235 HA ILE 30 HA ILE 30 -4.926 17.706 3.137
236 HB ILE 30 HB ILE 30 -4.325 18.515 5.445
237 HG12 ILE 30 HG12 ILE 30 -2.230 16.976 5.542
238 HG13 ILE 30 HG13 ILE 30 -2.894 16.251 4.082
239 HG21 ILE 30 HG21 ILE 30 -3.924 16.832 7.175
240 HG22 ILE 30 HG22 ILE 30 -5.628 16.902 6.725
241 HG23 ILE 30 HG23 ILE 30 -4.611 15.592 6.127
242 HD11 ILE 30 HD11 ILE 30 -2.866 19.123 3.888
243 HD12 ILE 30 HD12 ILE 30 -1.262 18.486 4.255
244 HD13 ILE 30 HD13 ILE 30 -2.136 17.912 2.834
245 H LEU 31 H LEU 31 -4.037 15.829 2.344
246 HA LEU 31 HA LEU 31 -5.196 13.294 3.278
247 HB2 LEU 31 HB2 LEU 31 -4.660 13.779 0.374
248 HB3 LEU 31 HB3 LEU 31 -5.685 12.558 1.126
249 HG LEU 31 HG LEU 31 -6.430 15.445 1.335
250 HD11 LEU 31 HD11 LEU 31 -7.568 13.926 -0.920
251 HD12 LEU 31 HD12 LEU 31 -7.178 15.641 -0.782
252 HD13 LEU 31 HD13 LEU 31 -5.902 14.470 -1.113
253 HD21 LEU 31 HD21 LEU 31 -8.041 12.902 1.135
254 HD22 LEU 31 HD22 LEU 31 -7.644 13.747 2.631
255 HD23 LEU 31 HD23 LEU 31 -8.673 14.522 1.427
256 H THR 32 H THR 32 -3.916 11.411 2.819
257 HA THR 32 HA THR 32 -1.056 12.032 2.771
258 HB THR 32 HB THR 32 -2.164 9.299 3.330
259 HG1 THR 32 HG1 THR 32 -3.319 10.567 4.751
260 HG21 THR 32 HG21 THR 32 0.148 10.674 4.662
261 HG22 THR 32 HG22 THR 32 -0.162 8.947 4.483
262 HG23 THR 32 HG23 THR 32 0.333 9.904 3.086
263 H LEU 33 H LEU 33 -0.194 12.024 0.794
264 HA LEU 33 HA LEU 33 -1.244 10.626 -1.421
265 HB2 LEU 33 HB2 LEU 33 1.210 12.177 -0.836
266 HB3 LEU 33 HB3 LEU 33 1.268 11.081 -2.215
267 HG LEU 33 HG LEU 33 0.685 13.483 -2.722
268 HD11 LEU 33 HD11 LEU 33 -1.614 11.847 -3.611
269 HD12 LEU 33 HD12 LEU 33 -0.488 12.831 -4.546
270 HD13 LEU 33 HD13 LEU 33 -0.001 11.234 -3.978
271 HD21 LEU 33 HD21 LEU 33 -0.751 14.016 -0.893
272 HD22 LEU 33 HD22 LEU 33 -1.721 14.064 -2.364
273 HD23 LEU 33 HD23 LEU 33 -1.834 12.679 -1.278
274 H LEU 34 H LEU 34 -0.537 8.774 -2.480
275 HA LEU 34 HA LEU 34 1.242 7.022 -0.915
276 HB2 LEU 34 HB2 LEU 34 -1.436 6.574 -2.027
277 HB3 LEU 34 HB3 LEU 34 -0.278 5.288 -2.361
278 HG LEU 34 HG LEU 34 -0.173 6.012 0.419
279 HD11 LEU 34 HD11 LEU 34 -2.827 5.953 -0.785
280 HD12 LEU 34 HD12 LEU 34 -2.626 4.794 0.528
281 HD13 LEU 34 HD13 LEU 34 -2.314 6.507 0.809
282 HD21 LEU 34 HD21 LEU 34 0.607 3.905 -0.569
283 HD22 LEU 34 HD22 LEU 34 -0.578 3.634 0.709
284 HD23 LEU 34 HD23 LEU 34 -1.056 3.491 -0.983
285 H ASN 35 H ASN 35 -0.190 7.216 -4.181
286 HA ASN 35 HA ASN 35 2.225 6.087 -5.326
287 HB2 ASN 35 HB2 ASN 35 0.059 5.334 -6.175
288 HB3 ASN 35 HB3 ASN 35 -0.357 6.985 -6.626
289 HD21 ASN 35 HD21 ASN 35 2.697 5.255 -7.007
290 HD22 ASN 35 HD22 ASN 35 2.745 5.358 -8.731
291 H SER 36 H SER 36 0.247 8.885 -6.308
292 HA SER 36 HA SER 36 0.810 10.983 -6.990
293 HB2 SER 36 HB2 SER 36 2.857 10.292 -5.056
294 HB3 SER 36 HB3 SER 36 3.504 11.342 -6.317
295 HG SER 36 HG SER 36 2.065 12.058 -4.255
296 H THR 37 H THR 37 1.570 8.398 -8.448
297 HA THR 37 HA THR 37 3.665 9.438 -10.217
298 HB THR 37 HB THR 37 2.431 6.677 -10.134
299 HG1 THR 37 HG1 THR 37 4.641 7.852 -8.871
300 HG21 THR 37 HG21 THR 37 4.262 6.027 -11.599
301 HG22 THR 37 HG22 THR 37 3.314 7.311 -12.348
302 HG23 THR 37 HG23 THR 37 4.870 7.682 -11.606
303 H ASN 38 H ASN 38 0.291 8.482 -10.163
304 HA ASN 38 HA ASN 38 0.032 9.026 -13.026
305 HB2 ASN 38 HB2 ASN 38 -1.054 7.005 -12.337
306 HB3 ASN 38 HB3 ASN 38 -1.861 7.823 -11.002
307 HD21 ASN 38 HD21 ASN 38 -1.477 8.738 -14.399
308 HD22 ASN 38 HD22 ASN 38 -3.167 8.836 -14.744
309 H LYS 39 H LYS 39 0.030 11.201 -13.297
310 HA LYS 39 HA LYS 39 -0.917 13.172 -11.647
311 HB2 LYS 39 HB2 LYS 39 0.321 13.760 -13.606
312 HB3 LYS 39 HB3 LYS 39 -0.887 13.039 -14.662
313 HG2 LYS 39 HG2 LYS 39 -2.484 14.760 -14.051
314 HG3 LYS 39 HG3 LYS 39 -1.316 15.467 -12.932
315 HD2 LYS 39 HD2 LYS 39 -1.109 16.794 -14.834
316 HD3 LYS 39 HD3 LYS 39 0.220 15.644 -14.996
317 HE2 LYS 39 HE2 LYS 39 -2.435 15.031 -16.221
318 HE3 LYS 39 HE3 LYS 39 -1.338 16.148 -17.030
319 HZ1 LYS 39 HZ1 LYS 39 0.273 14.071 -16.415
320 HZ2 LYS 39 HZ2 LYS 39 -1.182 13.286 -16.775
321 HZ3 LYS 39 HZ3 LYS 39 -0.468 14.311 -17.917
322 H ASP 40 H ASP 40 -2.752 11.513 -14.207
323 HA ASP 40 HA ASP 40 -5.164 12.806 -13.996
324 HB2 ASP 40 HB2 ASP 40 -4.973 9.813 -14.318
325 HB3 ASP 40 HB3 ASP 40 -6.173 10.906 -15.003
326 H TRP 41 H TRP 41 -4.018 10.072 -12.044
327 HA TRP 41 HA TRP 41 -5.903 10.858 -9.949
328 HB2 TRP 41 HB2 TRP 41 -5.734 8.134 -11.224
329 HB3 TRP 41 HB3 TRP 41 -6.350 8.351 -9.588
330 HD1 TRP 41 HD1 TRP 41 -7.268 8.931 -13.235
331 HE1 TRP 41 HE1 TRP 41 -9.753 9.588 -13.375
332 HE3 TRP 41 HE3 TRP 41 -8.234 9.524 -8.250
333 HZ2 TRP 41 HZ2 TRP 41 -11.845 10.269 -11.607
334 HZ3 TRP 41 HZ3 TRP 41 -10.502 10.180 -7.558
335 HH2 TRP 41 HH2 TRP 41 -12.269 10.544 -9.203
336 H TRP 42 H TRP 42 -4.747 11.184 -8.178
337 HA TRP 42 HA TRP 42 -2.224 9.742 -7.824
338 HB2 TRP 42 HB2 TRP 42 -3.353 12.267 -6.642
339 HB3 TRP 42 HB3 TRP 42 -1.981 11.451 -5.897
340 HD1 TRP 42 HD1 TRP 42 -0.776 10.643 -8.917
341 HE1 TRP 42 HE1 TRP 42 0.532 12.486 -10.149
342 HE3 TRP 42 HE3 TRP 42 -2.536 14.719 -6.383
343 HZ2 TRP 42 HZ2 TRP 42 0.785 15.296 -10.058
344 HZ3 TRP 42 HZ3 TRP 42 -1.711 16.948 -7.017
345 HH2 TRP 42 HH2 TRP 42 -0.084 17.229 -8.816
346 H LYS 43 H LYS 43 -2.463 7.859 -6.802
347 HA LYS 43 HA LYS 43 -4.563 7.148 -5.103
348 HB2 LYS 43 HB2 LYS 43 -3.172 5.474 -6.176
349 HB3 LYS 43 HB3 LYS 43 -1.761 6.030 -5.286
350 HG2 LYS 43 HG2 LYS 43 -3.396 5.458 -3.235
351 HG3 LYS 43 HG3 LYS 43 -3.983 4.298 -4.429
352 HD2 LYS 43 HD2 LYS 43 -1.094 4.377 -4.371
353 HD3 LYS 43 HD3 LYS 43 -1.758 4.023 -2.774
354 HE2 LYS 43 HE2 LYS 43 -1.381 1.963 -3.988
355 HE3 LYS 43 HE3 LYS 43 -3.110 2.220 -3.762
356 HZ1 LYS 43 HZ1 LYS 43 -1.807 3.132 -6.238
357 HZ2 LYS 43 HZ2 LYS 43 -2.223 1.502 -6.061
358 HZ3 LYS 43 HZ3 LYS 43 -3.420 2.694 -5.978
359 H VAL 44 H VAL 44 -4.993 7.542 -3.028
360 HA VAL 44 HA VAL 44 -2.827 8.303 -1.215
361 HB VAL 44 HB VAL 44 -3.963 10.237 -0.366
362 HG11 VAL 44 HG11 VAL 44 -2.687 10.198 -2.708
363 HG12 VAL 44 HG12 VAL 44 -4.259 10.772 -3.264
364 HG13 VAL 44 HG13 VAL 44 -3.379 11.671 -2.028
365 HG21 VAL 44 HG21 VAL 44 -6.052 11.049 -1.569
366 HG22 VAL 44 HG22 VAL 44 -6.173 9.419 -2.232
367 HG23 VAL 44 HG23 VAL 44 -6.245 9.669 -0.487
368 H GLU 45 H GLU 45 -3.588 8.378 1.081
369 HA GLU 45 HA GLU 45 -5.716 6.384 1.509
370 HB2 GLU 45 HB2 GLU 45 -3.714 5.335 2.161
371 HB3 GLU 45 HB3 GLU 45 -3.086 6.799 2.904
372 HG2 GLU 45 HG2 GLU 45 -4.625 6.609 4.728
373 HG3 GLU 45 HG3 GLU 45 -5.448 5.259 3.949
374 H VAL 46 H VAL 46 -7.391 6.967 2.732
375 HA VAL 46 HA VAL 46 -7.097 9.090 4.712
376 HB VAL 46 HB VAL 46 -9.285 10.108 3.843
377 HG11 VAL 46 HG11 VAL 46 -8.002 11.775 3.101
378 HG12 VAL 46 HG12 VAL 46 -6.628 10.710 3.398
379 HG13 VAL 46 HG13 VAL 46 -7.348 10.793 1.790
380 HG21 VAL 46 HG21 VAL 46 -8.420 9.059 1.179
381 HG22 VAL 46 HG22 VAL 46 -9.509 8.113 2.194
382 HG23 VAL 46 HG23 VAL 46 -9.977 9.730 1.667
383 H ASN 47 H ASN 47 -8.307 8.750 6.486
384 HA ASN 47 HA ASN 47 -9.481 7.457 7.979
385 HB2 ASN 47 HB2 ASN 47 -11.953 7.209 7.111
386 HB3 ASN 47 HB3 ASN 47 -11.302 8.798 7.499
387 HD21 ASN 47 HD21 ASN 47 -12.193 6.610 4.942
388 HD22 ASN 47 HD22 ASN 47 -12.244 7.790 3.681
389 H ASP 48 H ASP 48 -7.979 5.632 7.243
390 HA ASP 48 HA ASP 48 -7.619 3.486 6.502
391 HB2 ASP 48 HB2 ASP 48 -9.350 3.545 8.591
392 HB3 ASP 48 HB3 ASP 48 -10.304 2.652 7.410
393 H ARG 49 H ARG 49 -8.661 5.112 4.439
394 HA ARG 49 HA ARG 49 -9.829 3.043 2.766
395 HB2 ARG 49 HB2 ARG 49 -11.350 5.295 3.798
396 HB3 ARG 49 HB3 ARG 49 -11.320 5.280 2.040
397 HG2 ARG 49 HG2 ARG 49 -12.059 2.867 3.669
398 HG3 ARG 49 HG3 ARG 49 -13.238 4.070 3.143
399 HD2 ARG 49 HD2 ARG 49 -11.658 3.366 0.898
400 HD3 ARG 49 HD3 ARG 49 -12.157 1.872 1.691
401 HE ARG 49 HE ARG 49 -13.839 3.741 0.289
402 HH11 ARG 49 HH11 ARG 49 -13.718 1.214 2.680
403 HH12 ARG 49 HH12 ARG 49 -15.386 0.781 2.495
404 HH21 ARG 49 HH21 ARG 49 -16.035 3.180 0.037
405 HH22 ARG 49 HH22 ARG 49 -16.702 1.899 0.991
406 H GLN 50 H GLN 50 -7.869 3.092 1.645
407 HA GLN 50 HA GLN 50 -7.098 5.601 0.359
408 HB2 GLN 50 HB2 GLN 50 -5.004 4.625 -0.073
409 HB3 GLN 50 HB3 GLN 50 -5.438 4.044 1.529
410 HG2 GLN 50 HG2 GLN 50 -5.068 1.987 0.816
411 HG3 GLN 50 HG3 GLN 50 -6.466 2.152 -0.245
412 HE21 GLN 50 HE21 GLN 50 -3.021 2.970 -0.095
413 HE22 GLN 50 HE22 GLN 50 -2.698 2.663 -1.764
414 H GLY 51 H GLY 51 -6.839 5.793 -1.895
415 HA2 GLY 51 HA2 GLY 51 -7.584 3.670 -3.674
416 HA3 GLY 51 HA3 GLY 51 -8.857 4.869 -3.499
417 H PHE 52 H PHE 52 -8.809 6.569 -4.815
418 HA PHE 52 HA PHE 52 -6.254 7.481 -5.903
419 HB2 PHE 52 HB2 PHE 52 -8.532 6.361 -7.485
420 HB3 PHE 52 HB3 PHE 52 -7.583 7.675 -8.172
421 HD1 PHE 52 HD1 PHE 52 -5.028 7.346 -8.240
422 HD2 PHE 52 HD2 PHE 52 -7.815 4.173 -7.704
423 HE1 PHE 52 HE1 PHE 52 -3.327 5.731 -8.983
424 HE2 PHE 52 HE2 PHE 52 -6.118 2.553 -8.445
425 HZ PHE 52 HZ PHE 52 -3.871 3.331 -9.086
426 H VAL 53 H VAL 53 -6.119 9.614 -5.738
427 HA VAL 53 HA VAL 53 -8.610 11.163 -5.495
428 HB VAL 53 HB VAL 53 -6.379 11.110 -3.829
429 HG11 VAL 53 HG11 VAL 53 -5.401 13.311 -3.957
430 HG12 VAL 53 HG12 VAL 53 -5.190 12.489 -5.503
431 HG13 VAL 53 HG13 VAL 53 -6.433 13.727 -5.325
432 HG21 VAL 53 HG21 VAL 53 -7.995 13.532 -3.623
433 HG22 VAL 53 HG22 VAL 53 -8.952 12.060 -3.795
434 HG23 VAL 53 HG23 VAL 53 -7.788 12.206 -2.478
435 HA PRO 54 HA PRO 54 -7.713 13.139 -9.334
436 HB2 PRO 54 HB2 PRO 54 -9.268 15.342 -9.019
437 HB3 PRO 54 HB3 PRO 54 -9.931 13.740 -9.362
438 HG2 PRO 54 HG2 PRO 54 -9.709 15.178 -6.745
439 HG3 PRO 54 HG3 PRO 54 -11.064 14.234 -7.392
440 HD2 PRO 54 HD2 PRO 54 -9.331 13.233 -5.569
441 HD3 PRO 54 HD3 PRO 54 -10.107 12.221 -6.805
442 H ALA 55 H ALA 55 -5.825 14.096 -9.736
443 HA ALA 55 HA ALA 55 -4.432 15.743 -7.934
444 HB1 ALA 55 HB1 ALA 55 -4.031 15.590 -10.918
445 HB2 ALA 55 HB2 ALA 55 -2.853 16.100 -9.709
446 HB3 ALA 55 HB3 ALA 55 -3.392 14.422 -9.761
447 H ALA 56 H ALA 56 -6.049 16.615 -10.995
448 HA ALA 56 HA ALA 56 -5.693 19.333 -10.956
449 HB1 ALA 56 HB1 ALA 56 -7.714 19.508 -12.313
450 HB2 ALA 56 HB2 ALA 56 -6.729 18.134 -12.815
451 HB3 ALA 56 HB3 ALA 56 -8.179 17.873 -11.844
452 H TYR 57 H TYR 57 -7.947 17.422 -9.071
453 HA TYR 57 HA TYR 57 -9.177 19.829 -7.963
454 HB2 TYR 57 HB2 TYR 57 -9.820 16.893 -7.719
455 HB3 TYR 57 HB3 TYR 57 -10.615 18.118 -6.737
456 HD1 TYR 57 HD1 TYR 57 -11.236 20.276 -8.456
457 HD2 TYR 57 HD2 TYR 57 -11.223 16.122 -9.374
458 HE1 TYR 57 HE1 TYR 57 -12.858 20.676 -10.261
459 HE2 TYR 57 HE2 TYR 57 -12.844 16.510 -11.183
460 HH TYR 57 HH TYR 57 -14.648 18.319 -11.678
461 H VAL 58 H VAL 58 -6.465 19.476 -7.348
462 HA VAL 58 HA VAL 58 -6.637 19.346 -4.446
463 HB VAL 58 HB VAL 58 -5.802 17.088 -5.679
464 HG11 VAL 58 HG11 VAL 58 -3.856 18.468 -6.599
465 HG12 VAL 58 HG12 VAL 58 -3.223 18.442 -4.954
466 HG13 VAL 58 HG13 VAL 58 -3.469 16.930 -5.828
467 HG21 VAL 58 HG21 VAL 58 -6.261 17.529 -3.250
468 HG22 VAL 58 HG22 VAL 58 -4.932 16.413 -3.566
469 HG23 VAL 58 HG23 VAL 58 -4.592 18.081 -3.105
470 H LYS 59 H LYS 59 -4.462 19.993 -3.462
471 HA LYS 59 HA LYS 59 -2.749 21.606 -5.134
472 HB2 LYS 59 HB2 LYS 59 -4.886 22.787 -3.486
473 HB3 LYS 59 HB3 LYS 59 -3.298 23.507 -3.256
474 HG2 LYS 59 HG2 LYS 59 -3.424 23.410 -5.958
475 HG3 LYS 59 HG3 LYS 59 -5.124 23.646 -5.548
476 HD2 LYS 59 HD2 LYS 59 -2.853 25.353 -4.530
477 HD3 LYS 59 HD3 LYS 59 -3.896 25.771 -5.891
478 HE2 LYS 59 HE2 LYS 59 -5.555 25.064 -3.701
479 HE3 LYS 59 HE3 LYS 59 -4.335 26.192 -3.111
480 HZ1 LYS 59 HZ1 LYS 59 -5.332 27.079 -5.597
481 HZ2 LYS 59 HZ2 LYS 59 -6.630 26.783 -4.552
482 HZ3 LYS 59 HZ3 LYS 59 -5.399 27.849 -4.092
483 H LYS 60 H LYS 60 -0.793 21.088 -4.435
484 HA LYS 60 HA LYS 60 -0.261 19.923 -1.922
485 HB2 LYS 60 HB2 LYS 60 1.083 19.936 -4.209
486 HB3 LYS 60 HB3 LYS 60 1.916 21.283 -3.444
487 HG2 LYS 60 HG2 LYS 60 1.665 18.497 -2.327
488 HG3 LYS 60 HG3 LYS 60 3.100 19.190 -3.087
489 HD2 LYS 60 HD2 LYS 60 2.610 21.056 -1.203
490 HD3 LYS 60 HD3 LYS 60 1.980 19.621 -0.390
491 HE2 LYS 60 HE2 LYS 60 4.617 19.378 -1.718
492 HE3 LYS 60 HE3 LYS 60 4.544 20.359 -0.255
493 HZ1 LYS 60 HZ1 LYS 60 5.074 18.073 0.269
494 HZ2 LYS 60 HZ2 LYS 60 3.557 18.471 0.903
495 HZ3 LYS 60 HZ3 LYS 60 3.668 17.531 -0.500
496 H LEU 61 H LEU 61 -0.994 21.252 -0.272
497 HA LEU 61 HA LEU 61 0.535 23.742 0.109
498 HB2 LEU 61 HB2 LEU 61 -2.208 23.195 1.217
499 HB3 LEU 61 HB3 LEU 61 -1.331 24.724 1.213
500 HG LEU 61 HG LEU 61 -2.111 23.437 -1.374
501 HD11 LEU 61 HD11 LEU 61 -4.039 25.378 -0.737
502 HD12 LEU 61 HD12 LEU 61 -4.277 23.644 -0.953
503 HD13 LEU 61 HD13 LEU 61 -3.944 24.294 0.652
504 HD21 LEU 61 HD21 LEU 61 -1.896 26.333 -0.570
505 HD22 LEU 61 HD22 LEU 61 -0.563 25.400 -1.250
506 HD23 LEU 61 HD23 LEU 61 -2.023 25.672 -2.200
507 H ASP 62 H ASP 62 1.862 21.708 0.998
508 HA ASP 62 HA ASP 62 1.702 21.957 3.880
509 HB2 ASP 62 HB2 ASP 62 0.252 19.963 3.145
510 HB3 ASP 62 HB3 ASP 62 1.772 19.174 2.733