NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
18705 |
2e0h   |
7330 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 VAL 1 H VAL 1 -14.005 1.409 5.503
2 HA VAL 1 HA VAL 1 -11.560 -0.161 5.582
3 HB VAL 1 HB VAL 1 -12.782 -2.288 5.160
4 HG11 VAL 1 1HG1 VAL 1 -11.711 -1.769 7.320
5 HG12 VAL 1 2HG1 VAL 1 -13.219 -1.026 7.896
6 HG13 VAL 1 3HG1 VAL 1 -13.161 -2.763 7.529
7 HG21 VAL 1 3HG2 VAL 1 -15.075 -2.550 6.007
8 HG22 VAL 1 1HG2 VAL 1 -15.209 -0.803 6.270
9 HG23 VAL 1 2HG2 VAL 1 -15.047 -1.456 4.623
10 H ARG 2 H ARG 2 -10.698 -0.064 3.579
11 HA ARG 2 HA ARG 2 -12.400 -0.389 1.213
12 HB3 ARG 2 HB2 ARG 2 -12.523 2.025 1.452
13 HG3 ARG 2 HG2 ARG 2 -9.518 1.869 1.942
14 HD3 ARG 2 HD2 ARG 2 -11.162 4.033 0.676
15 HE ARG 2 HE ARG 2 -10.608 5.508 2.305
16 HH11 ARG 2 2HH2 ARG 2 -7.871 3.257 2.344
17 HH12 ARG 2 1HH2 ARG 2 -6.934 4.386 3.337
18 HH21 ARG 2 1HH1 ARG 2 -9.407 6.785 3.418
19 HH22 ARG 2 2HH1 ARG 2 -7.823 6.332 3.996
20 H ASP 3 H ASP 3 -10.795 -0.124 -0.747
21 HA ASP 3 HA ASP 3 -8.317 -1.681 -0.189
22 HB3 ASP 3 HB2 ASP 3 -8.037 -1.569 -2.669
23 H ALA 4 H ALA 4 -6.276 -0.722 -0.761
24 HA ALA 4 HA ALA 4 -6.182 2.062 -1.679
25 HB1 ALA 4 HB3 ALA 4 -6.715 2.404 0.707
26 HB2 ALA 4 HB1 ALA 4 -5.431 1.265 1.159
27 HB3 ALA 4 HB2 ALA 4 -5.004 2.818 0.411
28 H TYR 5 H TYR 5 -4.170 2.508 -2.534
29 HA TYR 5 HA TYR 5 -1.934 0.608 -2.250
30 HB3 TYR 5 HB2 TYR 5 -0.653 2.430 -3.345
31 HD1 TYR 5 HD2 TYR 5 -1.114 0.070 -4.586
32 HD2 TYR 5 HD1 TYR 5 -3.399 3.688 -5.157
33 HE1 TYR 5 HE2 TYR 5 -1.866 -0.741 -6.807
34 HE2 TYR 5 HE1 TYR 5 -4.182 2.849 -7.341
35 HH TYR 5 HH TYR 5 -4.126 1.118 -8.860
36 H ILE 6 H ILE 6 -1.226 0.484 -0.047
37 HA ILE 6 HA ILE 6 -1.839 2.712 1.691
38 HB ILE 6 HB ILE 6 -1.978 0.362 2.358
39 HG13 ILE 6 2HG1 ILE 6 -1.935 2.103 4.007
40 HG21 ILE 6 1HG2 ILE 6 -0.047 -0.986 2.870
41 HG22 ILE 6 2HG2 ILE 6 0.082 -0.439 1.203
42 HG23 ILE 6 3HG2 ILE 6 1.064 0.328 2.449
43 HD11 ILE 6 3HD1 ILE 6 -1.702 -0.334 4.675
44 HD12 ILE 6 1HD1 ILE 6 0.021 -0.008 4.955
45 HD13 ILE 6 2HD1 ILE 6 -1.197 0.861 5.908
46 H ALA 7 H ALA 7 -0.441 4.141 2.686
47 HA ALA 7 HA ALA 7 2.302 4.414 1.502
48 HB1 ALA 7 HB3 ALA 7 0.333 6.608 2.265
49 HB2 ALA 7 HB1 ALA 7 1.986 6.843 1.656
50 HB3 ALA 7 HB2 ALA 7 0.751 6.110 0.610
51 H GLN 8 H GLN 8 3.823 5.604 2.888
52 HA GLN 8 HA GLN 8 3.435 4.939 5.763
53 HB3 GLN 8 HB2 GLN 8 5.329 4.021 4.608
54 HG3 GLN 8 HG2 GLN 8 6.848 6.602 4.616
55 HE21 GLN 8 1HE2 GLN 8 6.053 4.403 2.008
56 HE22 GLN 8 2HE2 GLN 8 7.639 3.694 1.805
57 H ASN 9 H ASN 9 5.015 7.694 4.133
58 HA ASN 9 HA ASN 9 3.663 9.843 5.335
59 HB3 ASN 9 HB2 ASN 9 6.099 10.027 6.818
60 HD21 ASN 9 1HD2 ASN 9 2.902 8.629 7.670
61 HD22 ASN 9 2HD2 ASN 9 2.402 10.017 8.642
62 H TYR 10 H TYR 10 5.882 10.900 2.615
63 HA TYR 10 HA TYR 10 3.074 10.251 3.421
64 HB3 TYR 10 HB2 TYR 10 3.251 12.798 2.090
65 HD1 TYR 10 HD1 TYR 10 0.806 12.299 2.503
66 HD2 TYR 10 HD2 TYR 10 3.604 12.743 5.755
67 HE1 TYR 10 HE1 TYR 10 -1.070 12.308 4.127
68 HE2 TYR 10 HE2 TYR 10 1.736 12.743 7.367
69 HH TYR 10 HH TYR 10 -0.557 12.602 7.647
70 H ASN 11 H ASN 11 1.989 9.313 1.862
71 HA ASN 11 HA ASN 11 1.379 8.552 -0.152
72 HB3 ASN 11 HB2 ASN 11 2.787 10.580 -1.784
73 HD21 ASN 11 1HD2 ASN 11 1.671 10.764 -3.661
74 HD22 ASN 11 2HD2 ASN 11 0.023 10.207 -3.922
75 H CYS 12 H CYS 12 4.105 7.848 0.973
76 HA CYS 12 HA CYS 12 5.503 6.979 -1.529
77 HB3 CYS 12 HB2 CYS 12 7.512 6.896 -0.208
78 H VAL 13 H VAL 13 5.667 4.789 -1.825
79 HA VAL 13 HA VAL 13 4.093 3.047 -0.077
80 HB VAL 13 HB VAL 13 4.408 1.357 -1.792
81 HG11 VAL 13 1HG1 VAL 13 3.672 4.038 -3.033
82 HG12 VAL 13 2HG1 VAL 13 3.161 2.434 -3.583
83 HG13 VAL 13 3HG1 VAL 13 2.599 3.047 -2.018
84 HG21 VAL 13 3HG2 VAL 13 5.559 1.837 -3.911
85 HG22 VAL 13 1HG2 VAL 13 6.139 3.386 -3.282
86 HG23 VAL 13 2HG2 VAL 13 6.698 1.861 -2.560
87 H TYR 14 H TYR 14 4.890 1.004 0.719
88 HA TYR 14 HA TYR 14 7.459 1.366 2.067
89 HB3 TYR 14 HB2 TYR 14 6.805 -0.612 3.317
90 HD1 TYR 14 HD1 TYR 14 3.485 0.676 2.235
91 HD2 TYR 14 HD2 TYR 14 6.630 0.877 5.181
92 HE1 TYR 14 HE1 TYR 14 1.987 1.883 3.767
93 HE2 TYR 14 HE2 TYR 14 5.045 1.917 6.780
94 HH TYR 14 HH TYR 14 1.905 3.164 5.737
95 H HIS 15 H HIS 15 8.916 -0.677 2.250
96 HA HIS 15 HA HIS 15 9.885 -1.025 -0.474
97 HB3 HIS 15 HB2 HIS 15 11.048 -1.952 2.172
98 HD1 HIS 15 HD1 HIS 15 11.784 -4.068 0.382
99 HD2 HIS 15 HD2 HIS 15 13.467 -0.246 -0.074
100 HE1 HIS 15 HE1 HIS 15 13.945 -4.369 -1.001
101 H CYS 16 H CYS 16 7.870 -2.304 -1.025
102 HA CYS 16 HA CYS 16 7.616 -5.003 -0.086
103 HB3 CYS 16 HB2 CYS 16 6.563 -3.899 -2.701
104 H ALA 17 H ALA 17 9.844 -5.616 -0.112
105 HA ALA 17 HA ALA 17 11.238 -6.356 -2.506
106 HB1 ALA 17 HB3 ALA 17 12.490 -7.888 -1.023
107 HB2 ALA 17 HB1 ALA 17 12.311 -6.286 -0.284
108 HB3 ALA 17 HB2 ALA 17 11.295 -7.634 0.267
109 H ARG 18 H ARG 18 8.750 -7.986 -0.554
110 HA ARG 18 HA ARG 18 8.354 -10.086 -2.632
111 HB3 ARG 18 HB2 ARG 18 7.975 -11.731 -0.851
112 HG3 ARG 18 HG2 ARG 18 10.175 -11.985 0.227
113 HD3 ARG 18 HD2 ARG 18 11.660 -12.018 -1.736
114 HE ARG 18 HE ARG 18 9.279 -13.411 -1.621
115 HH11 ARG 18 2HH2 ARG 18 11.352 -12.200 -4.197
116 HH12 ARG 18 1HH2 ARG 18 10.933 -13.428 -5.352
117 HH21 ARG 18 1HH1 ARG 18 8.670 -15.064 -3.130
118 HH22 ARG 18 2HH1 ARG 18 9.365 -15.101 -4.716
119 H ASP 19 H ASP 19 6.138 -10.294 -3.030
120 HA ASP 19 HA ASP 19 4.144 -8.601 -2.344
121 HB3 ASP 19 HB2 ASP 19 3.877 -11.633 -2.581
122 H ALA 20 H ALA 20 4.941 -11.524 -0.512
123 HA ALA 20 HA ALA 20 3.223 -11.454 1.608
124 HB1 ALA 20 HB3 ALA 20 6.195 -12.130 1.715
125 HB2 ALA 20 HB1 ALA 20 4.968 -12.639 2.895
126 HB3 ALA 20 HB2 ALA 20 4.884 -13.230 1.224
127 H TYR 21 H TYR 21 6.182 -9.406 1.346
128 HA TYR 21 HA TYR 21 6.274 -8.319 3.970
129 HB3 TYR 21 HB2 TYR 21 6.850 -7.065 1.272
130 HD1 TYR 21 HD2 TYR 21 6.020 -4.865 1.776
131 HD2 TYR 21 HD1 TYR 21 9.071 -6.758 4.165
132 HE1 TYR 21 HE2 TYR 21 6.872 -2.672 2.415
133 HE2 TYR 21 HE1 TYR 21 9.878 -4.541 4.880
134 HH TYR 21 HH TYR 21 9.688 -2.246 4.583
135 H CYS 22 H CYS 22 4.285 -7.439 1.126
136 HA CYS 22 HA CYS 22 3.192 -5.060 2.446
137 HB3 CYS 22 HB2 CYS 22 2.575 -6.560 -0.114
138 H ASN 23 H ASN 23 1.995 -8.373 1.647
139 HA ASN 23 HA ASN 23 -0.620 -7.987 2.762
140 HB3 ASN 23 HB2 ASN 23 1.052 -10.515 2.716
141 HD21 ASN 23 1HD2 ASN 23 0.156 -11.516 4.582
142 HD22 ASN 23 2HD2 ASN 23 -1.566 -11.801 4.731
143 H GLU 24 H GLU 24 2.473 -8.976 4.294
144 HA GLU 24 HA GLU 24 1.558 -9.367 6.924
145 HB3 GLU 24 HB2 GLU 24 4.238 -8.427 5.778
146 HG3 GLU 24 HG2 GLU 24 3.534 -9.478 8.521
147 H LEU 25 H LEU 25 3.072 -6.410 5.491
148 HA LEU 25 HA LEU 25 2.769 -4.776 7.711
149 HB3 LEU 25 HB2 LEU 25 2.514 -3.755 4.833
150 HG LEU 25 HG LEU 25 3.593 -2.667 7.452
151 HD11 LEU 25 1HD1 LEU 25 4.607 -1.882 4.693
152 HD12 LEU 25 2HD1 LEU 25 5.026 -1.118 6.250
153 HD13 LEU 25 3HD1 LEU 25 5.541 -2.774 5.918
154 HD21 LEU 25 3HD2 LEU 25 1.394 -1.861 6.539
155 HD22 LEU 25 1HD2 LEU 25 2.605 -0.574 6.624
156 HD23 LEU 25 2HD2 LEU 25 2.221 -1.333 5.065
157 H CYS 26 H CYS 26 0.582 -5.058 4.967
158 HA CYS 26 HA CYS 26 -1.568 -3.430 5.593
159 HB3 CYS 26 HB2 CYS 26 -1.418 -6.118 4.224
160 H THR 27 H THR 27 -1.195 -6.913 6.501
161 HA THR 27 HA THR 27 -3.595 -6.909 8.110
162 HB THR 27 HB THR 27 -2.679 -9.088 8.992
163 HG1 THR 27 HG1 THR 27 -0.717 -8.692 6.981
164 HG21 THR 27 3HG2 THR 27 -4.244 -8.957 7.113
165 HG22 THR 27 1HG2 THR 27 -2.901 -8.719 5.977
166 HG23 THR 27 2HG2 THR 27 -3.068 -10.259 6.847
167 H LYS 28 H LYS 28 -0.201 -6.147 8.824
168 HA LYS 28 HA LYS 28 -0.404 -6.134 11.633
169 HB3 LYS 28 HB2 LYS 28 1.219 -3.938 10.397
170 HG3 LYS 28 HG2 LYS 28 3.056 -4.965 11.606
171 HD3 LYS 28 HD2 LYS 28 1.167 -3.490 12.774
172 HE3 LYS 28 HE2 LYS 28 1.394 -5.507 14.963
173 HZ1 LYS 28 HZ3 LYS 28 -0.931 -4.062 13.875
174 HZ2 LYS 28 HZ1 LYS 28 -0.896 -4.870 15.306
175 HZ3 LYS 28 HZ2 LYS 28 0.017 -3.511 15.110
176 H ASN 29 H ASN 29 -1.283 -3.781 9.146
177 HA ASN 29 HA ASN 29 -2.094 -1.672 10.953
178 HB3 ASN 29 HB2 ASN 29 -2.942 -0.541 9.066
179 HD21 ASN 29 1HD2 ASN 29 -0.175 -1.087 9.912
180 HD22 ASN 29 2HD2 ASN 29 0.784 -1.058 8.449
181 H GLY 30 H GLY 30 -3.491 -4.721 10.530
182 HA2 GLY 30 HA2 GLY 30 -5.396 -5.529 11.477
183 HA3 GLY 30 HA3 GLY 30 -5.996 -3.893 11.782
184 H ALA 31 H ALA 31 -4.849 -4.583 8.504
185 HA ALA 31 HA ALA 31 -7.625 -4.414 7.521
186 HB1 ALA 31 HB3 ALA 31 -5.190 -3.466 6.558
187 HB2 ALA 31 HB1 ALA 31 -5.525 -4.913 5.568
188 HB3 ALA 31 HB2 ALA 31 -6.694 -3.600 5.650
189 H LYS 32 H LYS 32 -7.727 -5.908 5.376
190 HA LYS 32 HA LYS 32 -8.131 -8.598 6.417
191 HB3 LYS 32 HB2 LYS 32 -8.440 -7.426 3.610
192 HG3 LYS 32 HG2 LYS 32 -8.393 -10.054 3.873
193 HD3 LYS 32 HD2 LYS 32 -10.224 -9.507 5.862
194 HE3 LYS 32 HE2 LYS 32 -12.422 -10.323 5.061
195 HZ1 LYS 32 HZ3 LYS 32 -11.585 -7.952 3.435
196 HZ2 LYS 32 HZ1 LYS 32 -13.111 -8.482 3.628
197 HZ3 LYS 32 HZ2 LYS 32 -12.261 -7.878 4.864
198 H SER 33 H SER 33 -6.199 -7.253 3.736
199 HA SER 33 HA SER 33 -3.917 -8.964 3.940
200 HB3 SER 33 HB2 SER 33 -5.322 -10.838 3.390
201 HG SER 33 HG SER 33 -6.758 -10.677 1.556
202 H GLY 34 H GLY 34 -2.583 -8.838 1.871
203 HA2 GLY 34 HA2 GLY 34 -3.344 -6.605 0.093
204 HA3 GLY 34 HA3 GLY 34 -1.907 -6.379 1.128
205 H SER 35 H SER 35 -1.331 -6.250 -1.442
206 HA SER 35 HA SER 35 0.451 -8.393 -1.922
207 HB3 SER 35 HB2 SER 35 -1.380 -9.696 -2.691
208 HG SER 35 HG SER 35 -2.941 -8.841 -4.129
209 H CYS 36 H CYS 36 1.603 -7.962 -4.050
210 HA CYS 36 HA CYS 36 1.812 -4.986 -4.287
211 HB3 CYS 36 HB2 CYS 36 4.181 -5.368 -4.754
212 HA PRO 37 HA PRO 37 1.214 -5.934 -8.751
213 HB3 PRO 37 HB2 PRO 37 -0.636 -4.617 -8.893
214 HG3 PRO 37 HG2 PRO 37 -1.030 -2.840 -7.355
215 HD3 PRO 37 HD2 PRO 37 -0.605 -4.749 -5.992
216 H TYR 38 H TYR 38 3.427 -6.338 -8.599
217 HA TYR 38 HA TYR 38 5.492 -4.320 -8.993
218 HB3 TYR 38 HB2 TYR 38 6.690 -6.288 -10.056
219 HD1 TYR 38 HD1 TYR 38 5.485 -5.186 -6.869
220 HD2 TYR 38 HD2 TYR 38 7.573 -8.420 -8.827
221 HE1 TYR 38 HE1 TYR 38 6.479 -5.866 -4.720
222 HE2 TYR 38 HE2 TYR 38 8.487 -9.140 -6.641
223 HH TYR 38 HH TYR 38 8.792 -8.360 -4.289
224 H LEU 39 H LEU 39 4.273 -6.684 -11.356
225 HA LEU 39 HA LEU 39 4.504 -4.719 -13.567
226 HB3 LEU 39 HB2 LEU 39 4.103 -6.688 -14.979
227 HG LEU 39 HG LEU 39 6.168 -7.356 -12.823
228 HD11 LEU 39 1HD1 LEU 39 5.844 -8.378 -15.674
229 HD12 LEU 39 2HD1 LEU 39 7.168 -8.781 -14.561
230 HD13 LEU 39 3HD1 LEU 39 5.514 -9.299 -14.191
231 HD21 LEU 39 3HD2 LEU 39 7.799 -6.422 -14.473
232 HD22 LEU 39 1HD2 LEU 39 6.442 -5.858 -15.469
233 HD23 LEU 39 2HD2 LEU 39 6.704 -5.189 -13.841
234 H GLY 40 H GLY 40 2.717 -3.526 -12.235
235 HA2 GLY 40 HA2 GLY 40 0.176 -4.015 -13.549
236 HA3 GLY 40 HA3 GLY 40 0.152 -4.428 -11.821
237 H GLU 41 H GLU 41 -1.503 -2.611 -12.083
238 HA GLU 41 HA GLU 41 -1.052 0.015 -12.645
239 HB3 GLU 41 HB2 GLU 41 -2.883 0.541 -11.156
240 HG3 GLU 41 HG2 GLU 41 -3.223 -1.172 -13.213
241 H HIS 42 H HIS 42 -0.236 1.808 -11.639
242 HA HIS 42 HA HIS 42 1.055 3.095 -10.351
243 HB3 HIS 42 HB2 HIS 42 0.777 1.089 -8.096
244 HD1 HIS 42 HD1 HIS 42 3.366 3.112 -8.432
245 HD2 HIS 42 HD2 HIS 42 -0.141 3.542 -6.144
246 HE1 HIS 42 HE1 HIS 42 3.961 4.604 -6.445
247 H LYS 43 H LYS 43 1.999 -0.348 -10.460
248 HA LYS 43 HA LYS 43 3.854 -1.317 -11.061
249 HB3 LYS 43 HB2 LYS 43 5.074 1.387 -11.685
250 HG3 LYS 43 HG2 LYS 43 5.633 -1.455 -12.626
251 HD3 LYS 43 HD2 LYS 43 5.689 0.097 -14.546
252 HE3 LYS 43 HE2 LYS 43 7.772 1.564 -12.838
253 HZ1 LYS 43 HZ3 LYS 43 8.064 2.947 -14.758
254 HZ2 LYS 43 HZ1 LYS 43 8.491 1.403 -15.124
255 HZ3 LYS 43 HZ2 LYS 43 7.058 2.014 -15.662
256 H PHE 44 H PHE 44 4.468 -2.287 -9.245
257 HA PHE 44 HA PHE 44 5.533 -2.818 -7.337
258 HB3 PHE 44 HB2 PHE 44 7.675 -1.603 -6.737
259 HD1 PHE 44 HD2 PHE 44 7.270 -2.260 -10.422
260 HD2 PHE 44 HD1 PHE 44 8.660 -3.745 -6.621
261 HE1 PHE 44 HE2 PHE 44 8.376 -4.159 -11.567
262 HE2 PHE 44 HE1 PHE 44 9.758 -5.640 -7.767
263 HZ PHE 44 HZ PHE 44 9.642 -5.842 -10.243
264 H ALA 45 H ALA 45 3.355 -1.846 -6.851
265 HA ALA 45 HA ALA 45 3.793 0.118 -4.597
266 HB1 ALA 45 HB3 ALA 45 1.212 -0.460 -6.095
267 HB2 ALA 45 HB1 ALA 45 1.424 0.679 -4.745
268 HB3 ALA 45 HB2 ALA 45 2.254 0.970 -6.283
269 H CYS 46 H CYS 46 2.141 -0.322 -2.790
270 HA CYS 46 HA CYS 46 1.807 -3.255 -2.295
271 HB3 CYS 46 HB2 CYS 46 2.478 -1.004 -0.384
272 H TYR 47 H TYR 47 -0.245 -3.661 -2.818
273 HA TYR 47 HA TYR 47 -2.397 -1.720 -2.299
274 HB3 TYR 47 HB2 TYR 47 -3.187 -4.416 -3.194
275 HD1 TYR 47 HD2 TYR 47 -4.874 -1.983 -2.497
276 HD2 TYR 47 HD1 TYR 47 -3.124 -3.331 -6.212
277 HE1 TYR 47 HE2 TYR 47 -6.364 -0.483 -3.757
278 HE2 TYR 47 HE1 TYR 47 -4.717 -1.931 -7.463
279 HH TYR 47 HH TYR 47 -6.347 -0.325 -7.329
280 H CYS 48 H CYS 48 -3.657 -1.920 -0.509
281 HA CYS 48 HA CYS 48 -3.626 -4.409 1.144
282 HB3 CYS 48 HB2 CYS 48 -3.840 -1.555 2.073
283 H LYS 49 H LYS 49 -5.542 -4.787 2.105
284 HA LYS 49 HA LYS 49 -8.014 -3.770 0.735
285 HB3 LYS 49 HB2 LYS 49 -8.801 -6.046 0.546
286 HG3 LYS 49 HG2 LYS 49 -7.105 -7.169 -0.880
287 HD3 LYS 49 HD2 LYS 49 -7.284 -4.169 -1.377
288 HE3 LYS 49 HE2 LYS 49 -7.043 -6.457 -3.372
289 HZ1 LYS 49 HZ3 LYS 49 -6.910 -4.728 -4.962
290 HZ2 LYS 49 HZ1 LYS 49 -8.198 -4.342 -3.988
291 HZ3 LYS 49 HZ2 LYS 49 -6.800 -3.555 -3.806
292 H ASP 50 H ASP 50 -9.810 -3.578 2.018
293 HA ASP 50 HA ASP 50 -10.964 -3.039 3.848
294 HB3 ASP 50 HB2 ASP 50 -10.647 -4.590 5.889
295 H LEU 51 H LEU 51 -8.467 -1.672 3.325
296 HA LEU 51 HA LEU 51 -7.138 -1.213 5.871
297 HB3 LEU 51 HB2 LEU 51 -7.138 0.467 3.338
298 HG LEU 51 HG LEU 51 -6.203 1.494 5.513
299 HD11 LEU 51 1HD1 LEU 51 -3.953 0.776 6.203
300 HD12 LEU 51 2HD1 LEU 51 -5.064 -0.584 6.396
301 HD13 LEU 51 3HD1 LEU 51 -3.976 -0.527 5.005
302 HD21 LEU 51 3HD2 LEU 51 -4.316 1.112 3.157
303 HD22 LEU 51 1HD2 LEU 51 -5.621 2.323 3.274
304 HD23 LEU 51 2HD2 LEU 51 -4.232 2.411 4.356
305 HA PRO 52 HA PRO 52 -10.725 1.244 7.121
306 HB3 PRO 52 HB2 PRO 52 -10.269 0.702 9.295
307 HG3 PRO 52 HG2 PRO 52 -8.019 0.462 10.077
308 HD3 PRO 52 HD2 PRO 52 -8.213 -0.943 8.158
309 H ASP 53 H ASP 53 -11.427 3.307 6.669
310 HA ASP 53 HA ASP 53 -9.946 4.682 4.858
311 HB3 ASP 53 HB2 ASP 53 -12.277 5.796 6.443
312 H ASN 54 H ASN 54 -10.004 5.242 8.288
313 HA ASN 54 HA ASN 54 -8.818 7.686 8.739
314 HB3 ASN 54 HB2 ASN 54 -8.099 4.975 9.936
315 HD21 ASN 54 1HD2 ASN 54 -5.950 5.244 10.641
316 HD22 ASN 54 2HD2 ASN 54 -5.502 6.596 11.669
317 H VAL 55 H VAL 55 -7.171 4.778 7.403
318 HA VAL 55 HA VAL 55 -4.595 6.174 7.361
319 HB VAL 55 HB VAL 55 -5.331 3.465 6.238
320 HG11 VAL 55 1HG1 VAL 55 -2.630 4.716 6.947
321 HG12 VAL 55 2HG1 VAL 55 -2.882 3.064 6.362
322 HG13 VAL 55 3HG1 VAL 55 -3.228 4.434 5.297
323 HG21 VAL 55 3HG2 VAL 55 -4.141 4.222 8.943
324 HG22 VAL 55 1HG2 VAL 55 -5.729 3.473 8.667
325 HG23 VAL 55 2HG2 VAL 55 -4.256 2.569 8.301
326 HA PRO 56 HA PRO 56 -5.865 7.882 3.395
327 HB3 PRO 56 HB2 PRO 56 -4.586 9.724 3.982
328 HG3 PRO 56 HG2 PRO 56 -2.450 9.476 5.061
329 HD3 PRO 56 HD2 PRO 56 -4.076 8.367 6.407
330 H ILE 57 H ILE 57 -5.043 7.909 1.077
331 HA ILE 57 HA ILE 57 -3.895 5.260 0.354
332 HB ILE 57 HB ILE 57 -5.179 5.284 -1.592
333 HG13 ILE 57 2HG1 ILE 57 -6.725 6.992 -2.333
334 HG21 ILE 57 1HG2 ILE 57 -7.451 5.217 -0.799
335 HG22 ILE 57 2HG2 ILE 57 -6.357 4.666 0.481
336 HG23 ILE 57 3HG2 ILE 57 -7.073 6.273 0.575
337 HD11 ILE 57 3HD1 ILE 57 -7.012 8.336 -0.196
338 HD12 ILE 57 1HD1 ILE 57 -5.395 9.016 -0.498
339 HD13 ILE 57 2HD1 ILE 57 -6.696 9.266 -1.659
340 H ARG 58 H ARG 58 -2.457 5.187 -1.462
341 HA ARG 58 HA ARG 58 -0.715 7.446 -1.744
342 HB3 ARG 58 HB2 ARG 58 -0.730 5.146 -3.703
343 HG3 ARG 58 HG2 ARG 58 1.696 5.288 -3.350
344 HD3 ARG 58 HD2 ARG 58 0.445 7.956 -4.035
345 HE ARG 58 HE ARG 58 3.088 7.568 -3.668
346 HH11 ARG 58 2HH2 ARG 58 0.878 8.851 -6.061
347 HH12 ARG 58 1HH2 ARG 58 2.114 9.840 -6.838
348 HH21 ARG 58 1HH1 ARG 58 4.700 8.877 -4.744
349 HH22 ARG 58 2HH1 ARG 58 4.136 9.980 -5.985
350 H VAL 59 H VAL 59 -1.753 9.295 -2.644
351 HA VAL 59 HA VAL 59 -3.708 8.969 -4.793
352 HB VAL 59 HB VAL 59 -3.792 11.401 -4.894
353 HG11 VAL 59 1HG1 VAL 59 -5.124 10.176 -3.230
354 HG12 VAL 59 2HG1 VAL 59 -3.827 10.378 -2.030
355 HG13 VAL 59 3HG1 VAL 59 -4.683 11.797 -2.664
356 HG21 VAL 59 3HG2 VAL 59 -1.397 11.953 -4.424
357 HG22 VAL 59 1HG2 VAL 59 -2.565 12.869 -3.466
358 HG23 VAL 59 2HG2 VAL 59 -1.690 11.534 -2.717
359 HA PRO 60 HA PRO 60 -0.750 8.965 -8.105
360 HB3 PRO 60 HB2 PRO 60 -2.533 8.325 -9.422
361 HG3 PRO 60 HG2 PRO 60 -4.651 9.464 -9.335
362 HD3 PRO 60 HD2 PRO 60 -4.154 8.629 -7.164
363 H GLY 61 H GLY 61 0.201 10.797 -6.578
364 HA2 GLY 61 HA2 GLY 61 1.086 12.928 -8.426
365 HA3 GLY 61 HA3 GLY 61 0.303 13.429 -6.917
366 H LYS 62 H LYS 62 1.926 14.160 -5.667
367 HA LYS 62 HA LYS 62 4.672 13.479 -5.959
368 HB3 LYS 62 HB2 LYS 62 4.938 14.915 -3.945
369 HG3 LYS 62 HG2 LYS 62 4.648 15.997 -6.221
370 HD3 LYS 62 HD2 LYS 62 1.890 16.518 -5.008
371 HE3 LYS 62 HE2 LYS 62 3.350 18.110 -7.175
372 HZ1 LYS 62 HZ3 LYS 62 0.982 17.966 -7.580
373 HZ2 LYS 62 HZ1 LYS 62 0.647 18.493 -6.055
374 HZ3 LYS 62 HZ2 LYS 62 1.401 19.486 -7.122
375 H CYS 63 H CYS 63 5.994 13.045 -3.832
376 HA CYS 63 HA CYS 63 4.740 11.452 -1.781
377 HB3 CYS 63 HB2 CYS 63 6.589 10.288 -3.813
378 H HIS 64 H HIS 64 5.686 12.193 0.135
379 HA HIS 64 HA HIS 64 7.987 14.097 -0.151
380 HB3 HIS 64 HB2 HIS 64 7.005 15.325 1.650
381 HD1 HIS 64 HD1 HIS 64 3.577 15.180 1.507
382 HD2 HIS 64 HD2 HIS 64 6.463 15.645 -1.521
383 HE1 HIS 64 HE1 HIS 64 2.386 16.246 -0.484
Start of MODEL 2
1 H1 VAL 1 H VAL 1 -14.915 1.239 4.611
2 HA VAL 1 HA VAL 1 -12.205 0.699 5.219
3 HB VAL 1 HB VAL 1 -12.389 -1.797 4.996
4 HG11 VAL 1 1HG1 VAL 1 -13.745 -0.620 7.455
5 HG12 VAL 1 2HG1 VAL 1 -13.011 -2.232 7.331
6 HG13 VAL 1 3HG1 VAL 1 -11.993 -0.791 7.191
7 HG21 VAL 1 3HG2 VAL 1 -15.360 -1.349 5.553
8 HG22 VAL 1 1HG2 VAL 1 -14.662 -1.957 4.035
9 HG23 VAL 1 2HG2 VAL 1 -14.520 -2.907 5.518
10 H ARG 2 H ARG 2 -11.072 -0.089 3.331
11 HA ARG 2 HA ARG 2 -12.576 -0.558 0.869
12 HB3 ARG 2 HB2 ARG 2 -12.593 1.869 0.817
13 HG3 ARG 2 HG2 ARG 2 -9.642 1.665 1.575
14 HD3 ARG 2 HD2 ARG 2 -11.162 3.788 0.082
15 HE ARG 2 HE ARG 2 -10.646 5.335 1.665
16 HH11 ARG 2 2HH2 ARG 2 -7.951 3.059 1.870
17 HH12 ARG 2 1HH2 ARG 2 -7.023 4.201 2.859
18 HH21 ARG 2 1HH1 ARG 2 -9.458 6.643 2.759
19 HH22 ARG 2 2HH1 ARG 2 -7.912 6.188 3.422
20 H ASP 3 H ASP 3 -10.857 -0.663 -0.941
21 HA ASP 3 HA ASP 3 -8.439 -2.135 -0.019
22 HB3 ASP 3 HB2 ASP 3 -7.884 -2.103 -2.469
23 H ALA 4 H ALA 4 -6.326 -1.261 -0.615
24 HA ALA 4 HA ALA 4 -6.280 1.650 -1.144
25 HB1 ALA 4 HB3 ALA 4 -6.755 1.590 1.244
26 HB2 ALA 4 HB1 ALA 4 -5.440 0.420 1.490
27 HB3 ALA 4 HB2 ALA 4 -5.059 2.080 0.960
28 H TYR 5 H TYR 5 -4.552 2.213 -2.129
29 HA TYR 5 HA TYR 5 -2.122 0.541 -2.368
30 HB3 TYR 5 HB2 TYR 5 -1.308 2.550 -3.575
31 HD1 TYR 5 HD2 TYR 5 -3.238 -0.082 -4.201
32 HD2 TYR 5 HD1 TYR 5 -2.804 3.979 -5.581
33 HE1 TYR 5 HE2 TYR 5 -4.071 -0.749 -6.424
34 HE2 TYR 5 HE1 TYR 5 -3.531 3.284 -7.830
35 HH TYR 5 HH TYR 5 -4.424 1.564 -9.114
36 H ILE 6 H ILE 6 -1.973 0.342 0.020
37 HA ILE 6 HA ILE 6 -2.099 2.446 1.759
38 HB ILE 6 HB ILE 6 -2.041 0.065 2.356
39 HG13 ILE 6 2HG1 ILE 6 -1.765 1.947 3.999
40 HG21 ILE 6 1HG2 ILE 6 -0.117 -0.671 1.015
41 HG22 ILE 6 2HG2 ILE 6 0.992 0.276 2.013
42 HG23 ILE 6 3HG2 ILE 6 0.150 -1.094 2.708
43 HD11 ILE 6 3HD1 ILE 6 -2.107 -0.407 4.710
44 HD12 ILE 6 1HD1 ILE 6 -0.346 -0.606 4.822
45 HD13 ILE 6 2HD1 ILE 6 -1.168 0.561 5.871
46 H ALA 7 H ALA 7 -0.707 3.898 2.735
47 HA ALA 7 HA ALA 7 1.872 4.406 1.294
48 HB1 ALA 7 HB3 ALA 7 0.079 5.851 0.409
49 HB2 ALA 7 HB1 ALA 7 -0.265 6.438 2.052
50 HB3 ALA 7 HB2 ALA 7 1.303 6.786 1.288
51 H GLN 8 H GLN 8 3.193 6.048 2.458
52 HA GLN 8 HA GLN 8 2.861 6.220 5.390
53 HB3 GLN 8 HB2 GLN 8 4.339 4.358 5.326
54 HG3 GLN 8 HG2 GLN 8 5.706 5.761 3.002
55 HE21 GLN 8 1HE2 GLN 8 7.245 4.085 1.879
56 HE22 GLN 8 2HE2 GLN 8 8.475 3.468 2.980
57 H ASN 9 H ASN 9 4.657 7.720 6.188
58 HA ASN 9 HA ASN 9 4.621 10.302 5.523
59 HB3 ASN 9 HB2 ASN 9 6.889 10.476 6.427
60 HD21 ASN 9 1HD2 ASN 9 6.370 11.182 8.493
61 HD22 ASN 9 2HD2 ASN 9 5.354 10.280 9.602
62 H TYR 10 H TYR 10 6.217 10.827 2.318
63 HA TYR 10 HA TYR 10 3.595 10.737 3.774
64 HB3 TYR 10 HB2 TYR 10 4.488 13.309 2.532
65 HD1 TYR 10 HD2 TYR 10 2.043 13.670 2.338
66 HD2 TYR 10 HD1 TYR 10 3.934 12.866 6.129
67 HE1 TYR 10 HE2 TYR 10 -0.027 14.363 3.526
68 HE2 TYR 10 HE1 TYR 10 1.880 13.577 7.307
69 HH TYR 10 HH TYR 10 -0.292 14.340 7.085
70 H ASN 11 H ASN 11 2.617 9.475 2.377
71 HA ASN 11 HA ASN 11 1.223 9.072 0.603
72 HB3 ASN 11 HB2 ASN 11 2.728 10.869 -1.286
73 HD21 ASN 11 1HD2 ASN 11 1.693 11.149 -3.235
74 HD22 ASN 11 2HD2 ASN 11 0.185 10.344 -3.644
75 H CYS 12 H CYS 12 4.199 8.243 1.323
76 HA CYS 12 HA CYS 12 5.197 7.521 -1.385
77 HB3 CYS 12 HB2 CYS 12 7.236 6.925 -0.180
78 H VAL 13 H VAL 13 5.446 5.380 -2.012
79 HA VAL 13 HA VAL 13 3.745 3.403 -0.675
80 HB VAL 13 HB VAL 13 4.421 1.896 -2.461
81 HG11 VAL 13 1HG1 VAL 13 3.442 3.077 -4.342
82 HG12 VAL 13 2HG1 VAL 13 2.591 3.518 -2.851
83 HG13 VAL 13 3HG1 VAL 13 3.761 4.640 -3.581
84 HG21 VAL 13 3HG2 VAL 13 6.263 4.111 -3.472
85 HG22 VAL 13 1HG2 VAL 13 6.784 2.565 -2.769
86 HG23 VAL 13 2HG2 VAL 13 5.890 2.585 -4.293
87 H TYR 14 H TYR 14 4.944 1.114 -0.510
88 HA TYR 14 HA TYR 14 7.223 1.530 1.369
89 HB3 TYR 14 HB2 TYR 14 6.574 -0.714 2.202
90 HD1 TYR 14 HD2 TYR 14 3.345 0.974 1.391
91 HD2 TYR 14 HD1 TYR 14 6.528 0.545 4.272
92 HE1 TYR 14 HE2 TYR 14 1.978 2.116 3.090
93 HE2 TYR 14 HE1 TYR 14 5.087 1.574 6.003
94 HH TYR 14 HH TYR 14 1.959 3.060 5.248
95 H HIS 15 H HIS 15 9.015 0.271 1.204
96 HA HIS 15 HA HIS 15 9.934 -0.778 -1.287
97 HB3 HIS 15 HB2 HIS 15 11.462 0.076 0.348
98 HD1 HIS 15 HD1 HIS 15 13.158 -1.158 2.491
99 HD2 HIS 15 HD2 HIS 15 8.959 -1.434 2.532
100 HE1 HIS 15 HE1 HIS 15 12.464 -1.641 4.898
101 H CYS 16 H CYS 16 7.914 -2.071 -1.737
102 HA CYS 16 HA CYS 16 7.325 -4.390 -0.240
103 HB3 CYS 16 HB2 CYS 16 6.680 -3.868 -3.157
104 H ALA 17 H ALA 17 9.409 -5.253 0.234
105 HA ALA 17 HA ALA 17 11.121 -6.619 -1.474
106 HB1 ALA 17 HB3 ALA 17 11.578 -8.107 0.445
107 HB2 ALA 17 HB1 ALA 17 11.446 -6.414 0.964
108 HB3 ALA 17 HB2 ALA 17 10.101 -7.539 1.252
109 H ARG 18 H ARG 18 7.874 -7.672 -0.352
110 HA ARG 18 HA ARG 18 7.620 -9.447 -2.588
111 HB3 ARG 18 HB2 ARG 18 7.330 -10.831 0.090
112 HG3 ARG 18 HG2 ARG 18 6.705 -11.846 -2.214
113 HD3 ARG 18 HD2 ARG 18 9.729 -12.279 -2.335
114 HE ARG 18 HE ARG 18 8.031 -12.827 -4.641
115 HH11 ARG 18 2HH2 ARG 18 9.234 -14.248 -1.662
116 HH12 ARG 18 1HH2 ARG 18 9.021 -15.903 -2.150
117 HH21 ARG 18 1HH1 ARG 18 7.681 -15.003 -5.333
118 HH22 ARG 18 2HH1 ARG 18 8.109 -16.333 -4.307
119 H ASP 19 H ASP 19 5.394 -10.257 -2.735
120 HA ASP 19 HA ASP 19 3.322 -8.540 -1.922
121 HB3 ASP 19 HB2 ASP 19 3.205 -10.155 -3.810
122 H ALA 20 H ALA 20 4.523 -11.595 -0.549
123 HA ALA 20 HA ALA 20 2.881 -11.728 1.709
124 HB1 ALA 20 HB3 ALA 20 5.819 -12.534 1.524
125 HB2 ALA 20 HB1 ALA 20 4.650 -13.118 2.729
126 HB3 ALA 20 HB2 ALA 20 4.428 -13.519 1.013
127 H TYR 21 H TYR 21 5.833 -9.738 1.341
128 HA TYR 21 HA TYR 21 5.991 -9.009 4.155
129 HB3 TYR 21 HB2 TYR 21 7.231 -7.859 1.636
130 HD1 TYR 21 HD2 TYR 21 8.203 -8.079 5.263
131 HD2 TYR 21 HD1 TYR 21 7.435 -5.529 1.873
132 HE1 TYR 21 HE2 TYR 21 9.089 -6.133 6.516
133 HE2 TYR 21 HE1 TYR 21 8.315 -3.600 3.116
134 HH TYR 21 HH TYR 21 9.574 -2.936 5.026
135 H CYS 22 H CYS 22 4.705 -7.550 1.158
136 HA CYS 22 HA CYS 22 3.570 -5.195 2.367
137 HB3 CYS 22 HB2 CYS 22 2.982 -6.859 -0.072
138 H ASN 23 H ASN 23 2.170 -8.475 1.869
139 HA ASN 23 HA ASN 23 -0.362 -7.941 2.979
140 HB3 ASN 23 HB2 ASN 23 1.276 -10.510 2.958
141 HD21 ASN 23 1HD2 ASN 23 0.371 -11.192 5.046
142 HD22 ASN 23 2HD2 ASN 23 -1.315 -11.666 5.109
143 H GLU 24 H GLU 24 2.620 -9.152 4.576
144 HA GLU 24 HA GLU 24 1.753 -9.286 7.243
145 HB3 GLU 24 HB2 GLU 24 4.402 -8.684 5.878
146 HG3 GLU 24 HG2 GLU 24 3.903 -9.004 8.833
147 H LEU 25 H LEU 25 3.087 -6.464 5.416
148 HA LEU 25 HA LEU 25 2.902 -4.671 7.580
149 HB3 LEU 25 HB2 LEU 25 2.593 -3.905 4.636
150 HG LEU 25 HG LEU 25 3.328 -2.482 7.184
151 HD11 LEU 25 1HD1 LEU 25 4.650 -1.852 4.522
152 HD12 LEU 25 2HD1 LEU 25 4.818 -0.962 6.059
153 HD13 LEU 25 3HD1 LEU 25 5.469 -2.596 5.917
154 HD21 LEU 25 3HD2 LEU 25 2.327 -0.567 6.010
155 HD22 LEU 25 1HD2 LEU 25 2.204 -1.508 4.510
156 HD23 LEU 25 2HD2 LEU 25 1.222 -1.947 5.919
157 H CYS 26 H CYS 26 0.500 -5.423 5.040
158 HA CYS 26 HA CYS 26 -1.519 -3.613 5.732
159 HB3 CYS 26 HB2 CYS 26 -3.076 -5.210 4.648
160 H THR 27 H THR 27 -1.084 -7.021 6.948
161 HA THR 27 HA THR 27 -3.279 -6.825 8.793
162 HB THR 27 HB THR 27 -2.163 -8.847 9.820
163 HG1 THR 27 HG1 THR 27 -0.437 -9.694 8.566
164 HG21 THR 27 3HG2 THR 27 -2.653 -10.291 7.866
165 HG22 THR 27 1HG2 THR 27 -3.881 -9.023 8.023
166 HG23 THR 27 2HG2 THR 27 -2.611 -8.879 6.792
167 H LYS 28 H LYS 28 0.201 -6.069 9.113
168 HA LYS 28 HA LYS 28 0.162 -5.597 11.884
169 HB3 LYS 28 HB2 LYS 28 1.810 -3.851 10.032
170 HG3 LYS 28 HG2 LYS 28 3.141 -5.367 12.149
171 HD3 LYS 28 HD2 LYS 28 4.081 -3.335 11.084
172 HE3 LYS 28 HE2 LYS 28 2.160 -1.810 10.948
173 HZ1 LYS 28 HZ3 LYS 28 0.940 -2.354 12.887
174 HZ2 LYS 28 HZ1 LYS 28 2.155 -1.857 13.894
175 HZ3 LYS 28 HZ2 LYS 28 1.341 -0.774 12.956
176 H ASN 29 H ASN 29 -1.019 -3.594 9.216
177 HA ASN 29 HA ASN 29 -1.159 -1.168 10.951
178 HB3 ASN 29 HB2 ASN 29 -1.994 -0.131 8.779
179 HD21 ASN 29 1HD2 ASN 29 0.854 -2.276 8.407
180 HD22 ASN 29 2HD2 ASN 29 2.049 -1.006 8.593
181 H GLY 30 H GLY 30 -3.289 -3.379 9.167
182 HA2 GLY 30 HA2 GLY 30 -5.295 -3.961 10.618
183 HA3 GLY 30 HA3 GLY 30 -5.678 -2.233 10.582
184 H ALA 31 H ALA 31 -4.546 -4.596 8.100
185 HA ALA 31 HA ALA 31 -7.108 -4.276 6.614
186 HB1 ALA 31 HB3 ALA 31 -5.358 -4.565 4.582
187 HB2 ALA 31 HB1 ALA 31 -5.868 -2.979 5.181
188 HB3 ALA 31 HB2 ALA 31 -4.315 -3.659 5.694
189 H LYS 32 H LYS 32 -7.770 -6.223 5.627
190 HA LYS 32 HA LYS 32 -7.053 -8.450 7.220
191 HB3 LYS 32 HB2 LYS 32 -9.220 -8.124 6.160
192 HG3 LYS 32 HG2 LYS 32 -8.191 -9.450 3.606
193 HD3 LYS 32 HD2 LYS 32 -10.019 -7.674 2.817
194 HE3 LYS 32 HE2 LYS 32 -11.063 -10.132 4.253
195 HZ1 LYS 32 HZ3 LYS 32 -12.117 -8.767 1.869
196 HZ2 LYS 32 HZ1 LYS 32 -12.938 -9.749 2.918
197 HZ3 LYS 32 HZ2 LYS 32 -12.466 -8.206 3.335
198 H SER 33 H SER 33 -5.660 -7.445 4.133
199 HA SER 33 HA SER 33 -3.419 -9.072 4.299
200 HB3 SER 33 HB2 SER 33 -4.206 -11.106 3.680
201 HG SER 33 HG SER 33 -6.289 -10.767 4.019
202 H GLY 34 H GLY 34 -2.376 -9.139 1.870
203 HA2 GLY 34 HA2 GLY 34 -3.378 -7.005 0.155
204 HA3 GLY 34 HA3 GLY 34 -1.847 -6.616 0.970
205 H SER 35 H SER 35 -1.651 -6.552 -1.594
206 HA SER 35 HA SER 35 0.012 -8.869 -2.356
207 HB3 SER 35 HB2 SER 35 -2.165 -9.586 -3.166
208 HG SER 35 HG SER 35 -2.394 -6.852 -3.825
209 H CYS 36 H CYS 36 1.611 -8.161 -3.931
210 HA CYS 36 HA CYS 36 1.692 -5.209 -4.238
211 HB3 CYS 36 HB2 CYS 36 4.077 -5.599 -4.870
212 HA PRO 37 HA PRO 37 1.156 -6.015 -8.747
213 HB3 PRO 37 HB2 PRO 37 -0.606 -4.565 -8.918
214 HG3 PRO 37 HG2 PRO 37 -0.962 -2.843 -7.311
215 HD3 PRO 37 HD2 PRO 37 -0.747 -4.859 -6.063
216 H TYR 38 H TYR 38 3.332 -6.537 -8.754
217 HA TYR 38 HA TYR 38 5.479 -4.576 -8.708
218 HB3 TYR 38 HB2 TYR 38 6.376 -6.632 -10.292
219 HD1 TYR 38 HD1 TYR 38 5.375 -6.351 -6.662
220 HD2 TYR 38 HD2 TYR 38 8.516 -7.050 -9.529
221 HE1 TYR 38 HE1 TYR 38 7.055 -6.319 -4.836
222 HE2 TYR 38 HE2 TYR 38 10.177 -7.085 -7.697
223 HH TYR 38 HH TYR 38 9.319 -6.377 -4.317
224 H LEU 39 H LEU 39 3.216 -5.776 -11.122
225 HA LEU 39 HA LEU 39 4.300 -3.866 -13.142
226 HB3 LEU 39 HB2 LEU 39 3.502 -5.357 -14.872
227 HG LEU 39 HG LEU 39 5.849 -5.737 -13.563
228 HD11 LEU 39 1HD1 LEU 39 4.869 -7.501 -12.040
229 HD12 LEU 39 2HD1 LEU 39 4.459 -8.460 -13.470
230 HD13 LEU 39 3HD1 LEU 39 6.157 -8.126 -13.079
231 HD21 LEU 39 3HD2 LEU 39 5.507 -5.918 -15.987
232 HD22 LEU 39 1HD2 LEU 39 6.447 -7.294 -15.389
233 HD23 LEU 39 2HD2 LEU 39 4.726 -7.501 -15.779
234 H GLY 40 H GLY 40 2.445 -3.324 -14.726
235 HA2 GLY 40 HA2 GLY 40 0.321 -2.588 -15.167
236 HA3 GLY 40 HA3 GLY 40 -0.271 -3.653 -13.884
237 H GLU 41 H GLU 41 -1.670 -2.248 -12.938
238 HA GLU 41 HA GLU 41 -1.561 0.435 -12.554
239 HB3 GLU 41 HB2 GLU 41 -3.139 0.130 -10.729
240 HG3 GLU 41 HG2 GLU 41 -3.678 -0.514 -13.259
241 H HIS 42 H HIS 42 -0.282 1.755 -11.539
242 HA HIS 42 HA HIS 42 1.663 2.397 -10.652
243 HB3 HIS 42 HB2 HIS 42 -0.108 3.104 -9.104
244 HD1 HIS 42 HD1 HIS 42 -0.189 -0.332 -8.307
245 HD2 HIS 42 HD2 HIS 42 0.367 3.146 -6.013
246 HE1 HIS 42 HE1 HIS 42 -0.774 -0.937 -5.896
247 H LYS 43 H LYS 43 2.213 0.062 -11.687
248 HA LYS 43 HA LYS 43 3.411 -1.975 -10.692
249 HB3 LYS 43 HB2 LYS 43 3.680 -1.477 -12.959
250 HG3 LYS 43 HG2 LYS 43 5.564 0.811 -12.260
251 HD3 LYS 43 HD2 LYS 43 4.515 -0.277 -14.910
252 HE3 LYS 43 HE2 LYS 43 6.460 2.008 -14.293
253 HZ1 LYS 43 HZ3 LYS 43 6.983 0.856 -16.337
254 HZ2 LYS 43 HZ1 LYS 43 5.442 1.045 -16.888
255 HZ3 LYS 43 HZ2 LYS 43 6.400 2.359 -16.652
256 H PHE 44 H PHE 44 4.449 -2.481 -8.963
257 HA PHE 44 HA PHE 44 6.085 -2.778 -7.467
258 HB3 PHE 44 HB2 PHE 44 7.518 -0.228 -8.206
259 HD1 PHE 44 HD2 PHE 44 8.356 -0.196 -5.818
260 HD2 PHE 44 HD1 PHE 44 8.879 -3.655 -8.352
261 HE1 PHE 44 HE2 PHE 44 9.915 -1.177 -4.167
262 HE2 PHE 44 HE1 PHE 44 10.551 -4.553 -6.755
263 HZ PHE 44 HZ PHE 44 11.004 -3.371 -4.626
264 H ALA 45 H ALA 45 3.901 -2.311 -6.474
265 HA ALA 45 HA ALA 45 4.486 -0.558 -4.193
266 HB1 ALA 45 HB3 ALA 45 3.456 1.053 -5.733
267 HB2 ALA 45 HB1 ALA 45 2.135 -0.080 -6.038
268 HB3 ALA 45 HB2 ALA 45 2.304 0.681 -4.434
269 H CYS 46 H CYS 46 2.405 -0.679 -2.683
270 HA CYS 46 HA CYS 46 1.743 -3.580 -2.396
271 HB3 CYS 46 HB2 CYS 46 2.304 -1.390 -0.377
272 H TYR 47 H TYR 47 -0.352 -4.044 -2.682
273 HA TYR 47 HA TYR 47 -2.401 -1.921 -2.334
274 HB3 TYR 47 HB2 TYR 47 -2.426 -4.464 -3.994
275 HD1 TYR 47 HD1 TYR 47 -4.564 -1.682 -2.737
276 HD2 TYR 47 HD2 TYR 47 -3.983 -4.576 -5.893
277 HE1 TYR 47 HE1 TYR 47 -6.567 -0.870 -3.862
278 HE2 TYR 47 HE2 TYR 47 -6.204 -3.977 -6.814
279 HH TYR 47 HH TYR 47 -8.259 -1.458 -5.359
280 H CYS 48 H CYS 48 -3.059 -2.134 -0.255
281 HA CYS 48 HA CYS 48 -3.477 -4.748 1.050
282 HB3 CYS 48 HB2 CYS 48 -4.280 -3.340 2.941
283 H LYS 49 H LYS 49 -5.549 -5.288 2.024
284 HA LYS 49 HA LYS 49 -7.919 -4.077 0.706
285 HB3 LYS 49 HB2 LYS 49 -8.957 -6.357 0.824
286 HG3 LYS 49 HG2 LYS 49 -7.723 -5.104 -1.129
287 HD3 LYS 49 HD2 LYS 49 -6.341 -7.731 -1.436
288 HE3 LYS 49 HE2 LYS 49 -4.929 -6.430 -2.945
289 HZ1 LYS 49 HZ3 LYS 49 -6.486 -5.365 -4.421
290 HZ2 LYS 49 HZ1 LYS 49 -7.188 -6.748 -3.867
291 HZ3 LYS 49 HZ2 LYS 49 -7.647 -5.279 -3.287
292 H ASP 50 H ASP 50 -9.704 -3.914 1.769
293 HA ASP 50 HA ASP 50 -10.941 -3.163 3.516
294 HB3 ASP 50 HB2 ASP 50 -10.714 -5.000 5.549
295 H LEU 51 H LEU 51 -8.732 -1.759 3.310
296 HA LEU 51 HA LEU 51 -7.519 -1.388 5.964
297 HB3 LEU 51 HB2 LEU 51 -7.249 0.307 3.451
298 HG LEU 51 HG LEU 51 -6.304 1.212 5.664
299 HD11 LEU 51 1HD1 LEU 51 -4.151 0.243 6.429
300 HD12 LEU 51 2HD1 LEU 51 -5.438 -0.949 6.617
301 HD13 LEU 51 3HD1 LEU 51 -4.317 -1.076 5.255
302 HD21 LEU 51 3HD2 LEU 51 -5.479 2.000 3.492
303 HD22 LEU 51 1HD2 LEU 51 -4.144 1.866 4.640
304 HD23 LEU 51 2HD2 LEU 51 -4.343 0.622 3.409
305 HA PRO 52 HA PRO 52 -11.010 1.358 6.896
306 HB3 PRO 52 HB2 PRO 52 -10.581 1.088 9.118
307 HG3 PRO 52 HG2 PRO 52 -8.341 0.856 9.937
308 HD3 PRO 52 HD2 PRO 52 -8.669 -0.770 8.218
309 H ASP 53 H ASP 53 -11.637 3.368 6.162
310 HA ASP 53 HA ASP 53 -10.057 4.582 4.287
311 HB3 ASP 53 HB2 ASP 53 -12.441 5.793 5.720
312 H ASN 54 H ASN 54 -10.279 5.352 7.674
313 HA ASN 54 HA ASN 54 -9.057 7.771 8.080
314 HB3 ASN 54 HB2 ASN 54 -8.425 5.093 9.395
315 HD21 ASN 54 1HD2 ASN 54 -6.294 5.357 10.159
316 HD22 ASN 54 2HD2 ASN 54 -5.863 6.733 11.161
317 H VAL 55 H VAL 55 -7.395 4.790 6.918
318 HA VAL 55 HA VAL 55 -4.817 6.187 6.905
319 HB VAL 55 HB VAL 55 -5.484 3.406 5.927
320 HG11 VAL 55 1HG1 VAL 55 -3.008 3.080 6.232
321 HG12 VAL 55 2HG1 VAL 55 -3.365 4.297 4.993
322 HG13 VAL 55 3HG1 VAL 55 -2.843 4.797 6.617
323 HG21 VAL 55 3HG2 VAL 55 -5.968 3.584 8.341
324 HG22 VAL 55 1HG2 VAL 55 -4.487 2.660 8.081
325 HG23 VAL 55 2HG2 VAL 55 -4.389 4.350 8.616
326 HA PRO 56 HA PRO 56 -5.945 7.599 2.760
327 HB3 PRO 56 HB2 PRO 56 -4.814 9.549 3.344
328 HG3 PRO 56 HG2 PRO 56 -2.729 9.477 4.549
329 HD3 PRO 56 HD2 PRO 56 -4.359 8.359 5.876
330 H ILE 57 H ILE 57 -4.938 7.495 0.506
331 HA ILE 57 HA ILE 57 -3.419 4.968 0.124
332 HB ILE 57 HB ILE 57 -4.573 4.575 -1.842
333 HG13 ILE 57 2HG1 ILE 57 -6.280 5.984 -2.860
334 HG21 ILE 57 1HG2 ILE 57 -6.731 5.547 0.059
335 HG22 ILE 57 2HG2 ILE 57 -6.865 4.297 -1.188
336 HG23 ILE 57 3HG2 ILE 57 -5.812 4.048 0.215
337 HD11 ILE 57 3HD1 ILE 57 -5.283 8.346 -1.234
338 HD12 ILE 57 1HD1 ILE 57 -6.510 8.321 -2.496
339 HD13 ILE 57 2HD1 ILE 57 -6.843 7.536 -0.951
340 H ARG 58 H ARG 58 -2.037 4.985 -1.807
341 HA ARG 58 HA ARG 58 -0.341 7.229 -2.117
342 HB3 ARG 58 HB2 ARG 58 -0.903 4.837 -3.920
343 HG3 ARG 58 HG2 ARG 58 0.306 6.504 -5.272
344 HD3 ARG 58 HD2 ARG 58 2.246 6.390 -2.939
345 HE ARG 58 HE ARG 58 3.669 6.447 -4.793
346 HH11 ARG 58 2HH2 ARG 58 1.400 9.220 -5.020
347 HH12 ARG 58 1HH2 ARG 58 2.648 10.273 -5.640
348 HH21 ARG 58 1HH1 ARG 58 5.174 7.882 -5.854
349 HH22 ARG 58 2HH1 ARG 58 4.646 9.487 -6.280
350 H VAL 59 H VAL 59 -1.559 9.180 -2.641
351 HA VAL 59 HA VAL 59 -3.376 9.089 -4.926
352 HB VAL 59 HB VAL 59 -3.482 11.485 -4.874
353 HG11 VAL 59 1HG1 VAL 59 -3.704 10.264 -2.092
354 HG12 VAL 59 2HG1 VAL 59 -4.547 11.707 -2.687
355 HG13 VAL 59 3HG1 VAL 59 -4.908 10.122 -3.391
356 HG21 VAL 59 3HG2 VAL 59 -1.147 12.055 -4.169
357 HG22 VAL 59 1HG2 VAL 59 -2.414 12.881 -3.255
358 HG23 VAL 59 2HG2 VAL 59 -1.577 11.515 -2.519
359 HA PRO 60 HA PRO 60 -0.166 8.942 -7.914
360 HB3 PRO 60 HB2 PRO 60 -1.868 8.132 -9.263
361 HG3 PRO 60 HG2 PRO 60 -3.992 9.261 -9.436
362 HD3 PRO 60 HD2 PRO 60 -3.630 8.638 -7.175
363 H GLY 61 H GLY 61 0.731 10.860 -6.587
364 HA2 GLY 61 HA2 GLY 61 1.697 12.819 -8.545
365 HA3 GLY 61 HA3 GLY 61 0.720 13.509 -7.233
366 H LYS 62 H LYS 62 2.312 14.549 -6.087
367 HA LYS 62 HA LYS 62 4.947 13.755 -5.684
368 HB3 LYS 62 HB2 LYS 62 4.056 16.020 -5.287
369 HG3 LYS 62 HG2 LYS 62 2.942 14.862 -2.688
370 HD3 LYS 62 HD2 LYS 62 2.942 17.687 -3.847
371 HE3 LYS 62 HE2 LYS 62 0.844 17.239 -2.608
372 HZ1 LYS 62 HZ3 LYS 62 1.573 15.575 -1.057
373 HZ2 LYS 62 HZ1 LYS 62 2.669 16.593 -0.374
374 HZ3 LYS 62 HZ2 LYS 62 1.054 16.882 -0.205
375 H CYS 63 H CYS 63 6.058 13.150 -3.651
376 HA CYS 63 HA CYS 63 4.533 11.993 -1.514
377 HB3 CYS 63 HB2 CYS 63 5.690 10.266 -3.517
378 H HIS 64 H HIS 64 5.825 12.431 0.437
379 HA HIS 64 HA HIS 64 8.284 14.062 -0.118
380 HB3 HIS 64 HB2 HIS 64 7.918 15.030 2.043
381 HD1 HIS 64 HD1 HIS 64 7.012 17.372 1.580
382 HD2 HIS 64 HD2 HIS 64 4.442 14.295 0.299
383 HE1 HIS 64 HE1 HIS 64 4.914 18.493 0.664
Start of MODEL 3
1 H1 VAL 1 H VAL 1 -15.165 0.603 4.431
2 HA VAL 1 HA VAL 1 -12.511 1.083 5.186
3 HB VAL 1 HB VAL 1 -11.626 -1.199 5.031
4 HG11 VAL 1 1HG1 VAL 1 -12.226 -0.292 7.273
5 HG12 VAL 1 2HG1 VAL 1 -13.791 -1.118 7.167
6 HG13 VAL 1 3HG1 VAL 1 -12.288 -2.060 7.191
7 HG21 VAL 1 3HG2 VAL 1 -14.527 -2.150 4.969
8 HG22 VAL 1 1HG2 VAL 1 -13.360 -2.284 3.636
9 HG23 VAL 1 2HG2 VAL 1 -13.097 -3.185 5.133
10 H ARG 2 H ARG 2 -11.047 0.515 3.180
11 HA ARG 2 HA ARG 2 -12.570 -0.175 0.760
12 HB3 ARG 2 HB2 ARG 2 -12.690 2.301 0.912
13 HG3 ARG 2 HG2 ARG 2 -10.682 3.572 0.433
14 HD3 ARG 2 HD2 ARG 2 -9.909 2.426 3.087
15 HE ARG 2 HE ARG 2 -10.921 5.135 2.843
16 HH11 ARG 2 2HH2 ARG 2 -7.939 3.225 2.746
17 HH12 ARG 2 1HH2 ARG 2 -6.998 4.489 3.530
18 HH21 ARG 2 1HH1 ARG 2 -9.623 6.812 3.623
19 HH22 ARG 2 2HH1 ARG 2 -8.076 6.415 4.171
20 H ASP 3 H ASP 3 -11.115 -0.715 -1.022
21 HA ASP 3 HA ASP 3 -8.577 -1.889 0.007
22 HB3 ASP 3 HB2 ASP 3 -8.466 -3.110 -2.056
23 H ALA 4 H ALA 4 -6.586 -1.037 -0.664
24 HA ALA 4 HA ALA 4 -6.490 1.056 -2.706
25 HB1 ALA 4 HB3 ALA 4 -7.648 2.321 -0.988
26 HB2 ALA 4 HB1 ALA 4 -6.484 1.784 0.239
27 HB3 ALA 4 HB2 ALA 4 -5.962 2.860 -1.075
28 H TYR 5 H TYR 5 -4.395 2.122 -2.746
29 HA TYR 5 HA TYR 5 -2.172 0.315 -2.251
30 HB3 TYR 5 HB2 TYR 5 -0.837 2.187 -3.106
31 HD1 TYR 5 HD1 TYR 5 -0.774 0.370 -4.856
32 HD2 TYR 5 HD2 TYR 5 -3.850 3.389 -4.766
33 HE1 TYR 5 HE1 TYR 5 -1.318 -0.120 -7.204
34 HE2 TYR 5 HE2 TYR 5 -4.358 2.944 -7.138
35 HH TYR 5 HH TYR 5 -3.812 1.735 -9.012
36 H ILE 6 H ILE 6 -1.712 0.018 -0.015
37 HA ILE 6 HA ILE 6 -2.180 2.056 1.910
38 HB ILE 6 HB ILE 6 -2.009 -0.275 2.462
39 HG13 ILE 6 2HG1 ILE 6 -1.354 1.682 4.063
40 HG21 ILE 6 1HG2 ILE 6 -0.304 -1.132 0.987
41 HG22 ILE 6 2HG2 ILE 6 0.939 -0.086 1.677
42 HG23 ILE 6 3HG2 ILE 6 0.274 -1.403 2.633
43 HD11 ILE 6 3HD1 ILE 6 -2.274 -0.415 4.838
44 HD12 ILE 6 1HD1 ILE 6 -0.706 -1.224 4.658
45 HD13 ILE 6 2HD1 ILE 6 -0.904 0.068 5.864
46 H ALA 7 H ALA 7 -0.811 3.623 2.860
47 HA ALA 7 HA ALA 7 1.830 4.049 1.605
48 HB1 ALA 7 HB3 ALA 7 -0.398 6.135 1.676
49 HB2 ALA 7 HB1 ALA 7 1.271 6.389 1.113
50 HB3 ALA 7 HB2 ALA 7 0.191 5.297 0.228
51 H GLN 8 H GLN 8 3.137 5.519 2.703
52 HA GLN 8 HA GLN 8 2.472 6.077 5.561
53 HB3 GLN 8 HB2 GLN 8 4.073 4.328 5.610
54 HG3 GLN 8 HG2 GLN 8 5.595 5.852 3.453
55 HE21 GLN 8 1HE2 GLN 8 7.275 4.042 2.502
56 HE22 GLN 8 2HE2 GLN 8 8.389 3.518 3.756
57 H ASN 9 H ASN 9 4.090 7.719 6.384
58 HA ASN 9 HA ASN 9 3.663 10.280 5.572
59 HB3 ASN 9 HB2 ASN 9 4.512 9.897 7.654
60 HD21 ASN 9 1HD2 ASN 9 7.845 9.890 6.589
61 HD22 ASN 9 2HD2 ASN 9 8.221 8.318 7.274
62 H TYR 10 H TYR 10 5.709 10.977 2.673
63 HA TYR 10 HA TYR 10 2.916 10.737 3.740
64 HB3 TYR 10 HB2 TYR 10 3.986 13.290 2.542
65 HD1 TYR 10 HD2 TYR 10 1.564 13.404 1.751
66 HD2 TYR 10 HD1 TYR 10 2.617 13.055 5.919
67 HE1 TYR 10 HE2 TYR 10 -0.770 13.951 2.395
68 HE2 TYR 10 HE1 TYR 10 0.294 13.608 6.553
69 HH TYR 10 HH TYR 10 -1.838 14.082 5.799
70 H ASN 11 H ASN 11 2.467 9.191 2.288
71 HA ASN 11 HA ASN 11 1.216 8.663 0.448
72 HB3 ASN 11 HB2 ASN 11 2.561 10.685 -1.340
73 HD21 ASN 11 1HD2 ASN 11 1.635 10.708 -3.362
74 HD22 ASN 11 2HD2 ASN 11 0.267 9.701 -3.802
75 H CYS 12 H CYS 12 3.943 7.834 1.400
76 HA CYS 12 HA CYS 12 5.246 7.052 -1.195
77 HB3 CYS 12 HB2 CYS 12 7.029 6.283 0.555
78 H VAL 13 H VAL 13 5.832 4.916 -1.499
79 HA VAL 13 HA VAL 13 4.148 2.864 -0.176
80 HB VAL 13 HB VAL 13 5.114 1.328 -1.846
81 HG11 VAL 13 1HG1 VAL 13 3.994 3.843 -3.129
82 HG12 VAL 13 2HG1 VAL 13 3.986 2.205 -3.804
83 HG13 VAL 13 3HG1 VAL 13 3.042 2.556 -2.348
84 HG21 VAL 13 3HG2 VAL 13 7.338 2.451 -2.175
85 HG22 VAL 13 1HG2 VAL 13 6.489 2.092 -3.686
86 HG23 VAL 13 2HG2 VAL 13 6.517 3.750 -3.064
87 H TYR 14 H TYR 14 5.590 0.734 0.135
88 HA TYR 14 HA TYR 14 7.762 1.454 2.046
89 HB3 TYR 14 HB2 TYR 14 7.228 -0.664 3.097
90 HD1 TYR 14 HD2 TYR 14 3.916 0.121 1.603
91 HD2 TYR 14 HD1 TYR 14 6.629 0.933 4.859
92 HE1 TYR 14 HE2 TYR 14 2.165 1.428 2.758
93 HE2 TYR 14 HE1 TYR 14 4.794 2.009 6.113
94 HH TYR 14 HH TYR 14 2.552 2.676 6.072
95 H HIS 15 H HIS 15 7.592 0.554 -1.109
96 HA HIS 15 HA HIS 15 8.733 -0.735 -2.551
97 HB3 HIS 15 HB2 HIS 15 11.063 -0.112 -0.710
98 HD1 HIS 15 HD1 HIS 15 10.353 -0.422 -4.553
99 HD2 HIS 15 HD2 HIS 15 13.116 -1.470 -1.552
100 HE1 HIS 15 HE1 HIS 15 12.223 -1.713 -5.700
101 H CYS 16 H CYS 16 7.277 -2.422 -1.298
102 HA CYS 16 HA CYS 16 8.528 -4.511 0.163
103 HB3 CYS 16 HB2 CYS 16 6.085 -4.282 -0.047
104 H ALA 17 H ALA 17 9.689 -6.274 -0.462
105 HA ALA 17 HA ALA 17 10.410 -6.656 -3.321
106 HB1 ALA 17 HB3 ALA 17 12.080 -8.202 -2.429
107 HB2 ALA 17 HB1 ALA 17 12.211 -6.615 -1.645
108 HB3 ALA 17 HB2 ALA 17 11.450 -7.973 -0.783
109 H ARG 18 H ARG 18 8.186 -7.877 -0.934
110 HA ARG 18 HA ARG 18 7.401 -10.129 -2.666
111 HB3 ARG 18 HB2 ARG 18 7.261 -11.609 -0.661
112 HG3 ARG 18 HG2 ARG 18 9.654 -11.982 -0.100
113 HD3 ARG 18 HD2 ARG 18 10.535 -12.419 -2.376
114 HE ARG 18 HE ARG 18 8.246 -13.582 -1.324
115 HH11 ARG 18 2HH2 ARG 18 9.533 -12.999 -4.546
116 HH12 ARG 18 1HH2 ARG 18 8.805 -14.391 -5.285
117 HH21 ARG 18 1HH1 ARG 18 7.240 -15.453 -2.258
118 HH22 ARG 18 2HH1 ARG 18 7.465 -15.822 -3.935
119 H ASP 19 H ASP 19 5.167 -10.351 -2.675
120 HA ASP 19 HA ASP 19 3.301 -8.678 -1.651
121 HB3 ASP 19 HB2 ASP 19 1.771 -10.622 -1.841
122 H ALA 20 H ALA 20 4.411 -11.664 -0.069
123 HA ALA 20 HA ALA 20 2.806 -11.651 2.143
124 HB1 ALA 20 HB3 ALA 20 5.720 -12.560 2.038
125 HB2 ALA 20 HB1 ALA 20 4.517 -13.065 3.244
126 HB3 ALA 20 HB2 ALA 20 4.304 -13.515 1.541
127 H TYR 21 H TYR 21 5.988 -9.997 1.950
128 HA TYR 21 HA TYR 21 6.092 -9.000 4.603
129 HB3 TYR 21 HB2 TYR 21 7.093 -7.928 1.939
130 HD1 TYR 21 HD1 TYR 21 8.270 -7.583 5.489
131 HD2 TYR 21 HD2 TYR 21 6.891 -5.572 1.938
132 HE1 TYR 21 HE1 TYR 21 8.691 -5.396 6.562
133 HE2 TYR 21 HE2 TYR 21 7.324 -3.380 3.008
134 HH TYR 21 HH TYR 21 8.585 -3.104 6.338
135 H CYS 22 H CYS 22 4.585 -7.588 1.645
136 HA CYS 22 HA CYS 22 3.750 -5.295 3.231
137 HB3 CYS 22 HB2 CYS 22 2.542 -5.653 0.546
138 H ASN 23 H ASN 23 2.248 -8.362 2.303
139 HA ASN 23 HA ASN 23 -0.455 -7.713 3.069
140 HB3 ASN 23 HB2 ASN 23 1.074 -10.335 3.087
141 HD21 ASN 23 1HD2 ASN 23 0.065 -10.879 5.228
142 HD22 ASN 23 2HD2 ASN 23 -1.619 -11.351 5.227
143 H GLU 24 H GLU 24 2.359 -9.075 4.888
144 HA GLU 24 HA GLU 24 1.215 -9.185 7.448
145 HB3 GLU 24 HB2 GLU 24 4.049 -8.693 6.449
146 HG3 GLU 24 HG2 GLU 24 3.051 -9.096 9.269
147 H LEU 25 H LEU 25 2.933 -6.498 5.807
148 HA LEU 25 HA LEU 25 2.592 -4.563 7.780
149 HB3 LEU 25 HB2 LEU 25 2.541 -3.965 4.788
150 HG LEU 25 HG LEU 25 3.130 -2.402 7.282
151 HD11 LEU 25 1HD1 LEU 25 5.332 -2.595 6.128
152 HD12 LEU 25 2HD1 LEU 25 4.578 -1.981 4.636
153 HD13 LEU 25 3HD1 LEU 25 4.681 -0.954 6.087
154 HD21 LEU 25 3HD2 LEU 25 2.140 -1.590 4.504
155 HD22 LEU 25 1HD2 LEU 25 1.101 -1.892 5.907
156 HD23 LEU 25 2HD2 LEU 25 2.237 -0.544 5.934
157 H CYS 26 H CYS 26 0.299 -5.374 5.143
158 HA CYS 26 HA CYS 26 -1.699 -3.466 5.629
159 HB3 CYS 26 HB2 CYS 26 -3.312 -5.026 4.668
160 H THR 27 H THR 27 -1.413 -6.820 7.018
161 HA THR 27 HA THR 27 -3.582 -6.446 8.852
162 HB THR 27 HB THR 27 -2.451 -8.420 10.047
163 HG1 THR 27 HG1 THR 27 -0.367 -7.866 8.785
164 HG21 THR 27 3HG2 THR 27 -3.191 -8.619 7.088
165 HG22 THR 27 1HG2 THR 27 -3.165 -9.965 8.242
166 HG23 THR 27 2HG2 THR 27 -4.335 -8.647 8.445
167 H LYS 28 H LYS 28 -0.154 -5.638 9.187
168 HA LYS 28 HA LYS 28 -0.199 -5.037 11.945
169 HB3 LYS 28 HB2 LYS 28 1.462 -3.328 10.108
170 HG3 LYS 28 HG2 LYS 28 3.305 -4.128 11.470
171 HD3 LYS 28 HD2 LYS 28 1.551 -2.273 12.331
172 HE3 LYS 28 HE2 LYS 28 0.264 -3.880 13.816
173 HZ1 LYS 28 HZ3 LYS 28 2.815 -4.055 15.276
174 HZ2 LYS 28 HZ1 LYS 28 1.358 -4.612 15.796
175 HZ3 LYS 28 HZ2 LYS 28 2.076 -5.300 14.492
176 H ASN 29 H ASN 29 -1.288 -3.274 9.073
177 HA ASN 29 HA ASN 29 -2.070 -0.875 10.668
178 HB3 ASN 29 HB2 ASN 29 -2.538 0.069 8.389
179 HD21 ASN 29 1HD2 ASN 29 0.461 -1.912 8.278
180 HD22 ASN 29 2HD2 ASN 29 1.527 -0.540 8.570
181 H GLY 30 H GLY 30 -3.447 -3.715 10.608
182 HA2 GLY 30 HA2 GLY 30 -5.577 -4.359 11.010
183 HA3 GLY 30 HA3 GLY 30 -6.037 -2.653 11.086
184 H ALA 31 H ALA 31 -4.600 -3.931 8.153
185 HA ALA 31 HA ALA 31 -7.226 -3.930 6.721
186 HB1 ALA 31 HB3 ALA 31 -5.495 -4.184 4.755
187 HB2 ALA 31 HB1 ALA 31 -5.850 -2.573 5.446
188 HB3 ALA 31 HB2 ALA 31 -4.365 -3.425 5.894
189 H LYS 32 H LYS 32 -7.924 -5.843 5.819
190 HA LYS 32 HA LYS 32 -7.076 -8.047 7.298
191 HB3 LYS 32 HB2 LYS 32 -9.333 -7.837 6.453
192 HG3 LYS 32 HG2 LYS 32 -8.185 -8.715 3.756
193 HD3 LYS 32 HD2 LYS 32 -10.920 -9.057 5.042
194 HE3 LYS 32 HE2 LYS 32 -11.540 -10.218 2.884
195 HZ1 LYS 32 HZ3 LYS 32 -12.131 -7.771 3.586
196 HZ2 LYS 32 HZ1 LYS 32 -11.298 -7.350 2.330
197 HZ3 LYS 32 HZ2 LYS 32 -12.576 -8.348 2.092
198 H SER 33 H SER 33 -5.874 -7.147 4.102
199 HA SER 33 HA SER 33 -3.659 -8.922 4.238
200 HB3 SER 33 HB2 SER 33 -4.698 -10.127 1.942
201 HG SER 33 HG SER 33 -3.675 -11.180 3.618
202 H GLY 34 H GLY 34 -2.575 -9.015 1.876
203 HA2 GLY 34 HA2 GLY 34 -3.636 -7.172 -0.063
204 HA3 GLY 34 HA3 GLY 34 -2.186 -6.507 0.722
205 H SER 35 H SER 35 -1.533 -6.625 -1.617
206 HA SER 35 HA SER 35 0.262 -8.906 -1.925
207 HB3 SER 35 HB2 SER 35 -1.627 -9.799 -3.136
208 HG SER 35 HG SER 35 -2.652 -7.677 -3.373
209 H CYS 36 H CYS 36 1.679 -8.376 -3.998
210 HA CYS 36 HA CYS 36 2.193 -5.420 -4.017
211 HB3 CYS 36 HB2 CYS 36 4.558 -6.100 -4.405
212 HA PRO 37 HA PRO 37 1.430 -6.650 -8.370
213 HB3 PRO 37 HB2 PRO 37 -0.622 -5.660 -8.463
214 HG3 PRO 37 HG2 PRO 37 -1.247 -3.974 -6.900
215 HD3 PRO 37 HD2 PRO 37 -0.410 -5.784 -5.609
216 H TYR 38 H TYR 38 3.092 -6.428 -9.708
217 HA TYR 38 HA TYR 38 4.631 -3.904 -9.846
218 HB3 TYR 38 HB2 TYR 38 6.640 -5.103 -10.211
219 HD1 TYR 38 HD2 TYR 38 5.708 -4.014 -7.646
220 HD2 TYR 38 HD1 TYR 38 6.604 -8.089 -8.727
221 HE1 TYR 38 HE2 TYR 38 6.483 -4.445 -5.355
222 HE2 TYR 38 HE1 TYR 38 7.336 -8.533 -6.400
223 HH TYR 38 HH TYR 38 7.650 -5.926 -4.004
224 H LEU 39 H LEU 39 5.185 -3.369 -11.927
225 HA LEU 39 HA LEU 39 4.757 -3.007 -14.126
226 HB3 LEU 39 HB2 LEU 39 4.939 -4.857 -15.677
227 HG LEU 39 HG LEU 39 6.722 -5.501 -13.278
228 HD11 LEU 39 1HD1 LEU 39 7.052 -6.061 -16.254
229 HD12 LEU 39 2HD1 LEU 39 8.220 -6.454 -14.974
230 HD13 LEU 39 3HD1 LEU 39 6.641 -7.258 -15.006
231 HD21 LEU 39 3HD2 LEU 39 7.146 -3.553 -15.594
232 HD22 LEU 39 1HD2 LEU 39 7.029 -3.138 -13.867
233 HD23 LEU 39 2HD2 LEU 39 8.408 -4.071 -14.457
234 H GLY 40 H GLY 40 2.609 -2.768 -12.404
235 HA2 GLY 40 HA2 GLY 40 0.367 -2.956 -14.259
236 HA3 GLY 40 HA3 GLY 40 0.247 -4.056 -12.873
237 H GLU 41 H GLU 41 -0.867 -3.187 -11.207
238 HA GLU 41 HA GLU 41 -1.864 -0.627 -11.106
239 HB3 GLU 41 HB2 GLU 41 -2.583 -1.174 -8.855
240 HG3 GLU 41 HG2 GLU 41 -3.366 -2.484 -11.064
241 H HIS 42 H HIS 42 -0.908 1.219 -10.895
242 HA HIS 42 HA HIS 42 0.619 2.846 -10.539
243 HB3 HIS 42 HB2 HIS 42 0.783 1.719 -7.727
244 HD1 HIS 42 HD1 HIS 42 3.212 3.372 -8.240
245 HD2 HIS 42 HD2 HIS 42 -0.555 5.078 -7.507
246 HE1 HIS 42 HE1 HIS 42 3.643 5.765 -7.422
247 H LYS 43 H LYS 43 1.669 0.467 -11.706
248 HA LYS 43 HA LYS 43 3.547 -0.190 -12.614
249 HB3 LYS 43 HB2 LYS 43 4.962 2.141 -11.249
250 HG3 LYS 43 HG2 LYS 43 5.913 2.135 -13.709
251 HD3 LYS 43 HD2 LYS 43 6.914 0.238 -11.541
252 HE3 LYS 43 HE2 LYS 43 7.923 -0.434 -13.659
253 HZ1 LYS 43 HZ3 LYS 43 9.363 1.118 -14.788
254 HZ2 LYS 43 HZ1 LYS 43 7.807 1.633 -14.871
255 HZ3 LYS 43 HZ2 LYS 43 8.863 2.359 -13.835
256 H PHE 44 H PHE 44 4.414 0.653 -9.222
257 HA PHE 44 HA PHE 44 5.125 -2.103 -8.657
258 HB3 PHE 44 HB2 PHE 44 7.209 0.106 -8.346
259 HD1 PHE 44 HD1 PHE 44 7.266 -0.784 -5.839
260 HD2 PHE 44 HD2 PHE 44 8.397 -3.140 -9.281
261 HE1 PHE 44 HE1 PHE 44 8.554 -2.331 -4.385
262 HE2 PHE 44 HE2 PHE 44 9.782 -4.582 -7.827
263 HZ PHE 44 HZ PHE 44 9.875 -4.167 -5.378
264 H ALA 45 H ALA 45 3.672 -2.233 -6.902
265 HA ALA 45 HA ALA 45 4.051 -0.319 -4.697
266 HB1 ALA 45 HB3 ALA 45 1.419 -0.462 -6.241
267 HB2 ALA 45 HB1 ALA 45 1.713 0.488 -4.766
268 HB3 ALA 45 HB2 ALA 45 2.547 0.909 -6.266
269 H CYS 46 H CYS 46 2.107 -0.765 -3.088
270 HA CYS 46 HA CYS 46 1.599 -3.695 -2.872
271 HB3 CYS 46 HB2 CYS 46 1.128 -3.390 -0.583
272 H TYR 47 H TYR 47 -0.650 -4.207 -2.775
273 HA TYR 47 HA TYR 47 -2.544 -1.942 -2.511
274 HB3 TYR 47 HB2 TYR 47 -3.099 -4.292 -4.343
275 HD1 TYR 47 HD2 TYR 47 -3.673 -0.623 -4.602
276 HD2 TYR 47 HD1 TYR 47 -5.542 -4.443 -3.901
277 HE1 TYR 47 HE2 TYR 47 -5.901 0.401 -4.954
278 HE2 TYR 47 HE1 TYR 47 -7.756 -3.416 -4.346
279 HH TYR 47 HH TYR 47 -8.414 -0.211 -4.096
280 H CYS 48 H CYS 48 -3.660 -2.221 -0.732
281 HA CYS 48 HA CYS 48 -3.775 -4.885 0.611
282 HB3 CYS 48 HB2 CYS 48 -4.427 -3.454 2.597
283 H LYS 49 H LYS 49 -5.752 -5.465 1.473
284 HA LYS 49 HA LYS 49 -8.205 -4.360 0.256
285 HB3 LYS 49 HB2 LYS 49 -9.008 -6.543 1.651
286 HG3 LYS 49 HG2 LYS 49 -9.475 -6.325 -0.640
287 HD3 LYS 49 HD2 LYS 49 -6.596 -7.208 -1.198
288 HE3 LYS 49 HE2 LYS 49 -8.398 -8.012 -2.809
289 HZ1 LYS 49 HZ3 LYS 49 -9.731 -5.886 -2.747
290 HZ2 LYS 49 HZ1 LYS 49 -8.544 -5.148 -3.525
291 HZ3 LYS 49 HZ2 LYS 49 -9.342 -6.374 -4.270
292 H ASP 50 H ASP 50 -9.889 -3.676 1.617
293 HA ASP 50 HA ASP 50 -10.895 -2.803 3.461
294 HB3 ASP 50 HB2 ASP 50 -10.717 -4.343 5.493
295 H LEU 51 H LEU 51 -8.700 -1.176 3.003
296 HA LEU 51 HA LEU 51 -7.172 -0.735 5.398
297 HB3 LEU 51 HB2 LEU 51 -7.501 1.782 4.295
298 HG LEU 51 HG LEU 51 -5.381 0.617 4.914
299 HD11 LEU 51 1HD1 LEU 51 -4.231 -0.671 3.249
300 HD12 LEU 51 2HD1 LEU 51 -5.807 -1.447 3.491
301 HD13 LEU 51 3HD1 LEU 51 -5.545 -0.438 2.060
302 HD21 LEU 51 3HD2 LEU 51 -5.392 2.812 3.757
303 HD22 LEU 51 1HD2 LEU 51 -4.017 1.812 3.270
304 HD23 LEU 51 2HD2 LEU 51 -5.409 1.993 2.190
305 HA PRO 52 HA PRO 52 -10.641 1.257 7.662
306 HB3 PRO 52 HB2 PRO 52 -9.843 0.276 9.614
307 HG3 PRO 52 HG2 PRO 52 -7.520 -0.146 9.943
308 HD3 PRO 52 HD2 PRO 52 -7.896 -1.170 7.856
309 H ASP 53 H ASP 53 -11.127 3.434 7.497
310 HA ASP 53 HA ASP 53 -9.816 4.482 5.431
311 HB3 ASP 53 HB2 ASP 53 -11.484 6.381 7.084
312 H ASN 54 H ASN 54 -9.256 5.392 8.735
313 HA ASN 54 HA ASN 54 -7.708 7.668 8.700
314 HB3 ASN 54 HB2 ASN 54 -6.398 6.644 10.570
315 HD21 ASN 54 1HD2 ASN 54 -8.760 4.607 11.643
316 HD22 ASN 54 2HD2 ASN 54 -9.815 5.825 12.339
317 H VAL 55 H VAL 55 -6.651 4.433 7.559
318 HA VAL 55 HA VAL 55 -3.894 5.243 7.251
319 HB VAL 55 HB VAL 55 -5.381 2.858 6.110
320 HG11 VAL 55 1HG1 VAL 55 -3.218 3.374 4.918
321 HG12 VAL 55 2HG1 VAL 55 -2.382 3.353 6.481
322 HG13 VAL 55 3HG1 VAL 55 -3.136 1.874 5.858
323 HG21 VAL 55 3HG2 VAL 55 -4.372 1.615 7.976
324 HG22 VAL 55 1HG2 VAL 55 -3.641 3.107 8.605
325 HG23 VAL 55 2HG2 VAL 55 -5.401 2.904 8.602
326 HA PRO 56 HA PRO 56 -5.029 7.536 3.581
327 HB3 PRO 56 HB2 PRO 56 -3.389 9.040 4.235
328 HG3 PRO 56 HG2 PRO 56 -1.272 8.281 5.101
329 HD3 PRO 56 HD2 PRO 56 -2.974 7.332 6.469
330 H ILE 57 H ILE 57 -4.984 7.357 1.328
331 HA ILE 57 HA ILE 57 -4.023 4.790 0.238
332 HB ILE 57 HB ILE 57 -5.449 5.106 -1.550
333 HG13 ILE 57 2HG1 ILE 57 -6.852 6.988 -2.053
334 HG21 ILE 57 1HG2 ILE 57 -7.009 6.096 0.873
335 HG22 ILE 57 2HG2 ILE 57 -7.631 5.195 -0.519
336 HG23 ILE 57 3HG2 ILE 57 -6.488 4.433 0.601
337 HD11 ILE 57 3HD1 ILE 57 -6.923 8.210 0.138
338 HD12 ILE 57 1HD1 ILE 57 -5.229 8.698 -0.123
339 HD13 ILE 57 2HD1 ILE 57 -6.484 9.217 -1.244
340 H ARG 58 H ARG 58 -2.515 4.699 -1.452
341 HA ARG 58 HA ARG 58 -0.692 6.907 -1.635
342 HB3 ARG 58 HB2 ARG 58 -0.502 4.544 -3.512
343 HG3 ARG 58 HG2 ARG 58 1.870 4.685 -2.487
344 HD3 ARG 58 HD2 ARG 58 0.691 6.624 -4.475
345 HE ARG 58 HE ARG 58 3.077 7.176 -3.016
346 HH11 ARG 58 2HH2 ARG 58 1.962 7.334 -6.422
347 HH12 ARG 58 1HH2 ARG 58 2.640 8.970 -6.560
348 HH21 ARG 58 1HH1 ARG 58 3.672 9.176 -3.247
349 HH22 ARG 58 2HH1 ARG 58 3.580 9.995 -4.815
350 H VAL 59 H VAL 59 -1.634 8.731 -2.681
351 HA VAL 59 HA VAL 59 -3.381 8.276 -4.983
352 HB VAL 59 HB VAL 59 -3.524 10.691 -5.203
353 HG11 VAL 59 1HG1 VAL 59 -3.869 9.753 -2.327
354 HG12 VAL 59 2HG1 VAL 59 -4.688 11.123 -3.099
355 HG13 VAL 59 3HG1 VAL 59 -5.014 9.475 -3.659
356 HG21 VAL 59 3HG2 VAL 59 -2.537 12.247 -3.665
357 HG22 VAL 59 1HG2 VAL 59 -1.707 10.959 -2.790
358 HG23 VAL 59 2HG2 VAL 59 -1.233 11.360 -4.462
359 HA PRO 60 HA PRO 60 -0.080 8.048 -7.907
360 HB3 PRO 60 HB2 PRO 60 -1.697 7.143 -9.292
361 HG3 PRO 60 HG2 PRO 60 -3.860 8.173 -9.551
362 HD3 PRO 60 HD2 PRO 60 -3.545 7.639 -7.256
363 H GLY 61 H GLY 61 0.705 10.024 -6.594
364 HA2 GLY 61 HA2 GLY 61 1.592 12.060 -8.534
365 HA3 GLY 61 HA3 GLY 61 0.619 12.639 -7.162
366 H LYS 62 H LYS 62 2.445 13.804 -6.380
367 HA LYS 62 HA LYS 62 5.025 12.707 -5.883
368 HB3 LYS 62 HB2 LYS 62 5.329 14.751 -4.485
369 HG3 LYS 62 HG2 LYS 62 3.797 15.372 -7.052
370 HD3 LYS 62 HD2 LYS 62 5.371 17.205 -7.263
371 HE3 LYS 62 HE2 LYS 62 3.144 17.410 -5.812
372 HZ1 LYS 62 HZ3 LYS 62 4.179 16.986 -3.620
373 HZ2 LYS 62 HZ1 LYS 62 5.279 18.172 -3.907
374 HZ3 LYS 62 HZ2 LYS 62 3.692 18.536 -3.750
375 H CYS 63 H CYS 63 5.982 12.821 -3.558
376 HA CYS 63 HA CYS 63 4.157 12.099 -1.428
377 HB3 CYS 63 HB2 CYS 63 6.399 10.299 -2.421
378 H HIS 64 H HIS 64 5.066 12.906 0.597
379 HA HIS 64 HA HIS 64 7.392 14.755 0.236
380 HB3 HIS 64 HB2 HIS 64 6.234 16.394 1.481
381 HD1 HIS 64 HD1 HIS 64 2.763 15.804 0.915
382 HD2 HIS 64 HD2 HIS 64 6.099 16.010 -1.619
383 HE1 HIS 64 HE1 HIS 64 1.861 16.197 -1.440
Start of MODEL 4
1 H1 VAL 1 H VAL 1 -16.257 -0.177 2.403
2 HA VAL 1 HA VAL 1 -14.512 1.124 3.992
3 HB VAL 1 HB VAL 1 -13.383 -1.669 3.923
4 HG11 VAL 1 1HG1 VAL 1 -12.218 -0.863 5.904
5 HG12 VAL 1 2HG1 VAL 1 -12.175 0.440 4.705
6 HG13 VAL 1 3HG1 VAL 1 -13.320 0.522 6.049
7 HG21 VAL 1 3HG2 VAL 1 -14.295 -2.170 6.190
8 HG22 VAL 1 1HG2 VAL 1 -15.421 -0.810 6.023
9 HG23 VAL 1 2HG2 VAL 1 -15.532 -2.214 4.933
10 H ARG 2 H ARG 2 -11.993 -0.034 2.800
11 HA ARG 2 HA ARG 2 -12.651 -0.347 -0.035
12 HB3 ARG 2 HB2 ARG 2 -12.437 2.160 0.359
13 HG3 ARG 2 HG2 ARG 2 -9.539 1.375 0.977
14 HD3 ARG 2 HD2 ARG 2 -10.115 3.398 -0.647
15 HE ARG 2 HE ARG 2 -11.494 4.650 1.076
16 HH11 ARG 2 2HH2 ARG 2 -8.254 4.274 2.252
17 HH12 ARG 2 1HH2 ARG 2 -8.185 5.864 2.956
18 HH21 ARG 2 1HH1 ARG 2 -11.419 6.672 1.828
19 HH22 ARG 2 2HH1 ARG 2 -10.131 7.120 2.864
20 H ASP 3 H ASP 3 -10.709 -0.829 -1.288
21 HA ASP 3 HA ASP 3 -8.419 -1.927 0.261
22 HB3 ASP 3 HB2 ASP 3 -8.025 -3.420 -1.678
23 H ALA 4 H ALA 4 -6.410 -1.047 -0.459
24 HA ALA 4 HA ALA 4 -6.336 0.781 -2.715
25 HB1 ALA 4 HB3 ALA 4 -6.508 1.987 0.066
26 HB2 ALA 4 HB1 ALA 4 -6.107 2.843 -1.436
27 HB3 ALA 4 HB2 ALA 4 -7.710 2.132 -1.233
28 H TYR 5 H TYR 5 -4.253 2.242 -2.393
29 HA TYR 5 HA TYR 5 -2.091 0.281 -1.875
30 HB3 TYR 5 HB2 TYR 5 -0.724 2.157 -2.934
31 HD1 TYR 5 HD2 TYR 5 -0.269 -0.233 -3.645
32 HD2 TYR 5 HD1 TYR 5 -3.488 2.093 -5.311
33 HE1 TYR 5 HE2 TYR 5 -0.402 -1.794 -5.567
34 HE2 TYR 5 HE1 TYR 5 -3.653 0.509 -7.199
35 HH TYR 5 HH TYR 5 -3.036 -1.630 -7.932
36 H ILE 6 H ILE 6 -1.207 0.306 0.158
37 HA ILE 6 HA ILE 6 -1.892 2.454 1.937
38 HB ILE 6 HB ILE 6 -1.538 0.101 2.582
39 HG13 ILE 6 2HG1 ILE 6 -1.535 2.030 4.171
40 HG21 ILE 6 1HG2 ILE 6 1.451 0.686 2.395
41 HG22 ILE 6 2HG2 ILE 6 0.687 -0.832 2.898
42 HG23 ILE 6 3HG2 ILE 6 0.554 -0.297 1.225
43 HD11 ILE 6 3HD1 ILE 6 -0.757 0.795 6.052
44 HD12 ILE 6 1HD1 ILE 6 -1.455 -0.364 4.897
45 HD13 ILE 6 2HD1 ILE 6 0.309 -0.211 5.048
46 H ALA 7 H ALA 7 -0.581 4.068 2.800
47 HA ALA 7 HA ALA 7 2.075 4.561 1.516
48 HB1 ALA 7 HB3 ALA 7 -0.078 6.634 2.116
49 HB2 ALA 7 HB1 ALA 7 1.588 6.970 1.595
50 HB3 ALA 7 HB2 ALA 7 0.468 6.121 0.502
51 H GLN 8 H GLN 8 3.650 5.163 2.973
52 HA GLN 8 HA GLN 8 2.976 4.810 5.813
53 HB3 GLN 8 HB2 GLN 8 4.916 3.717 4.734
54 HG3 GLN 8 HG2 GLN 8 6.374 6.366 4.972
55 HE21 GLN 8 1HE2 GLN 8 7.411 4.228 2.476
56 HE22 GLN 8 2HE2 GLN 8 8.766 3.608 3.392
57 H ASN 9 H ASN 9 4.669 7.281 3.892
58 HA ASN 9 HA ASN 9 3.588 9.646 4.938
59 HB3 ASN 9 HB2 ASN 9 6.144 9.762 6.248
60 HD21 ASN 9 1HD2 ASN 9 2.902 8.767 7.430
61 HD22 ASN 9 2HD2 ASN 9 2.602 10.273 8.303
62 H TYR 10 H TYR 10 5.959 10.673 2.344
63 HA TYR 10 HA TYR 10 3.091 10.631 3.185
64 HB3 TYR 10 HB2 TYR 10 3.645 12.952 1.717
65 HD1 TYR 10 HD1 TYR 10 1.331 13.233 2.502
66 HD2 TYR 10 HD2 TYR 10 4.594 12.913 5.303
67 HE1 TYR 10 HE1 TYR 10 -0.201 13.821 4.362
68 HE2 TYR 10 HE2 TYR 10 3.065 13.496 7.153
69 HH TYR 10 HH TYR 10 0.895 14.008 7.756
70 H ASN 11 H ASN 11 2.055 9.517 1.716
71 HA ASN 11 HA ASN 11 1.411 8.549 -0.176
72 HB3 ASN 11 HB2 ASN 11 2.844 10.329 -2.054
73 HD21 ASN 11 1HD2 ASN 11 1.771 10.145 -3.962
74 HD22 ASN 11 2HD2 ASN 11 0.118 9.583 -4.158
75 H CYS 12 H CYS 12 4.228 7.993 0.986
76 HA CYS 12 HA CYS 12 5.542 6.850 -1.437
77 HB3 CYS 12 HB2 CYS 12 7.515 6.714 -0.045
78 H VAL 13 H VAL 13 5.627 4.645 -1.558
79 HA VAL 13 HA VAL 13 4.017 3.041 0.285
80 HB VAL 13 HB VAL 13 4.672 1.158 -1.142
81 HG11 VAL 13 1HG1 VAL 13 2.750 2.575 -1.776
82 HG12 VAL 13 2HG1 VAL 13 3.823 3.591 -2.769
83 HG13 VAL 13 3HG1 VAL 13 3.575 1.891 -3.189
84 HG21 VAL 13 3HG2 VAL 13 6.324 3.140 -2.778
85 HG22 VAL 13 1HG2 VAL 13 6.991 1.860 -1.745
86 HG23 VAL 13 2HG2 VAL 13 6.012 1.438 -3.154
87 H TYR 14 H TYR 14 5.100 0.946 1.106
88 HA TYR 14 HA TYR 14 7.641 1.568 2.517
89 HB3 TYR 14 HB2 TYR 14 7.196 -0.611 3.622
90 HD1 TYR 14 HD2 TYR 14 7.378 1.065 5.430
91 HD2 TYR 14 HD1 TYR 14 3.712 0.472 3.245
92 HE1 TYR 14 HE2 TYR 14 6.078 1.855 7.383
93 HE2 TYR 14 HE1 TYR 14 2.422 1.245 5.195
94 HH TYR 14 HH TYR 14 2.531 1.711 7.522
95 H HIS 15 H HIS 15 9.262 -0.292 2.484
96 HA HIS 15 HA HIS 15 9.970 -0.919 -0.255
97 HB3 HIS 15 HB2 HIS 15 11.146 -1.821 2.395
98 HD1 HIS 15 HD1 HIS 15 12.309 -1.473 -1.322
99 HD2 HIS 15 HD2 HIS 15 12.454 -4.034 2.015
100 HE1 HIS 15 HE1 HIS 15 13.641 -3.529 -2.034
101 H CYS 16 H CYS 16 7.941 -1.980 -0.813
102 HA CYS 16 HA CYS 16 7.112 -4.499 0.132
103 HB3 CYS 16 HB2 CYS 16 7.001 -3.293 -2.632
104 H ALA 17 H ALA 17 8.908 -5.753 0.753
105 HA ALA 17 HA ALA 17 10.854 -6.737 -1.110
106 HB1 ALA 17 HB3 ALA 17 9.768 -8.035 1.423
107 HB2 ALA 17 HB1 ALA 17 11.264 -8.471 0.573
108 HB3 ALA 17 HB2 ALA 17 11.114 -6.876 1.337
109 H ARG 18 H ARG 18 7.494 -7.662 -0.411
110 HA ARG 18 HA ARG 18 7.265 -9.332 -2.702
111 HB3 ARG 18 HB2 ARG 18 6.699 -10.992 -0.293
112 HG3 ARG 18 HG2 ARG 18 6.669 -11.810 -2.716
113 HD3 ARG 18 HD2 ARG 18 9.678 -11.721 -2.237
114 HE ARG 18 HE ARG 18 8.159 -13.507 -3.843
115 HH11 ARG 18 2HH2 ARG 18 10.903 -11.329 -4.110
116 HH12 ARG 18 1HH2 ARG 18 11.725 -12.214 -5.359
117 HH21 ARG 18 1HH1 ARG 18 9.204 -14.745 -5.510
118 HH22 ARG 18 2HH1 ARG 18 10.716 -14.221 -6.177
119 H ASP 19 H ASP 19 5.047 -10.529 -2.548
120 HA ASP 19 HA ASP 19 2.914 -8.721 -1.862
121 HB3 ASP 19 HB2 ASP 19 2.805 -10.268 -3.791
122 H ALA 20 H ALA 20 4.245 -11.791 -0.619
123 HA ALA 20 HA ALA 20 2.629 -12.027 1.667
124 HB1 ALA 20 HB3 ALA 20 4.180 -13.786 0.904
125 HB2 ALA 20 HB1 ALA 20 5.574 -12.798 1.392
126 HB3 ALA 20 HB2 ALA 20 4.447 -13.414 2.620
127 H TYR 21 H TYR 21 5.797 -10.356 1.463
128 HA TYR 21 HA TYR 21 5.914 -9.306 4.086
129 HB3 TYR 21 HB2 TYR 21 6.917 -8.282 1.421
130 HD1 TYR 21 HD1 TYR 21 6.228 -5.905 1.731
131 HD2 TYR 21 HD2 TYR 21 8.825 -7.917 4.522
132 HE1 TYR 21 HE1 TYR 21 6.848 -3.726 2.727
133 HE2 TYR 21 HE2 TYR 21 9.520 -5.730 5.443
134 HH TYR 21 HH TYR 21 9.254 -3.442 5.346
135 H CYS 22 H CYS 22 4.458 -7.887 1.107
136 HA CYS 22 HA CYS 22 3.410 -5.569 2.366
137 HB3 CYS 22 HB2 CYS 22 2.661 -7.177 -0.083
138 H ASN 23 H ASN 23 1.868 -8.798 1.940
139 HA ASN 23 HA ASN 23 -0.618 -8.117 3.134
140 HB3 ASN 23 HB2 ASN 23 0.848 -10.785 3.061
141 HD21 ASN 23 1HD2 ASN 23 -0.045 -11.364 5.210
142 HD22 ASN 23 2HD2 ASN 23 -1.761 -11.695 5.335
143 H GLU 24 H GLU 24 2.381 -9.432 4.656
144 HA GLU 24 HA GLU 24 1.423 -9.452 7.313
145 HB3 GLU 24 HB2 GLU 24 4.214 -8.987 6.147
146 HG3 GLU 24 HG2 GLU 24 3.241 -9.257 9.001
147 H LEU 25 H LEU 25 3.043 -6.796 5.462
148 HA LEU 25 HA LEU 25 3.078 -4.945 7.560
149 HB3 LEU 25 HB2 LEU 25 2.792 -4.290 4.581
150 HG LEU 25 HG LEU 25 3.589 -2.803 7.047
151 HD11 LEU 25 1HD1 LEU 25 5.192 -1.419 5.875
152 HD12 LEU 25 2HD1 LEU 25 5.760 -3.091 5.922
153 HD13 LEU 25 3HD1 LEU 25 5.069 -2.440 4.419
154 HD21 LEU 25 3HD2 LEU 25 2.613 -0.978 5.871
155 HD22 LEU 25 1HD2 LEU 25 2.705 -1.806 4.299
156 HD23 LEU 25 2HD2 LEU 25 1.540 -2.322 5.527
157 H CYS 26 H CYS 26 0.524 -5.580 5.141
158 HA CYS 26 HA CYS 26 -1.278 -3.530 5.845
159 HB3 CYS 26 HB2 CYS 26 -3.011 -5.016 4.851
160 H THR 27 H THR 27 -1.150 -6.945 7.050
161 HA THR 27 HA THR 27 -3.171 -6.551 9.043
162 HB THR 27 HB THR 27 -2.344 -8.624 10.047
163 HG1 THR 27 HG1 THR 27 -0.148 -8.136 8.396
164 HG21 THR 27 3HG2 THR 27 -2.788 -10.066 8.126
165 HG22 THR 27 1HG2 THR 27 -3.871 -8.660 8.108
166 HG23 THR 27 2HG2 THR 27 -2.488 -8.731 7.000
167 H LYS 28 H LYS 28 0.308 -5.915 9.164
168 HA LYS 28 HA LYS 28 0.484 -5.434 11.966
169 HB3 LYS 28 HB2 LYS 28 2.681 -4.322 10.875
170 HG3 LYS 28 HG2 LYS 28 3.591 -6.594 10.215
171 HD3 LYS 28 HD2 LYS 28 2.205 -6.507 12.931
172 HE3 LYS 28 HE2 LYS 28 3.057 -8.780 12.352
173 HZ1 LYS 28 HZ3 LYS 28 5.679 -7.412 12.167
174 HZ2 LYS 28 HZ1 LYS 28 5.485 -9.030 12.362
175 HZ3 LYS 28 HZ2 LYS 28 4.990 -8.362 11.013
176 H ASN 29 H ASN 29 -0.495 -3.478 9.166
177 HA ASN 29 HA ASN 29 -0.146 -0.937 10.681
178 HB3 ASN 29 HB2 ASN 29 -1.242 -0.032 8.511
179 HD21 ASN 29 1HD2 ASN 29 1.544 -2.311 8.504
180 HD22 ASN 29 2HD2 ASN 29 2.760 -1.048 8.276
181 H GLY 30 H GLY 30 -2.739 -2.844 9.158
182 HA2 GLY 30 HA2 GLY 30 -4.757 -3.012 10.788
183 HA3 GLY 30 HA3 GLY 30 -4.826 -1.252 10.585
184 H ALA 31 H ALA 31 -4.219 -4.030 8.355
185 HA ALA 31 HA ALA 31 -6.737 -3.465 6.900
186 HB1 ALA 31 HB3 ALA 31 -5.412 -2.344 5.373
187 HB2 ALA 31 HB1 ALA 31 -3.934 -3.213 5.823
188 HB3 ALA 31 HB2 ALA 31 -5.154 -4.017 4.814
189 H LYS 32 H LYS 32 -7.410 -5.428 5.681
190 HA LYS 32 HA LYS 32 -7.000 -7.541 7.604
191 HB3 LYS 32 HB2 LYS 32 -9.167 -6.923 6.428
192 HG3 LYS 32 HG2 LYS 32 -8.167 -9.022 4.454
193 HD3 LYS 32 HD2 LYS 32 -10.138 -9.005 3.335
194 HE3 LYS 32 HE2 LYS 32 -10.599 -9.954 5.663
195 HZ1 LYS 32 HZ3 LYS 32 -11.908 -7.289 5.959
196 HZ2 LYS 32 HZ1 LYS 32 -12.302 -8.596 6.869
197 HZ3 LYS 32 HZ2 LYS 32 -10.806 -7.925 6.938
198 H SER 33 H SER 33 -5.714 -6.954 4.375
199 HA SER 33 HA SER 33 -3.811 -9.091 4.518
200 HB3 SER 33 HB2 SER 33 -4.694 -10.415 2.580
201 HG SER 33 HG SER 33 -5.700 -10.517 4.971
202 H GLY 34 H GLY 34 -2.741 -9.182 2.111
203 HA2 GLY 34 HA2 GLY 34 -3.026 -6.589 0.700
204 HA3 GLY 34 HA3 GLY 34 -1.461 -6.974 1.418
205 H SER 35 H SER 35 -1.581 -6.451 -1.222
206 HA SER 35 HA SER 35 -0.349 -8.882 -2.194
207 HB3 SER 35 HB2 SER 35 -1.586 -9.191 -4.174
208 HG SER 35 HG SER 35 -2.850 -9.571 -2.170
209 H CYS 36 H CYS 36 1.375 -8.200 -3.648
210 HA CYS 36 HA CYS 36 1.629 -5.220 -3.897
211 HB3 CYS 36 HB2 CYS 36 3.785 -7.258 -3.470
212 HA PRO 37 HA PRO 37 1.698 -6.899 -8.203
213 HB3 PRO 37 HB2 PRO 37 -0.407 -6.126 -8.703
214 HG3 PRO 37 HG2 PRO 37 -1.365 -4.283 -7.500
215 HD3 PRO 37 HD2 PRO 37 -0.644 -5.925 -5.918
216 H TYR 38 H TYR 38 3.050 -6.315 -9.840
217 HA TYR 38 HA TYR 38 4.938 -4.030 -9.517
218 HB3 TYR 38 HB2 TYR 38 6.259 -5.444 -11.221
219 HD1 TYR 38 HD2 TYR 38 5.190 -7.595 -8.354
220 HD2 TYR 38 HD1 TYR 38 8.102 -4.840 -9.925
221 HE1 TYR 38 HE2 TYR 38 6.757 -8.226 -6.547
222 HE2 TYR 38 HE1 TYR 38 9.641 -5.412 -8.066
223 HH TYR 38 HH TYR 38 8.818 -7.824 -5.573
224 H LEU 39 H LEU 39 5.633 -3.237 -11.594
225 HA LEU 39 HA LEU 39 4.739 -1.649 -13.065
226 HB3 LEU 39 HB2 LEU 39 6.394 -2.776 -14.181
227 HG LEU 39 HG LEU 39 4.782 -5.176 -13.934
228 HD11 LEU 39 1HD1 LEU 39 5.096 -6.110 -16.189
229 HD12 LEU 39 2HD1 LEU 39 4.021 -4.701 -16.245
230 HD13 LEU 39 3HD1 LEU 39 5.712 -4.548 -16.771
231 HD21 LEU 39 3HD2 LEU 39 7.571 -4.733 -15.074
232 HD22 LEU 39 1HD2 LEU 39 7.185 -4.919 -13.351
233 HD23 LEU 39 2HD2 LEU 39 6.898 -6.262 -14.471
234 H GLY 40 H GLY 40 2.579 -1.745 -11.876
235 HA2 GLY 40 HA2 GLY 40 0.410 -2.117 -13.914
236 HA3 GLY 40 HA3 GLY 40 0.284 -2.775 -12.275
237 H GLU 41 H GLU 41 -1.426 -1.520 -11.631
238 HA GLU 41 HA GLU 41 -2.298 0.859 -12.373
239 HB3 GLU 41 HB2 GLU 41 -3.515 1.019 -10.263
240 HG3 GLU 41 HG2 GLU 41 -3.175 -1.945 -10.941
241 H HIS 42 H HIS 42 -0.121 0.557 -9.532
242 HA HIS 42 HA HIS 42 0.706 3.424 -9.909
243 HB3 HIS 42 HB2 HIS 42 1.018 3.517 -7.444
244 HD1 HIS 42 HD1 HIS 42 -1.631 3.801 -9.892
245 HD2 HIS 42 HD2 HIS 42 -1.360 3.845 -5.691
246 HE1 HIS 42 HE1 HIS 42 -3.745 4.943 -9.032
247 H LYS 43 H LYS 43 1.814 1.511 -11.334
248 HA LYS 43 HA LYS 43 3.697 0.578 -11.963
249 HB3 LYS 43 HB2 LYS 43 5.121 2.324 -9.906
250 HG3 LYS 43 HG2 LYS 43 5.986 1.043 -12.543
251 HD3 LYS 43 HD2 LYS 43 7.487 2.908 -10.650
252 HE3 LYS 43 HE2 LYS 43 8.291 1.602 -13.307
253 HZ1 LYS 43 HZ3 LYS 43 9.215 3.803 -13.066
254 HZ2 LYS 43 HZ1 LYS 43 9.835 3.429 -11.586
255 HZ3 LYS 43 HZ2 LYS 43 10.389 2.663 -12.930
256 H PHE 44 H PHE 44 4.682 0.808 -8.513
257 HA PHE 44 HA PHE 44 4.499 -2.117 -8.239
258 HB3 PHE 44 HB2 PHE 44 7.067 -0.518 -8.103
259 HD1 PHE 44 HD2 PHE 44 5.572 -3.868 -7.136
260 HD2 PHE 44 HD1 PHE 44 9.112 -1.395 -7.215
261 HE1 PHE 44 HE2 PHE 44 6.657 -5.345 -5.516
262 HE2 PHE 44 HE1 PHE 44 10.177 -2.893 -5.563
263 HZ PHE 44 HZ PHE 44 8.948 -4.872 -4.711
264 H ALA 45 H ALA 45 3.308 -2.243 -6.351
265 HA ALA 45 HA ALA 45 3.947 -0.541 -4.059
266 HB1 ALA 45 HB3 ALA 45 1.790 0.748 -4.203
267 HB2 ALA 45 HB1 ALA 45 2.901 1.144 -5.519
268 HB3 ALA 45 HB2 ALA 45 1.533 0.067 -5.826
269 H CYS 46 H CYS 46 2.395 -0.836 -2.289
270 HA CYS 46 HA CYS 46 1.498 -3.652 -2.184
271 HB3 CYS 46 HB2 CYS 46 2.153 -1.582 -0.084
272 H TYR 47 H TYR 47 -0.542 -3.835 -2.942
273 HA TYR 47 HA TYR 47 -2.641 -1.897 -2.319
274 HB3 TYR 47 HB2 TYR 47 -2.886 -4.542 -3.788
275 HD1 TYR 47 HD1 TYR 47 -3.919 -0.931 -4.127
276 HD2 TYR 47 HD2 TYR 47 -5.227 -5.029 -4.026
277 HE1 TYR 47 HE1 TYR 47 -6.224 -0.227 -4.700
278 HE2 TYR 47 HE2 TYR 47 -7.570 -4.286 -4.329
279 HH TYR 47 HH TYR 47 -8.524 -0.977 -4.065
280 H CYS 48 H CYS 48 -3.132 -1.981 -0.191
281 HA CYS 48 HA CYS 48 -3.431 -4.540 1.261
282 HB3 CYS 48 HB2 CYS 48 -4.106 -3.027 3.133
283 H LYS 49 H LYS 49 -5.446 -5.051 2.298
284 HA LYS 49 HA LYS 49 -7.806 -3.959 0.868
285 HB3 LYS 49 HB2 LYS 49 -8.927 -6.091 1.161
286 HG3 LYS 49 HG2 LYS 49 -7.148 -5.623 -0.813
287 HD3 LYS 49 HD2 LYS 49 -6.290 -8.103 0.731
288 HE3 LYS 49 HE2 LYS 49 -6.216 -8.487 -1.750
289 HZ1 LYS 49 HZ3 LYS 49 -4.173 -6.325 -1.590
290 HZ2 LYS 49 HZ1 LYS 49 -4.175 -7.542 -2.704
291 HZ3 LYS 49 HZ2 LYS 49 -5.452 -6.473 -2.622
292 H ASP 50 H ASP 50 -9.656 -3.698 2.021
293 HA ASP 50 HA ASP 50 -10.881 -2.946 3.804
294 HB3 ASP 50 HB2 ASP 50 -9.357 -4.737 5.708
295 H LEU 51 H LEU 51 -8.956 -1.219 3.168
296 HA LEU 51 HA LEU 51 -7.351 -0.445 5.521
297 HB3 LEU 51 HB2 LEU 51 -7.126 1.713 3.950
298 HG LEU 51 HG LEU 51 -5.757 -0.936 3.392
299 HD11 LEU 51 1HD1 LEU 51 -5.637 0.348 1.380
300 HD12 LEU 51 2HD1 LEU 51 -5.275 1.853 2.261
301 HD13 LEU 51 3HD1 LEU 51 -4.070 0.562 2.178
302 HD21 LEU 51 3HD2 LEU 51 -5.236 0.126 5.637
303 HD22 LEU 51 1HD2 LEU 51 -3.849 0.071 4.548
304 HD23 LEU 51 2HD2 LEU 51 -4.726 1.591 4.773
305 HA PRO 52 HA PRO 52 -11.220 1.355 7.016
306 HB3 PRO 52 HB2 PRO 52 -10.549 0.956 9.164
307 HG3 PRO 52 HG2 PRO 52 -8.236 1.043 9.779
308 HD3 PRO 52 HD2 PRO 52 -8.416 -0.408 7.888
309 H ASP 53 H ASP 53 -12.095 2.978 5.918
310 HA ASP 53 HA ASP 53 -10.839 4.293 4.090
311 HB3 ASP 53 HB2 ASP 53 -13.372 5.407 5.344
312 H ASN 54 H ASN 54 -11.271 5.825 7.259
313 HA ASN 54 HA ASN 54 -10.532 8.458 6.775
314 HB3 ASN 54 HB2 ASN 54 -9.679 6.663 9.083
315 HD21 ASN 54 1HD2 ASN 54 -7.891 7.685 10.020
316 HD22 ASN 54 2HD2 ASN 54 -7.874 9.412 10.342
317 H VAL 55 H VAL 55 -8.347 5.637 6.840
318 HA VAL 55 HA VAL 55 -5.921 7.078 6.994
319 HB VAL 55 HB VAL 55 -6.355 4.628 7.440
320 HG11 VAL 55 1HG1 VAL 55 -7.475 4.211 5.137
321 HG12 VAL 55 2HG1 VAL 55 -5.832 4.161 4.485
322 HG13 VAL 55 3HG1 VAL 55 -6.326 3.009 5.744
323 HG21 VAL 55 3HG2 VAL 55 -3.965 5.224 5.655
324 HG22 VAL 55 1HG2 VAL 55 -4.068 5.512 7.411
325 HG23 VAL 55 2HG2 VAL 55 -4.136 3.862 6.774
326 HA PRO 56 HA PRO 56 -5.810 8.617 2.762
327 HB3 PRO 56 HB2 PRO 56 -4.237 10.167 3.434
328 HG3 PRO 56 HG2 PRO 56 -2.534 9.601 5.036
329 HD3 PRO 56 HD2 PRO 56 -4.663 9.104 6.009
330 H ILE 57 H ILE 57 -5.113 7.963 0.684
331 HA ILE 57 HA ILE 57 -3.995 5.198 0.401
332 HB ILE 57 HB ILE 57 -5.139 5.001 -1.607
333 HG13 ILE 57 2HG1 ILE 57 -6.665 6.565 -2.619
334 HG21 ILE 57 1HG2 ILE 57 -7.125 6.168 0.379
335 HG22 ILE 57 2HG2 ILE 57 -7.473 5.014 -0.916
336 HG23 ILE 57 3HG2 ILE 57 -6.427 4.544 0.441
337 HD11 ILE 57 3HD1 ILE 57 -7.091 8.134 -0.649
338 HD12 ILE 57 1HD1 ILE 57 -5.489 8.839 -0.991
339 HD13 ILE 57 2HD1 ILE 57 -6.760 8.885 -2.209
340 H ARG 58 H ARG 58 -2.459 4.933 -1.307
341 HA ARG 58 HA ARG 58 -0.645 7.132 -1.711
342 HB3 ARG 58 HB2 ARG 58 -0.687 4.580 -3.356
343 HG3 ARG 58 HG2 ARG 58 1.741 4.710 -3.058
344 HD3 ARG 58 HD2 ARG 58 0.597 7.329 -4.060
345 HE ARG 58 HE ARG 58 3.193 6.935 -3.558
346 HH11 ARG 58 2HH2 ARG 58 1.102 8.116 -6.084
347 HH12 ARG 58 1HH2 ARG 58 2.387 9.021 -6.878
348 HH21 ARG 58 1HH1 ARG 58 4.923 7.943 -4.748
349 HH22 ARG 58 2HH1 ARG 58 4.460 9.026 -6.039
350 H VAL 59 H VAL 59 -1.694 8.886 -2.832
351 HA VAL 59 HA VAL 59 -3.543 8.296 -5.001
352 HB VAL 59 HB VAL 59 -3.611 10.692 -5.431
353 HG11 VAL 59 1HG1 VAL 59 -4.998 9.702 -3.659
354 HG12 VAL 59 2HG1 VAL 59 -3.738 10.061 -2.458
355 HG13 VAL 59 3HG1 VAL 59 -4.567 11.383 -3.301
356 HG21 VAL 59 3HG2 VAL 59 -1.229 11.301 -4.964
357 HG22 VAL 59 1HG2 VAL 59 -2.422 12.336 -4.173
358 HG23 VAL 59 2HG2 VAL 59 -1.577 11.113 -3.226
359 HA PRO 60 HA PRO 60 -0.507 7.903 -8.243
360 HB3 PRO 60 HB2 PRO 60 -2.236 7.080 -9.520
361 HG3 PRO 60 HG2 PRO 60 -4.393 8.143 -9.575
362 HD3 PRO 60 HD2 PRO 60 -3.901 7.574 -7.318
363 H GLY 61 H GLY 61 0.372 9.920 -6.922
364 HA2 GLY 61 HA2 GLY 61 1.325 11.790 -8.981
365 HA3 GLY 61 HA3 GLY 61 0.423 12.510 -7.634
366 H LYS 62 H LYS 62 1.848 13.362 -6.266
367 HA LYS 62 HA LYS 62 4.599 13.036 -6.224
368 HB3 LYS 62 HB2 LYS 62 4.473 14.285 -4.060
369 HG3 LYS 62 HG2 LYS 62 2.473 15.392 -6.067
370 HD3 LYS 62 HD2 LYS 62 4.185 16.629 -3.858
371 HE3 LYS 62 HE2 LYS 62 2.195 17.931 -5.783
372 HZ1 LYS 62 HZ3 LYS 62 2.218 18.956 -3.608
373 HZ2 LYS 62 HZ1 LYS 62 3.854 19.129 -3.658
374 HZ3 LYS 62 HZ2 LYS 62 2.908 19.951 -4.719
375 H CYS 63 H CYS 63 5.950 12.571 -4.238
376 HA CYS 63 HA CYS 63 4.847 11.147 -2.060
377 HB3 CYS 63 HB2 CYS 63 6.494 9.666 -4.061
378 H HIS 64 H HIS 64 6.134 11.877 -0.227
379 HA HIS 64 HA HIS 64 8.918 12.669 -0.698
380 HB3 HIS 64 HB2 HIS 64 8.148 14.746 -1.389
381 HD1 HIS 64 HD1 HIS 64 5.948 14.896 1.823
382 HD2 HIS 64 HD2 HIS 64 5.805 15.151 -2.367
383 HE1 HIS 64 HE1 HIS 64 3.578 15.625 1.218
Start of MODEL 5
1 H1 VAL 1 H VAL 1 -13.309 2.242 5.810
2 HA VAL 1 HA VAL 1 -11.612 0.806 5.262
3 HB VAL 1 HB VAL 1 -11.950 -1.640 5.019
4 HG11 VAL 1 1HG1 VAL 1 -12.446 -2.116 7.376
5 HG12 VAL 1 2HG1 VAL 1 -11.361 -0.733 7.202
6 HG13 VAL 1 3HG1 VAL 1 -13.078 -0.471 7.590
7 HG21 VAL 1 3HG2 VAL 1 -14.083 -2.677 5.681
8 HG22 VAL 1 1HG2 VAL 1 -14.853 -1.080 5.760
9 HG23 VAL 1 2HG2 VAL 1 -14.273 -1.724 4.208
10 H ARG 2 H ARG 2 -10.639 0.569 3.232
11 HA ARG 2 HA ARG 2 -12.314 -0.195 0.937
12 HB3 ARG 2 HB2 ARG 2 -12.531 2.246 0.925
13 HG3 ARG 2 HG2 ARG 2 -10.312 3.471 0.382
14 HD3 ARG 2 HD2 ARG 2 -10.778 2.868 3.340
15 HE ARG 2 HE ARG 2 -10.098 5.505 2.288
16 HH11 ARG 2 2HH2 ARG 2 -8.746 2.561 3.762
17 HH12 ARG 2 1HH2 ARG 2 -7.603 3.454 4.709
18 HH21 ARG 2 1HH1 ARG 2 -8.389 6.603 3.435
19 HH22 ARG 2 2HH1 ARG 2 -7.155 5.664 4.223
20 H ASP 3 H ASP 3 -10.932 -0.827 -0.904
21 HA ASP 3 HA ASP 3 -8.293 -1.785 0.013
22 HB3 ASP 3 HB2 ASP 3 -8.045 -2.796 -2.150
23 H ALA 4 H ALA 4 -6.302 -1.002 -0.822
24 HA ALA 4 HA ALA 4 -6.237 1.362 -2.493
25 HB1 ALA 4 HB3 ALA 4 -7.278 2.422 -0.529
26 HB2 ALA 4 HB1 ALA 4 -6.055 1.692 0.533
27 HB3 ALA 4 HB2 ALA 4 -5.582 2.923 -0.655
28 H TYR 5 H TYR 5 -4.106 2.323 -2.532
29 HA TYR 5 HA TYR 5 -1.891 0.445 -1.924
30 HB3 TYR 5 HB2 TYR 5 -0.559 2.312 -3.019
31 HD1 TYR 5 HD2 TYR 5 -0.141 -0.079 -3.810
32 HD2 TYR 5 HD1 TYR 5 -3.300 2.389 -5.392
33 HE1 TYR 5 HE2 TYR 5 -0.498 -1.699 -5.627
34 HE2 TYR 5 HE1 TYR 5 -3.711 0.719 -7.163
35 HH TYR 5 HH TYR 5 -3.381 -1.514 -7.762
36 H ILE 6 H ILE 6 -1.283 0.588 0.253
37 HA ILE 6 HA ILE 6 -2.048 2.798 1.858
38 HB ILE 6 HB ILE 6 -1.621 0.635 2.786
39 HG13 ILE 6 2HG1 ILE 6 -1.255 2.779 4.078
40 HG21 ILE 6 1HG2 ILE 6 1.319 1.000 2.053
41 HG22 ILE 6 2HG2 ILE 6 0.644 -0.353 2.980
42 HG23 ILE 6 3HG2 ILE 6 0.206 -0.151 1.297
43 HD11 ILE 6 3HD1 ILE 6 -0.313 1.673 6.024
44 HD12 ILE 6 1HD1 ILE 6 -1.411 0.582 5.134
45 HD13 ILE 6 2HD1 ILE 6 0.346 0.374 5.016
46 H ALA 7 H ALA 7 -0.987 4.635 2.539
47 HA ALA 7 HA ALA 7 1.655 5.280 1.264
48 HB1 ALA 7 HB3 ALA 7 -0.639 7.074 2.150
49 HB2 ALA 7 HB1 ALA 7 0.958 7.632 1.629
50 HB3 ALA 7 HB2 ALA 7 -0.103 6.766 0.486
51 H GLN 8 H GLN 8 3.304 5.914 2.592
52 HA GLN 8 HA GLN 8 3.057 5.592 5.488
53 HB3 GLN 8 HB2 GLN 8 5.507 6.197 5.379
54 HG3 GLN 8 HG2 GLN 8 4.726 3.958 3.465
55 HE21 GLN 8 1HE2 GLN 8 6.854 4.222 2.314
56 HE22 GLN 8 2HE2 GLN 8 8.326 3.941 3.213
57 H ASN 9 H ASN 9 5.026 8.172 4.174
58 HA ASN 9 HA ASN 9 3.346 10.397 5.045
59 HB3 ASN 9 HB2 ASN 9 5.723 10.669 6.592
60 HD21 ASN 9 1HD2 ASN 9 2.389 9.303 7.038
61 HD22 ASN 9 2HD2 ASN 9 1.897 10.578 8.150
62 H TYR 10 H TYR 10 5.498 11.462 2.294
63 HA TYR 10 HA TYR 10 2.775 10.534 3.107
64 HB3 TYR 10 HB2 TYR 10 2.780 13.072 1.652
65 HD1 TYR 10 HD1 TYR 10 0.396 12.540 1.552
66 HD2 TYR 10 HD2 TYR 10 2.448 12.801 5.335
67 HE1 TYR 10 HE1 TYR 10 -1.728 12.055 2.745
68 HE2 TYR 10 HE2 TYR 10 0.326 12.353 6.521
69 HH TYR 10 HH TYR 10 -1.920 11.848 6.306
70 H ASN 11 H ASN 11 1.652 9.617 1.589
71 HA ASN 11 HA ASN 11 1.113 8.700 -0.402
72 HB3 ASN 11 HB2 ASN 11 2.541 10.682 -2.078
73 HD21 ASN 11 1HD2 ASN 11 1.492 10.769 -4.010
74 HD22 ASN 11 2HD2 ASN 11 -0.106 10.097 -4.311
75 H CYS 12 H CYS 12 3.894 8.194 0.837
76 HA CYS 12 HA CYS 12 5.389 7.261 -1.569
77 HB3 CYS 12 HB2 CYS 12 7.322 7.242 -0.145
78 H VAL 13 H VAL 13 5.490 5.061 -1.818
79 HA VAL 13 HA VAL 13 3.851 3.369 -0.081
80 HB VAL 13 HB VAL 13 4.316 1.616 -1.710
81 HG11 VAL 13 1HG1 VAL 13 2.525 3.247 -2.155
82 HG12 VAL 13 2HG1 VAL 13 3.666 4.273 -3.057
83 HG13 VAL 13 3HG1 VAL 13 3.262 2.664 -3.658
84 HG21 VAL 13 3HG2 VAL 13 5.659 2.003 -3.715
85 HG22 VAL 13 1HG2 VAL 13 6.152 3.601 -3.132
86 HG23 VAL 13 2HG2 VAL 13 6.676 2.136 -2.276
87 H TYR 14 H TYR 14 4.964 1.042 0.307
88 HA TYR 14 HA TYR 14 7.408 1.528 1.935
89 HB3 TYR 14 HB2 TYR 14 6.977 -0.833 2.678
90 HD1 TYR 14 HD1 TYR 14 7.238 0.674 4.652
91 HD2 TYR 14 HD2 TYR 14 3.534 0.431 2.470
92 HE1 TYR 14 HE1 TYR 14 6.043 1.742 6.535
93 HE2 TYR 14 HE2 TYR 14 2.353 1.443 4.407
94 HH TYR 14 HH TYR 14 3.989 2.211 7.473
95 H HIS 15 H HIS 15 9.194 0.077 1.721
96 HA HIS 15 HA HIS 15 9.918 -0.764 -0.961
97 HB3 HIS 15 HB2 HIS 15 11.837 -1.802 0.187
98 HD1 HIS 15 HD1 HIS 15 12.241 0.599 2.822
99 HD2 HIS 15 HD2 HIS 15 11.941 0.772 -1.375
100 HE1 HIS 15 HE1 HIS 15 13.270 2.822 2.102
101 H CYS 16 H CYS 16 8.158 -2.071 -1.606
102 HA CYS 16 HA CYS 16 7.172 -4.374 -0.302
103 HB3 CYS 16 HB2 CYS 16 7.361 -3.632 -3.209
104 H ALA 17 H ALA 17 8.825 -5.507 0.739
105 HA ALA 17 HA ALA 17 10.938 -6.863 -0.667
106 HB1 ALA 17 HB3 ALA 17 10.878 -6.604 1.798
107 HB2 ALA 17 HB1 ALA 17 9.473 -7.691 1.873
108 HB3 ALA 17 HB2 ALA 17 11.036 -8.304 1.305
109 H ARG 18 H ARG 18 7.482 -7.632 -0.032
110 HA ARG 18 HA ARG 18 7.353 -9.463 -2.196
111 HB3 ARG 18 HB2 ARG 18 6.758 -10.863 0.397
112 HG3 ARG 18 HG2 ARG 18 6.454 -12.215 -1.627
113 HD3 ARG 18 HD2 ARG 18 8.730 -13.028 -2.625
114 HE ARG 18 HE ARG 18 7.019 -12.027 -3.981
115 HH11 ARG 18 2HH2 ARG 18 9.574 -9.694 -3.094
116 HH12 ARG 18 1HH2 ARG 18 9.660 -8.983 -4.671
117 HH21 ARG 18 1HH1 ARG 18 6.949 -10.910 -5.972
118 HH22 ARG 18 2HH1 ARG 18 7.985 -9.551 -6.257
119 H ASP 19 H ASP 19 5.099 -10.613 -2.162
120 HA ASP 19 HA ASP 19 3.052 -8.614 -1.733
121 HB3 ASP 19 HB2 ASP 19 3.034 -10.141 -3.683
122 H ALA 20 H ALA 20 4.045 -11.750 -0.370
123 HA ALA 20 HA ALA 20 2.175 -11.888 1.800
124 HB1 ALA 20 HB3 ALA 20 3.833 -13.347 2.888
125 HB2 ALA 20 HB1 ALA 20 3.667 -13.744 1.165
126 HB3 ALA 20 HB2 ALA 20 5.082 -12.831 1.733
127 H TYR 21 H TYR 21 5.466 -10.449 1.827
128 HA TYR 21 HA TYR 21 5.525 -9.242 4.371
129 HB3 TYR 21 HB2 TYR 21 6.663 -8.557 1.685
130 HD1 TYR 21 HD2 TYR 21 8.020 -7.626 5.001
131 HD2 TYR 21 HD1 TYR 21 6.177 -6.184 1.376
132 HE1 TYR 21 HE2 TYR 21 8.896 -5.363 5.447
133 HE2 TYR 21 HE1 TYR 21 6.932 -3.896 1.913
134 HH TYR 21 HH TYR 21 8.992 -3.049 2.824
135 H CYS 22 H CYS 22 4.274 -7.761 1.310
136 HA CYS 22 HA CYS 22 3.204 -5.459 2.597
137 HB3 CYS 22 HB2 CYS 22 1.564 -5.494 0.583
138 H ASN 23 H ASN 23 1.670 -8.615 1.948
139 HA ASN 23 HA ASN 23 -0.887 -8.074 2.990
140 HB3 ASN 23 HB2 ASN 23 0.645 -10.391 2.149
141 HD21 ASN 23 1HD2 ASN 23 -2.377 -10.855 3.890
142 HD22 ASN 23 2HD2 ASN 23 -1.689 -11.995 5.060
143 H GLU 24 H GLU 24 2.019 -9.252 4.740
144 HA GLU 24 HA GLU 24 0.840 -9.393 7.279
145 HB3 GLU 24 HB2 GLU 24 3.711 -8.858 6.363
146 HG3 GLU 24 HG2 GLU 24 2.591 -9.281 9.140
147 H LEU 25 H LEU 25 2.617 -6.683 5.681
148 HA LEU 25 HA LEU 25 2.514 -4.890 7.823
149 HB3 LEU 25 HB2 LEU 25 2.375 -4.074 4.875
150 HG LEU 25 HG LEU 25 3.616 -2.934 7.398
151 HD11 LEU 25 1HD1 LEU 25 5.471 -3.218 5.791
152 HD12 LEU 25 2HD1 LEU 25 4.530 -2.373 4.543
153 HD13 LEU 25 3HD1 LEU 25 5.064 -1.512 6.004
154 HD21 LEU 25 3HD2 LEU 25 2.168 -1.619 5.050
155 HD22 LEU 25 1HD2 LEU 25 1.449 -2.010 6.622
156 HD23 LEU 25 2HD2 LEU 25 2.734 -0.812 6.532
157 H CYS 26 H CYS 26 0.289 -5.202 5.109
158 HA CYS 26 HA CYS 26 -1.693 -3.346 5.744
159 HB3 CYS 26 HB2 CYS 26 -3.173 -4.795 4.358
160 H THR 27 H THR 27 -1.625 -6.861 6.743
161 HA THR 27 HA THR 27 -3.948 -6.596 8.389
162 HB THR 27 HB THR 27 -3.246 -8.656 9.507
163 HG1 THR 27 HG1 THR 27 -0.832 -8.119 8.201
164 HG21 THR 27 3HG2 THR 27 -2.904 -8.796 6.496
165 HG22 THR 27 1HG2 THR 27 -3.386 -10.114 7.574
166 HG23 THR 27 2HG2 THR 27 -4.458 -8.716 7.351
167 H LYS 28 H LYS 28 -0.548 -5.890 9.078
168 HA LYS 28 HA LYS 28 -0.857 -5.498 11.889
169 HB3 LYS 28 HB2 LYS 28 1.116 -3.726 10.583
170 HG3 LYS 28 HG2 LYS 28 1.346 -6.167 12.417
171 HD3 LYS 28 HD2 LYS 28 3.539 -5.130 13.064
172 HE3 LYS 28 HE2 LYS 28 4.916 -5.687 11.134
173 HZ1 LYS 28 HZ3 LYS 28 3.816 -7.564 12.269
174 HZ2 LYS 28 HZ1 LYS 28 2.672 -7.583 11.073
175 HZ3 LYS 28 HZ2 LYS 28 4.242 -7.872 10.733
176 H ASN 29 H ASN 29 -1.691 -3.560 9.078
177 HA ASN 29 HA ASN 29 -2.341 -1.169 10.691
178 HB3 ASN 29 HB2 ASN 29 -2.866 -0.111 8.653
179 HD21 ASN 29 1HD2 ASN 29 -0.264 -0.865 9.900
180 HD22 ASN 29 2HD2 ASN 29 0.871 -0.883 8.562
181 H GLY 30 H GLY 30 -3.822 -4.095 10.606
182 HA2 GLY 30 HA2 GLY 30 -5.924 -4.767 11.109
183 HA3 GLY 30 HA3 GLY 30 -6.421 -3.079 11.305
184 H ALA 31 H ALA 31 -4.942 -4.225 8.272
185 HA ALA 31 HA ALA 31 -7.502 -3.822 6.835
186 HB1 ALA 31 HB3 ALA 31 -4.838 -4.621 5.687
187 HB2 ALA 31 HB1 ALA 31 -6.143 -3.735 4.884
188 HB3 ALA 31 HB2 ALA 31 -5.169 -2.927 6.112
189 H LYS 32 H LYS 32 -8.088 -5.654 5.183
190 HA LYS 32 HA LYS 32 -8.197 -8.094 6.744
191 HB3 LYS 32 HB2 LYS 32 -10.001 -7.320 5.153
192 HG3 LYS 32 HG2 LYS 32 -8.592 -9.068 3.112
193 HD3 LYS 32 HD2 LYS 32 -9.899 -7.881 1.465
194 HE3 LYS 32 HE2 LYS 32 -11.384 -9.136 3.665
195 HZ1 LYS 32 HZ3 LYS 32 -12.691 -7.253 3.855
196 HZ2 LYS 32 HZ1 LYS 32 -12.564 -6.782 2.362
197 HZ3 LYS 32 HZ2 LYS 32 -13.527 -8.100 2.712
198 H SER 33 H SER 33 -6.170 -7.036 4.022
199 HA SER 33 HA SER 33 -4.014 -8.677 4.564
200 HB3 SER 33 HB2 SER 33 -5.641 -9.815 2.247
201 HG SER 33 HG SER 33 -3.949 -11.383 2.312
202 H GLY 34 H GLY 34 -3.023 -8.980 1.918
203 HA2 GLY 34 HA2 GLY 34 -3.215 -6.431 0.523
204 HA3 GLY 34 HA3 GLY 34 -1.712 -6.636 1.429
205 H SER 35 H SER 35 -1.376 -6.297 -1.189
206 HA SER 35 HA SER 35 -0.077 -8.783 -1.877
207 HB3 SER 35 HB2 SER 35 -1.053 -9.215 -3.975
208 HG SER 35 HG SER 35 -2.547 -9.488 -2.127
209 H CYS 36 H CYS 36 1.445 -8.312 -3.802
210 HA CYS 36 HA CYS 36 2.100 -5.389 -3.941
211 HB3 CYS 36 HB2 CYS 36 4.012 -7.694 -3.770
212 HA PRO 37 HA PRO 37 1.780 -6.491 -8.436
213 HB3 PRO 37 HB2 PRO 37 -0.027 -5.152 -8.836
214 HG3 PRO 37 HG2 PRO 37 -0.720 -3.529 -7.235
215 HD3 PRO 37 HD2 PRO 37 -0.446 -5.632 -6.120
216 H TYR 38 H TYR 38 3.905 -6.748 -8.800
217 HA TYR 38 HA TYR 38 5.989 -4.726 -8.474
218 HB3 TYR 38 HB2 TYR 38 6.856 -6.373 -10.463
219 HD1 TYR 38 HD2 TYR 38 6.209 -6.490 -6.773
220 HD2 TYR 38 HD1 TYR 38 8.826 -7.562 -10.030
221 HE1 TYR 38 HE2 TYR 38 8.042 -6.948 -5.166
222 HE2 TYR 38 HE1 TYR 38 10.615 -8.101 -8.420
223 HH TYR 38 HH TYR 38 11.274 -7.997 -6.180
224 H LEU 39 H LEU 39 3.645 -5.648 -10.973
225 HA LEU 39 HA LEU 39 4.592 -3.411 -12.717
226 HB3 LEU 39 HB2 LEU 39 3.896 -4.805 -14.640
227 HG LEU 39 HG LEU 39 5.904 -6.278 -12.870
228 HD11 LEU 39 1HD1 LEU 39 5.391 -6.441 -15.867
229 HD12 LEU 39 2HD1 LEU 39 6.682 -7.274 -14.977
230 HD13 LEU 39 3HD1 LEU 39 4.988 -7.690 -14.669
231 HD21 LEU 39 3HD2 LEU 39 6.298 -4.162 -15.039
232 HD22 LEU 39 1HD2 LEU 39 6.683 -3.984 -13.312
233 HD23 LEU 39 2HD2 LEU 39 7.597 -5.121 -14.303
234 H GLY 40 H GLY 40 2.824 -2.658 -14.165
235 HA2 GLY 40 HA2 GLY 40 0.673 -1.931 -14.541
236 HA3 GLY 40 HA3 GLY 40 0.072 -3.172 -13.433
237 H GLU 41 H GLU 41 -1.152 -2.128 -11.937
238 HA GLU 41 HA GLU 41 -1.214 0.562 -11.376
239 HB3 GLU 41 HB2 GLU 41 -2.410 -0.098 -9.314
240 HG3 GLU 41 HG2 GLU 41 -3.272 -1.705 -11.753
241 H HIS 42 H HIS 42 0.389 1.757 -10.664
242 HA HIS 42 HA HIS 42 2.209 2.532 -9.490
243 HB3 HIS 42 HB2 HIS 42 2.014 2.342 -7.014
244 HD1 HIS 42 HD1 HIS 42 0.239 3.897 -9.710
245 HD2 HIS 42 HD2 HIS 42 -0.346 3.332 -5.590
246 HE1 HIS 42 HE1 HIS 42 -1.303 5.772 -8.932
247 H LYS 43 H LYS 43 2.633 0.107 -10.844
248 HA LYS 43 HA LYS 43 3.929 -1.948 -10.239
249 HB3 LYS 43 HB2 LYS 43 4.159 -0.970 -12.349
250 HG3 LYS 43 HG2 LYS 43 6.381 0.874 -11.453
251 HD3 LYS 43 HD2 LYS 43 6.006 0.295 -13.900
252 HE3 LYS 43 HE2 LYS 43 3.515 2.030 -13.414
253 HZ1 LYS 43 HZ3 LYS 43 4.603 2.619 -15.469
254 HZ2 LYS 43 HZ1 LYS 43 4.605 1.049 -15.968
255 HZ3 LYS 43 HZ2 LYS 43 3.183 1.848 -15.762
256 H PHE 44 H PHE 44 4.680 -2.587 -8.362
257 HA PHE 44 HA PHE 44 6.053 -3.048 -6.654
258 HB3 PHE 44 HB2 PHE 44 7.998 -1.634 -6.028
259 HD1 PHE 44 HD2 PHE 44 7.881 -2.010 -9.762
260 HD2 PHE 44 HD1 PHE 44 9.286 -3.602 -6.004
261 HE1 PHE 44 HE2 PHE 44 9.331 -3.602 -10.974
262 HE2 PHE 44 HE1 PHE 44 10.884 -5.037 -7.223
263 HZ PHE 44 HZ PHE 44 10.875 -5.091 -9.711
264 H ALA 45 H ALA 45 3.778 -2.413 -5.963
265 HA ALA 45 HA ALA 45 4.210 -0.633 -3.638
266 HB1 ALA 45 HB3 ALA 45 3.314 0.918 -5.317
267 HB2 ALA 45 HB1 ALA 45 1.948 -0.181 -5.626
268 HB3 ALA 45 HB2 ALA 45 2.113 0.622 -4.047
269 H CYS 46 H CYS 46 2.670 -0.953 -1.944
270 HA CYS 46 HA CYS 46 1.624 -3.703 -1.840
271 HB3 CYS 46 HB2 CYS 46 1.151 -3.102 0.523
272 H TYR 47 H TYR 47 -0.395 -3.888 -2.859
273 HA TYR 47 HA TYR 47 -2.459 -1.832 -2.340
274 HB3 TYR 47 HB2 TYR 47 -2.884 -4.425 -3.844
275 HD1 TYR 47 HD1 TYR 47 -3.602 -0.724 -4.030
276 HD2 TYR 47 HD2 TYR 47 -5.319 -4.672 -3.945
277 HE1 TYR 47 HE1 TYR 47 -5.810 0.213 -4.633
278 HE2 TYR 47 HE2 TYR 47 -7.515 -3.733 -4.476
279 HH TYR 47 HH TYR 47 -8.731 -1.820 -4.864
280 H CYS 48 H CYS 48 -3.069 -1.913 -0.271
281 HA CYS 48 HA CYS 48 -3.539 -4.414 1.207
282 HB3 CYS 48 HB2 CYS 48 -4.383 -2.912 2.955
283 H LYS 49 H LYS 49 -5.679 -4.990 1.969
284 HA LYS 49 HA LYS 49 -7.890 -3.838 0.390
285 HB3 LYS 49 HB2 LYS 49 -9.022 -5.917 0.214
286 HG3 LYS 49 HG2 LYS 49 -6.885 -5.442 -1.363
287 HD3 LYS 49 HD2 LYS 49 -6.447 -8.043 0.206
288 HE3 LYS 49 HE2 LYS 49 -5.959 -8.449 -2.190
289 HZ1 LYS 49 HZ3 LYS 49 -3.794 -7.513 -2.855
290 HZ2 LYS 49 HZ1 LYS 49 -5.077 -6.469 -3.008
291 HZ3 LYS 49 HZ2 LYS 49 -3.982 -6.266 -1.790
292 H ASP 50 H ASP 50 -9.853 -3.705 1.485
293 HA ASP 50 HA ASP 50 -10.931 -2.688 3.234
294 HB3 ASP 50 HB2 ASP 50 -10.850 -4.114 5.425
295 H LEU 51 H LEU 51 -8.454 -1.459 2.785
296 HA LEU 51 HA LEU 51 -6.940 -1.210 5.230
297 HB3 LEU 51 HB2 LEU 51 -7.124 0.678 2.851
298 HG LEU 51 HG LEU 51 -6.010 1.546 5.011
299 HD11 LEU 51 1HD1 LEU 51 -4.821 -0.620 5.601
300 HD12 LEU 51 2HD1 LEU 51 -3.826 -0.402 4.156
301 HD13 LEU 51 3HD1 LEU 51 -3.751 0.773 5.476
302 HD21 LEU 51 3HD2 LEU 51 -5.622 2.561 2.818
303 HD22 LEU 51 1HD2 LEU 51 -4.120 2.525 3.753
304 HD23 LEU 51 2HD2 LEU 51 -4.376 1.345 2.449
305 HA PRO 52 HA PRO 52 -10.260 1.278 7.007
306 HB3 PRO 52 HB2 PRO 52 -9.691 0.464 9.062
307 HG3 PRO 52 HG2 PRO 52 -7.416 0.004 9.634
308 HD3 PRO 52 HD2 PRO 52 -7.824 -1.141 7.592
309 H ASP 53 H ASP 53 -10.924 3.355 6.979
310 HA ASP 53 HA ASP 53 -9.946 5.226 5.375
311 HB3 ASP 53 HB2 ASP 53 -11.473 6.767 6.482
312 H ASN 54 H ASN 54 -9.255 5.077 8.830
313 HA ASN 54 HA ASN 54 -7.854 7.350 9.378
314 HB3 ASN 54 HB2 ASN 54 -6.579 6.045 11.017
315 HD21 ASN 54 1HD2 ASN 54 -7.840 6.373 12.842
316 HD22 ASN 54 2HD2 ASN 54 -9.466 5.733 13.016
317 H VAL 55 H VAL 55 -6.577 4.539 7.533
318 HA VAL 55 HA VAL 55 -3.867 5.674 7.616
319 HB VAL 55 HB VAL 55 -4.891 3.092 6.402
320 HG11 VAL 55 1HG1 VAL 55 -2.512 2.436 6.473
321 HG12 VAL 55 2HG1 VAL 55 -2.732 3.857 5.437
322 HG13 VAL 55 3HG1 VAL 55 -2.062 4.037 7.073
323 HG21 VAL 55 3HG2 VAL 55 -3.914 2.034 8.415
324 HG22 VAL 55 1HG2 VAL 55 -3.527 3.632 9.082
325 HG23 VAL 55 2HG2 VAL 55 -5.215 3.135 8.870
326 HA PRO 56 HA PRO 56 -4.845 7.724 3.808
327 HB3 PRO 56 HB2 PRO 56 -3.343 9.337 4.443
328 HG3 PRO 56 HG2 PRO 56 -1.271 8.761 5.506
329 HD3 PRO 56 HD2 PRO 56 -3.001 7.732 6.776
330 H ILE 57 H ILE 57 -4.695 7.604 1.580
331 HA ILE 57 HA ILE 57 -3.722 5.025 0.467
332 HB ILE 57 HB ILE 57 -5.427 5.245 -1.176
333 HG13 ILE 57 2HG1 ILE 57 -5.783 8.074 -0.162
334 HG21 ILE 57 1HG2 ILE 57 -7.363 4.958 0.209
335 HG22 ILE 57 2HG2 ILE 57 -5.972 4.405 1.166
336 HG23 ILE 57 3HG2 ILE 57 -6.684 6.000 1.472
337 HD11 ILE 57 3HD1 ILE 57 -4.786 7.726 -2.429
338 HD12 ILE 57 1HD1 ILE 57 -6.189 6.739 -2.886
339 HD13 ILE 57 2HD1 ILE 57 -6.385 8.465 -2.536
340 H ARG 58 H ARG 58 -2.718 5.063 -1.603
341 HA ARG 58 HA ARG 58 -0.953 7.319 -1.993
342 HB3 ARG 58 HB2 ARG 58 -1.048 4.993 -3.895
343 HG3 ARG 58 HG2 ARG 58 1.397 5.046 -3.524
344 HD3 ARG 58 HD2 ARG 58 0.167 7.710 -4.238
345 HE ARG 58 HE ARG 58 2.779 7.470 -3.731
346 HH11 ARG 58 2HH2 ARG 58 0.695 8.453 -6.366
347 HH12 ARG 58 1HH2 ARG 58 1.944 9.429 -7.136
348 HH21 ARG 58 1HH1 ARG 58 4.285 8.963 -4.640
349 HH22 ARG 58 2HH1 ARG 58 3.763 9.889 -6.042
350 H VAL 59 H VAL 59 -1.846 9.134 -2.986
351 HA VAL 59 HA VAL 59 -3.930 9.015 -4.985
352 HB VAL 59 HB VAL 59 -2.186 11.058 -3.565
353 HG11 VAL 59 1HG1 VAL 59 -3.197 12.896 -4.726
354 HG12 VAL 59 2HG1 VAL 59 -2.175 11.922 -5.784
355 HG13 VAL 59 3HG1 VAL 59 -3.957 11.794 -5.891
356 HG21 VAL 59 3HG2 VAL 59 -4.351 11.931 -2.820
357 HG22 VAL 59 1HG2 VAL 59 -5.203 10.743 -3.829
358 HG23 VAL 59 2HG2 VAL 59 -4.219 10.205 -2.449
359 HA PRO 60 HA PRO 60 -0.915 8.534 -8.312
360 HB3 PRO 60 HB2 PRO 60 -2.700 7.847 -9.595
361 HG3 PRO 60 HG2 PRO 60 -4.811 8.998 -9.559
362 HD3 PRO 60 HD2 PRO 60 -4.284 8.247 -7.355
363 H GLY 61 H GLY 61 0.093 10.456 -6.905
364 HA2 GLY 61 HA2 GLY 61 0.990 12.449 -8.902
365 HA3 GLY 61 HA3 GLY 61 0.219 13.056 -7.426
366 H LYS 62 H LYS 62 2.014 14.023 -6.562
367 HA LYS 62 HA LYS 62 4.657 12.994 -6.511
368 HB3 LYS 62 HB2 LYS 62 4.426 14.867 -4.379
369 HG3 LYS 62 HG2 LYS 62 5.023 16.577 -6.101
370 HD3 LYS 62 HD2 LYS 62 6.679 14.002 -6.199
371 HE3 LYS 62 HE2 LYS 62 7.419 15.722 -7.842
372 HZ1 LYS 62 HZ3 LYS 62 8.465 17.690 -6.945
373 HZ2 LYS 62 HZ1 LYS 62 6.856 17.724 -6.623
374 HZ3 LYS 62 HZ2 LYS 62 7.930 17.353 -5.430
375 H CYS 63 H CYS 63 5.822 13.051 -4.189
376 HA CYS 63 HA CYS 63 4.383 11.734 -2.065
377 HB3 CYS 63 HB2 CYS 63 6.285 10.312 -3.813
378 H HIS 64 H HIS 64 5.270 12.494 -0.085
379 HA HIS 64 HA HIS 64 7.230 14.716 -0.381
380 HB3 HIS 64 HB2 HIS 64 6.171 15.557 1.640
381 HD1 HIS 64 HD1 HIS 64 4.558 17.457 1.024
382 HD2 HIS 64 HD2 HIS 64 3.511 13.761 -0.694
383 HE1 HIS 64 HE1 HIS 64 2.387 17.818 -0.268
Start of MODEL 6
1 H1 VAL 1 H VAL 1 -15.230 1.398 5.109
2 HA VAL 1 HA VAL 1 -12.564 0.780 5.707
3 HB VAL 1 HB VAL 1 -12.657 -1.656 5.124
4 HG11 VAL 1 1HG1 VAL 1 -12.357 -0.963 7.451
5 HG12 VAL 1 2HG1 VAL 1 -14.120 -0.922 7.689
6 HG13 VAL 1 3HG1 VAL 1 -13.295 -2.458 7.341
7 HG21 VAL 1 3HG2 VAL 1 -14.910 -1.737 4.083
8 HG22 VAL 1 1HG2 VAL 1 -14.762 -2.903 5.405
9 HG23 VAL 1 2HG2 VAL 1 -15.656 -1.396 5.662
10 H ARG 2 H ARG 2 -11.502 -0.138 3.661
11 HA ARG 2 HA ARG 2 -12.957 -0.014 1.148
12 HB3 ARG 2 HB2 ARG 2 -12.764 2.375 1.508
13 HG3 ARG 2 HG2 ARG 2 -9.792 1.893 2.067
14 HD3 ARG 2 HD2 ARG 2 -11.482 4.350 1.558
15 HE ARG 2 HE ARG 2 -10.661 5.340 3.399
16 HH11 ARG 2 2HH2 ARG 2 -8.026 3.172 2.385
17 HH12 ARG 2 1HH2 ARG 2 -6.830 4.136 3.265
18 HH21 ARG 2 1HH1 ARG 2 -9.078 6.442 4.529
19 HH22 ARG 2 2HH1 ARG 2 -7.386 5.971 4.346
20 H ASP 3 H ASP 3 -11.127 -0.034 -0.641
21 HA ASP 3 HA ASP 3 -8.728 -1.555 0.319
22 HB3 ASP 3 HB2 ASP 3 -8.460 -2.493 -1.827
23 H ALA 4 H ALA 4 -6.751 -0.759 -0.698
24 HA ALA 4 HA ALA 4 -6.725 1.299 -2.633
25 HB1 ALA 4 HB3 ALA 4 -5.990 3.228 -1.283
26 HB2 ALA 4 HB1 ALA 4 -7.636 2.796 -0.845
27 HB3 ALA 4 HB2 ALA 4 -6.289 2.330 0.210
28 H TYR 5 H TYR 5 -4.443 2.387 -2.570
29 HA TYR 5 HA TYR 5 -2.334 0.416 -1.947
30 HB3 TYR 5 HB2 TYR 5 -0.879 2.298 -2.729
31 HD1 TYR 5 HD2 TYR 5 -0.484 0.225 -4.058
32 HD2 TYR 5 HD1 TYR 5 -3.655 2.981 -5.009
33 HE1 TYR 5 HE2 TYR 5 -0.837 -0.932 -6.214
34 HE2 TYR 5 HE1 TYR 5 -3.961 1.858 -7.203
35 HH TYR 5 HH TYR 5 -1.799 -0.743 -8.283
36 H ILE 6 H ILE 6 -1.810 0.288 0.300
37 HA ILE 6 HA ILE 6 -2.488 2.406 2.072
38 HB ILE 6 HB ILE 6 -2.080 0.073 2.744
39 HG13 ILE 6 2HG1 ILE 6 -2.025 2.056 4.292
40 HG21 ILE 6 1HG2 ILE 6 0.905 0.675 2.452
41 HG22 ILE 6 2HG2 ILE 6 0.183 -0.831 3.024
42 HG23 ILE 6 3HG2 ILE 6 -0.018 -0.351 1.339
43 HD11 ILE 6 3HD1 ILE 6 -1.967 -0.305 5.082
44 HD12 ILE 6 1HD1 ILE 6 -0.194 -0.195 5.143
45 HD13 ILE 6 2HD1 ILE 6 -1.178 0.860 6.180
46 H ALA 7 H ALA 7 -1.258 4.107 2.885
47 HA ALA 7 HA ALA 7 1.446 4.549 1.692
48 HB1 ALA 7 HB3 ALA 7 0.919 6.923 1.407
49 HB2 ALA 7 HB1 ALA 7 -0.170 5.912 0.440
50 HB3 ALA 7 HB2 ALA 7 -0.750 6.645 1.951
51 H GLN 8 H GLN 8 2.735 6.029 2.903
52 HA GLN 8 HA GLN 8 1.981 6.467 5.751
53 HB3 GLN 8 HB2 GLN 8 3.463 4.590 5.819
54 HG3 GLN 8 HG2 GLN 8 5.178 6.127 3.836
55 HE21 GLN 8 1HE2 GLN 8 6.800 4.098 2.997
56 HE22 GLN 8 2HE2 GLN 8 7.910 3.698 4.304
57 H ASN 9 H ASN 9 3.816 8.004 6.635
58 HA ASN 9 HA ASN 9 3.604 10.574 5.552
59 HB3 ASN 9 HB2 ASN 9 4.173 10.321 7.786
60 HD21 ASN 9 1HD2 ASN 9 7.563 10.209 7.500
61 HD22 ASN 9 2HD2 ASN 9 7.768 8.591 8.145
62 H TYR 10 H TYR 10 6.065 10.530 2.851
63 HA TYR 10 HA TYR 10 3.252 11.146 3.644
64 HB3 TYR 10 HB2 TYR 10 4.471 13.275 2.159
65 HD1 TYR 10 HD1 TYR 10 2.115 13.974 2.376
66 HD2 TYR 10 HD2 TYR 10 4.595 13.324 5.842
67 HE1 TYR 10 HE1 TYR 10 0.382 15.011 3.819
68 HE2 TYR 10 HE2 TYR 10 2.868 14.362 7.276
69 HH TYR 10 HH TYR 10 0.767 15.321 7.356
70 H ASN 11 H ASN 11 2.357 9.742 2.387
71 HA ASN 11 HA ASN 11 1.190 9.155 0.576
72 HB3 ASN 11 HB2 ASN 11 2.935 10.648 -1.374
73 HD21 ASN 11 1HD2 ASN 11 1.894 11.032 -3.362
74 HD22 ASN 11 2HD2 ASN 11 0.447 10.134 -3.798
75 H CYS 12 H CYS 12 3.979 8.186 1.558
76 HA CYS 12 HA CYS 12 5.118 7.095 -0.967
77 HB3 CYS 12 HB2 CYS 12 7.072 6.625 0.426
78 H VAL 13 H VAL 13 5.426 4.852 -1.226
79 HA VAL 13 HA VAL 13 3.551 3.113 0.208
80 HB VAL 13 HB VAL 13 4.502 1.330 -1.201
81 HG11 VAL 13 1HG1 VAL 13 2.668 2.709 -2.055
82 HG12 VAL 13 2HG1 VAL 13 3.842 3.811 -2.818
83 HG13 VAL 13 3HG1 VAL 13 3.722 2.124 -3.354
84 HG21 VAL 13 3HG2 VAL 13 6.152 1.768 -2.932
85 HG22 VAL 13 1HG2 VAL 13 6.348 3.445 -2.402
86 HG23 VAL 13 2HG2 VAL 13 6.862 2.108 -1.352
87 H TYR 14 H TYR 14 4.607 0.932 0.924
88 HA TYR 14 HA TYR 14 7.146 1.350 2.434
89 HB3 TYR 14 HB2 TYR 14 6.617 -0.830 3.445
90 HD1 TYR 14 HD2 TYR 14 7.022 0.852 5.245
91 HD2 TYR 14 HD1 TYR 14 3.180 0.445 3.335
92 HE1 TYR 14 HE2 TYR 14 5.953 1.995 7.156
93 HE2 TYR 14 HE1 TYR 14 2.104 1.559 5.267
94 HH TYR 14 HH TYR 14 3.991 2.877 7.997
95 H HIS 15 H HIS 15 8.913 0.185 1.669
96 HA HIS 15 HA HIS 15 8.901 -0.398 -1.114
97 HB3 HIS 15 HB2 HIS 15 11.227 -1.071 -0.759
98 HD1 HIS 15 HD1 HIS 15 11.732 1.039 2.185
99 HD2 HIS 15 HD2 HIS 15 10.437 1.610 -1.781
100 HE1 HIS 15 HE1 HIS 15 11.934 3.537 1.697
101 H CYS 16 H CYS 16 8.174 -2.178 -2.122
102 HA CYS 16 HA CYS 16 7.168 -4.471 -0.796
103 HB3 CYS 16 HB2 CYS 16 7.994 -4.089 -3.671
104 H ALA 17 H ALA 17 9.105 -4.990 0.578
105 HA ALA 17 HA ALA 17 11.332 -6.421 -0.480
106 HB1 ALA 17 HB3 ALA 17 11.076 -5.853 1.918
107 HB2 ALA 17 HB1 ALA 17 9.754 -7.032 2.054
108 HB3 ALA 17 HB2 ALA 17 11.394 -7.583 1.676
109 H ARG 18 H ARG 18 7.930 -7.335 0.011
110 HA ARG 18 HA ARG 18 7.948 -9.157 -2.118
111 HB3 ARG 18 HB2 ARG 18 7.026 -10.741 0.204
112 HG3 ARG 18 HG2 ARG 18 7.429 -11.643 -2.122
113 HD3 ARG 18 HD2 ARG 18 10.319 -11.349 -1.191
114 HE ARG 18 HE ARG 18 9.237 -13.335 -2.900
115 HH11 ARG 18 2HH2 ARG 18 11.753 -10.884 -2.873
116 HH12 ARG 18 1HH2 ARG 18 12.849 -11.719 -3.934
117 HH21 ARG 18 1HH1 ARG 18 10.658 -14.521 -4.321
118 HH22 ARG 18 2HH1 ARG 18 12.193 -13.860 -4.780
119 H ASP 19 H ASP 19 5.725 -10.231 -2.246
120 HA ASP 19 HA ASP 19 3.541 -8.390 -1.832
121 HB3 ASP 19 HB2 ASP 19 3.592 -9.972 -3.717
122 H ALA 20 H ALA 20 4.673 -11.454 -0.420
123 HA ALA 20 HA ALA 20 2.853 -11.618 1.698
124 HB1 ALA 20 HB3 ALA 20 5.785 -12.480 1.712
125 HB2 ALA 20 HB1 ALA 20 4.521 -13.068 2.813
126 HB3 ALA 20 HB2 ALA 20 4.420 -13.425 1.077
127 H TYR 21 H TYR 21 5.984 -9.871 1.706
128 HA TYR 21 HA TYR 21 5.904 -8.941 4.403
129 HB3 TYR 21 HB2 TYR 21 7.170 -7.964 1.849
130 HD1 TYR 21 HD2 TYR 21 8.042 -7.225 5.402
131 HD2 TYR 21 HD1 TYR 21 6.767 -5.620 1.606
132 HE1 TYR 21 HE2 TYR 21 8.379 -4.929 6.255
133 HE2 TYR 21 HE1 TYR 21 7.028 -3.328 2.486
134 HH TYR 21 HH TYR 21 8.252 -2.684 5.788
135 H CYS 22 H CYS 22 4.745 -7.395 1.344
136 HA CYS 22 HA CYS 22 3.601 -5.188 2.778
137 HB3 CYS 22 HB2 CYS 22 2.108 -5.123 0.563
138 H ASN 23 H ASN 23 2.167 -8.355 1.907
139 HA ASN 23 HA ASN 23 -0.496 -7.834 2.799
140 HB3 ASN 23 HB2 ASN 23 1.101 -10.420 2.858
141 HD21 ASN 23 1HD2 ASN 23 -0.141 -10.916 4.923
142 HD22 ASN 23 2HD2 ASN 23 -1.803 -11.425 4.719
143 H GLU 24 H GLU 24 2.356 -9.147 4.588
144 HA GLU 24 HA GLU 24 1.240 -9.448 7.133
145 HB3 GLU 24 HB2 GLU 24 4.019 -8.732 6.118
146 HG3 GLU 24 HG2 GLU 24 3.197 -9.415 8.938
147 H LEU 25 H LEU 25 2.844 -6.589 5.679
148 HA LEU 25 HA LEU 25 2.441 -4.849 7.840
149 HB3 LEU 25 HB2 LEU 25 2.513 -4.030 4.895
150 HG LEU 25 HG LEU 25 2.952 -2.639 7.538
151 HD11 LEU 25 1HD1 LEU 25 4.487 -2.030 4.985
152 HD12 LEU 25 2HD1 LEU 25 4.478 -1.049 6.474
153 HD13 LEU 25 3HD1 LEU 25 5.191 -2.668 6.489
154 HD21 LEU 25 3HD2 LEU 25 0.943 -2.119 6.062
155 HD22 LEU 25 1HD2 LEU 25 2.001 -0.741 6.347
156 HD23 LEU 25 2HD2 LEU 25 2.069 -1.609 4.797
157 H CYS 26 H CYS 26 0.304 -5.447 5.018
158 HA CYS 26 HA CYS 26 -1.725 -3.596 5.570
159 HB3 CYS 26 HB2 CYS 26 -3.251 -5.113 4.358
160 H THR 27 H THR 27 -1.517 -7.065 6.696
161 HA THR 27 HA THR 27 -3.751 -6.875 8.462
162 HB THR 27 HB THR 27 -2.550 -8.851 9.600
163 HG1 THR 27 HG1 THR 27 -0.473 -8.218 8.451
164 HG21 THR 27 3HG2 THR 27 -3.198 -10.336 7.720
165 HG22 THR 27 1HG2 THR 27 -4.423 -9.082 7.987
166 HG23 THR 27 2HG2 THR 27 -3.280 -8.935 6.634
167 H LYS 28 H LYS 28 -0.324 -6.066 9.091
168 HA LYS 28 HA LYS 28 -0.695 -5.567 11.853
169 HB3 LYS 28 HB2 LYS 28 1.144 -3.845 10.200
170 HG3 LYS 28 HG2 LYS 28 1.720 -5.520 12.666
171 HD3 LYS 28 HD2 LYS 28 3.565 -4.267 11.386
172 HE3 LYS 28 HE2 LYS 28 2.132 -1.916 12.761
173 HZ1 LYS 28 HZ3 LYS 28 3.909 -0.599 11.898
174 HZ2 LYS 28 HZ1 LYS 28 4.516 -1.732 12.921
175 HZ3 LYS 28 HZ2 LYS 28 4.682 -1.919 11.292
176 H ASN 29 H ASN 29 -1.531 -3.674 8.990
177 HA ASN 29 HA ASN 29 -2.375 -1.332 10.648
178 HB3 ASN 29 HB2 ASN 29 -2.593 -0.219 8.419
179 HD21 ASN 29 1HD2 ASN 29 0.316 -2.324 8.452
180 HD22 ASN 29 2HD2 ASN 29 1.420 -1.019 8.873
181 H GLY 30 H GLY 30 -3.802 -4.106 10.322
182 HA2 GLY 30 HA2 GLY 30 -5.980 -4.706 10.489
183 HA3 GLY 30 HA3 GLY 30 -6.379 -2.993 10.674
184 H ALA 31 H ALA 31 -4.841 -4.445 7.830
185 HA ALA 31 HA ALA 31 -7.362 -4.264 6.225
186 HB1 ALA 31 HB3 ALA 31 -6.000 -2.924 4.954
187 HB2 ALA 31 HB1 ALA 31 -4.497 -3.624 5.577
188 HB3 ALA 31 HB2 ALA 31 -5.448 -4.491 4.354
189 H LYS 32 H LYS 32 -7.792 -6.196 4.935
190 HA LYS 32 HA LYS 32 -7.193 -8.419 6.698
191 HB3 LYS 32 HB2 LYS 32 -9.388 -8.145 5.747
192 HG3 LYS 32 HG2 LYS 32 -8.045 -8.921 3.126
193 HD3 LYS 32 HD2 LYS 32 -10.063 -10.350 3.614
194 HE3 LYS 32 HE2 LYS 32 -12.248 -9.425 3.035
195 HZ1 LYS 32 HZ3 LYS 32 -11.356 -7.680 5.233
196 HZ2 LYS 32 HZ1 LYS 32 -12.796 -8.282 4.987
197 HZ3 LYS 32 HZ2 LYS 32 -11.584 -9.305 5.446
198 H SER 33 H SER 33 -5.854 -7.370 3.607
199 HA SER 33 HA SER 33 -3.727 -9.294 3.679
200 HB3 SER 33 HB2 SER 33 -4.344 -10.600 1.694
201 HG SER 33 HG SER 33 -5.679 -10.938 3.783
202 H GLY 34 H GLY 34 -2.453 -9.045 1.439
203 HA2 GLY 34 HA2 GLY 34 -3.331 -6.917 -0.278
204 HA3 GLY 34 HA3 GLY 34 -1.915 -6.420 0.678
205 H SER 35 H SER 35 -1.295 -6.351 -1.799
206 HA SER 35 HA SER 35 0.594 -8.528 -2.151
207 HB3 SER 35 HB2 SER 35 -0.165 -9.245 -4.358
208 HG SER 35 HG SER 35 -1.412 -9.867 -2.209
209 H CYS 36 H CYS 36 2.113 -8.012 -3.938
210 HA CYS 36 HA CYS 36 2.342 -5.094 -4.404
211 HB3 CYS 36 HB2 CYS 36 4.551 -5.555 -5.210
212 HA PRO 37 HA PRO 37 1.074 -6.242 -8.760
213 HB3 PRO 37 HB2 PRO 37 -0.819 -4.908 -8.740
214 HG3 PRO 37 HG2 PRO 37 -1.075 -3.147 -7.157
215 HD3 PRO 37 HD2 PRO 37 -0.564 -5.073 -5.870
216 H TYR 38 H TYR 38 2.850 -6.133 -10.037
217 HA TYR 38 HA TYR 38 5.085 -4.316 -9.252
218 HB3 TYR 38 HB2 TYR 38 5.646 -6.968 -10.488
219 HD1 TYR 38 HD2 TYR 38 7.622 -4.905 -10.565
220 HD2 TYR 38 HD1 TYR 38 6.412 -7.252 -7.148
221 HE1 TYR 38 HE2 TYR 38 9.738 -4.355 -9.433
222 HE2 TYR 38 HE1 TYR 38 8.602 -6.809 -6.082
223 HH TYR 38 HH TYR 38 11.081 -4.743 -7.606
224 H LEU 39 H LEU 39 3.643 -6.068 -11.994
225 HA LEU 39 HA LEU 39 4.338 -3.757 -13.726
226 HB3 LEU 39 HB2 LEU 39 4.505 -5.251 -15.647
227 HG LEU 39 HG LEU 39 6.570 -4.677 -13.998
228 HD11 LEU 39 1HD1 LEU 39 7.878 -6.714 -13.552
229 HD12 LEU 39 2HD1 LEU 39 6.343 -6.789 -12.679
230 HD13 LEU 39 3HD1 LEU 39 6.557 -7.727 -14.167
231 HD21 LEU 39 3HD2 LEU 39 8.045 -5.622 -15.748
232 HD22 LEU 39 1HD2 LEU 39 6.678 -6.549 -16.401
233 HD23 LEU 39 2HD2 LEU 39 6.661 -4.774 -16.459
234 H GLY 40 H GLY 40 2.174 -3.525 -12.328
235 HA2 GLY 40 HA2 GLY 40 -0.067 -4.215 -14.157
236 HA3 GLY 40 HA3 GLY 40 -0.094 -4.898 -12.524
237 H GLU 41 H GLU 41 -1.520 -3.748 -11.354
238 HA GLU 41 HA GLU 41 -2.470 -1.219 -12.053
239 HB3 GLU 41 HB2 GLU 41 -3.744 -1.326 -10.022
240 HG3 GLU 41 HG2 GLU 41 -3.914 -3.179 -11.972
241 H HIS 42 H HIS 42 -1.670 0.718 -11.787
242 HA HIS 42 HA HIS 42 -0.342 2.483 -11.207
243 HB3 HIS 42 HB2 HIS 42 -0.014 1.190 -8.471
244 HD1 HIS 42 HD1 HIS 42 2.310 2.969 -8.959
245 HD2 HIS 42 HD2 HIS 42 -1.481 4.347 -7.791
246 HE1 HIS 42 HE1 HIS 42 2.678 5.220 -7.762
247 H LYS 43 H LYS 43 0.694 0.055 -12.454
248 HA LYS 43 HA LYS 43 2.490 -0.929 -13.156
249 HB3 LYS 43 HB2 LYS 43 4.022 1.490 -12.126
250 HG3 LYS 43 HG2 LYS 43 5.531 -0.480 -12.516
251 HD3 LYS 43 HD2 LYS 43 4.687 -0.172 -15.445
252 HE3 LYS 43 HE2 LYS 43 6.003 -2.281 -15.715
253 HZ1 LYS 43 HZ3 LYS 43 7.200 -0.210 -16.000
254 HZ2 LYS 43 HZ1 LYS 43 7.630 -0.204 -14.408
255 HZ3 LYS 43 HZ2 LYS 43 8.178 -1.388 -15.404
256 H PHE 44 H PHE 44 3.888 0.503 -10.209
257 HA PHE 44 HA PHE 44 4.316 -2.172 -9.080
258 HB3 PHE 44 HB2 PHE 44 6.466 -0.092 -9.452
259 HD1 PHE 44 HD2 PHE 44 5.483 -3.061 -7.398
260 HD2 PHE 44 HD1 PHE 44 8.804 -0.699 -8.857
261 HE1 PHE 44 HE2 PHE 44 6.927 -4.045 -5.714
262 HE2 PHE 44 HE1 PHE 44 10.225 -1.622 -7.054
263 HZ PHE 44 HZ PHE 44 9.303 -3.302 -5.479
264 H ALA 45 H ALA 45 3.369 -2.055 -7.052
265 HA ALA 45 HA ALA 45 4.034 -0.027 -5.150
266 HB1 ALA 45 HB3 ALA 45 1.245 0.075 -6.370
267 HB2 ALA 45 HB1 ALA 45 1.727 0.946 -4.892
268 HB3 ALA 45 HB2 ALA 45 2.449 1.364 -6.440
269 H CYS 46 H CYS 46 1.822 -0.421 -3.383
270 HA CYS 46 HA CYS 46 1.506 -3.382 -3.163
271 HB3 CYS 46 HB2 CYS 46 1.561 -3.024 -0.685
272 H TYR 47 H TYR 47 -0.624 -3.815 -3.293
273 HA TYR 47 HA TYR 47 -2.572 -1.709 -2.487
274 HB3 TYR 47 HB2 TYR 47 -3.274 -4.270 -3.919
275 HD1 TYR 47 HD2 TYR 47 -3.716 -0.599 -4.489
276 HD2 TYR 47 HD1 TYR 47 -5.700 -4.276 -3.450
277 HE1 TYR 47 HE2 TYR 47 -5.910 0.471 -4.898
278 HE2 TYR 47 HE1 TYR 47 -7.876 -3.231 -3.929
279 HH TYR 47 HH TYR 47 -8.993 -1.251 -4.387
280 H CYS 48 H CYS 48 -3.893 -2.055 -0.754
281 HA CYS 48 HA CYS 48 -3.741 -4.658 0.699
282 HB3 CYS 48 HB2 CYS 48 -4.363 -3.359 2.712
283 H LYS 49 H LYS 49 -5.646 -5.408 1.415
284 HA LYS 49 HA LYS 49 -8.155 -4.312 0.321
285 HB3 LYS 49 HB2 LYS 49 -8.956 -6.683 0.925
286 HG3 LYS 49 HG2 LYS 49 -7.731 -7.906 -0.840
287 HD3 LYS 49 HD2 LYS 49 -8.263 -5.019 -1.635
288 HE3 LYS 49 HE2 LYS 49 -8.541 -7.590 -3.170
289 HZ1 LYS 49 HZ3 LYS 49 -9.537 -5.860 -4.796
290 HZ2 LYS 49 HZ1 LYS 49 -10.512 -6.470 -3.610
291 HZ3 LYS 49 HZ2 LYS 49 -9.895 -4.999 -3.414
292 H ASP 50 H ASP 50 -9.839 -3.728 1.580
293 HA ASP 50 HA ASP 50 -11.076 -3.278 3.414
294 HB3 ASP 50 HB2 ASP 50 -9.610 -5.433 4.959
295 H LEU 51 H LEU 51 -8.785 -1.715 3.136
296 HA LEU 51 HA LEU 51 -7.380 -1.236 5.630
297 HB3 LEU 51 HB2 LEU 51 -7.064 1.091 4.502
298 HG LEU 51 HG LEU 51 -6.130 -1.379 3.021
299 HD11 LEU 51 1HD1 LEU 51 -4.537 0.277 1.886
300 HD12 LEU 51 2HD1 LEU 51 -6.242 0.408 1.428
301 HD13 LEU 51 3HD1 LEU 51 -5.526 1.577 2.562
302 HD21 LEU 51 3HD2 LEU 51 -5.179 -0.801 5.394
303 HD22 LEU 51 1HD2 LEU 51 -4.022 -1.029 4.078
304 HD23 LEU 51 2HD2 LEU 51 -4.442 0.602 4.601
305 HA PRO 52 HA PRO 52 -10.825 0.843 7.578
306 HB3 PRO 52 HB2 PRO 52 -9.734 0.637 9.585
307 HG3 PRO 52 HG2 PRO 52 -7.343 0.863 9.730
308 HD3 PRO 52 HD2 PRO 52 -7.865 -0.806 8.101
309 H ASP 53 H ASP 53 -11.813 2.808 7.718
310 HA ASP 53 HA ASP 53 -12.092 4.460 5.678
311 HB3 ASP 53 HB2 ASP 53 -13.470 4.337 7.793
312 H ASN 54 H ASN 54 -9.919 5.170 8.305
313 HA ASN 54 HA ASN 54 -9.183 7.760 7.292
314 HB3 ASN 54 HB2 ASN 54 -9.596 7.273 9.674
315 HD21 ASN 54 1HD2 ASN 54 -9.697 4.954 10.224
316 HD22 ASN 54 2HD2 ASN 54 -8.229 4.240 10.910
317 H VAL 55 H VAL 55 -7.553 4.594 7.061
318 HA VAL 55 HA VAL 55 -4.972 5.813 7.429
319 HB VAL 55 HB VAL 55 -5.443 3.489 8.004
320 HG11 VAL 55 1HG1 VAL 55 -6.665 2.822 5.933
321 HG12 VAL 55 2HG1 VAL 55 -5.132 2.876 5.033
322 HG13 VAL 55 3HG1 VAL 55 -5.337 1.732 6.367
323 HG21 VAL 55 3HG2 VAL 55 -3.069 3.852 6.134
324 HG22 VAL 55 1HG2 VAL 55 -3.128 4.255 7.869
325 HG23 VAL 55 2HG2 VAL 55 -3.263 2.572 7.346
326 HA PRO 56 HA PRO 56 -4.924 7.845 3.694
327 HB3 PRO 56 HB2 PRO 56 -3.314 9.268 4.387
328 HG3 PRO 56 HG2 PRO 56 -1.591 8.506 5.859
329 HD3 PRO 56 HD2 PRO 56 -3.692 7.743 6.737
330 H ILE 57 H ILE 57 -4.783 7.712 1.509
331 HA ILE 57 HA ILE 57 -4.000 5.093 0.391
332 HB ILE 57 HB ILE 57 -5.502 5.550 -1.384
333 HG13 ILE 57 2HG1 ILE 57 -5.524 8.388 -0.392
334 HG21 ILE 57 1HG2 ILE 57 -6.887 6.345 1.208
335 HG22 ILE 57 2HG2 ILE 57 -7.584 5.497 -0.183
336 HG23 ILE 57 3HG2 ILE 57 -6.348 4.702 0.807
337 HD11 ILE 57 3HD1 ILE 57 -4.536 7.759 -2.631
338 HD12 ILE 57 1HD1 ILE 57 -6.113 7.097 -3.104
339 HD13 ILE 57 2HD1 ILE 57 -5.940 8.830 -2.783
340 H ARG 58 H ARG 58 -2.544 4.953 -1.300
341 HA ARG 58 HA ARG 58 -0.608 7.064 -1.566
342 HB3 ARG 58 HB2 ARG 58 -0.737 4.714 -3.455
343 HG3 ARG 58 HG2 ARG 58 1.588 4.543 -3.055
344 HD3 ARG 58 HD2 ARG 58 1.045 7.504 -3.382
345 HE ARG 58 HE ARG 58 3.405 5.913 -3.650
346 HH11 ARG 58 2HH2 ARG 58 1.672 8.615 -5.103
347 HH12 ARG 58 1HH2 ARG 58 3.097 9.394 -5.745
348 HH21 ARG 58 1HH1 ARG 58 5.318 6.883 -4.573
349 HH22 ARG 58 2HH1 ARG 58 5.174 8.359 -5.481
350 H VAL 59 H VAL 59 -1.303 8.969 -2.645
351 HA VAL 59 HA VAL 59 -3.164 8.871 -4.845
352 HB VAL 59 HB VAL 59 -1.534 10.923 -3.317
353 HG11 VAL 59 1HG1 VAL 59 -1.251 11.684 -5.542
354 HG12 VAL 59 2HG1 VAL 59 -2.995 11.498 -5.895
355 HG13 VAL 59 3HG1 VAL 59 -2.430 12.706 -4.713
356 HG21 VAL 59 3HG2 VAL 59 -3.737 11.864 -2.850
357 HG22 VAL 59 1HG2 VAL 59 -4.507 10.655 -3.898
358 HG23 VAL 59 2HG2 VAL 59 -3.688 10.154 -2.400
359 HA PRO 60 HA PRO 60 0.231 8.054 -7.725
360 HB3 PRO 60 HB2 PRO 60 -1.403 7.061 -9.027
361 HG3 PRO 60 HG2 PRO 60 -3.560 8.078 -9.349
362 HD3 PRO 60 HD2 PRO 60 -3.253 7.742 -7.015
363 H GLY 61 H GLY 61 1.055 10.103 -6.583
364 HA2 GLY 61 HA2 GLY 61 1.917 12.015 -8.642
365 HA3 GLY 61 HA3 GLY 61 0.948 12.689 -7.314
366 H LYS 62 H LYS 62 2.694 13.890 -6.441
367 HA LYS 62 HA LYS 62 5.304 12.931 -5.975
368 HB3 LYS 62 HB2 LYS 62 3.745 15.077 -4.475
369 HG3 LYS 62 HG2 LYS 62 6.747 14.879 -5.037
370 HD3 LYS 62 HD2 LYS 62 6.920 16.668 -3.366
371 HE3 LYS 62 HE2 LYS 62 6.607 17.216 -5.896
372 HZ1 LYS 62 HZ3 LYS 62 4.159 18.431 -4.766
373 HZ2 LYS 62 HZ1 LYS 62 4.761 18.683 -6.272
374 HZ3 LYS 62 HZ2 LYS 62 4.165 17.209 -5.865
375 H CYS 63 H CYS 63 6.341 12.212 -4.057
376 HA CYS 63 HA CYS 63 4.783 11.638 -1.661
377 HB3 CYS 63 HB2 CYS 63 5.928 9.604 -3.435
378 H HIS 64 H HIS 64 6.279 11.864 0.211
379 HA HIS 64 HA HIS 64 9.046 12.641 -0.296
380 HB3 HIS 64 HB2 HIS 64 8.035 14.736 -0.926
381 HD1 HIS 64 HD1 HIS 64 7.124 15.709 2.604
382 HD2 HIS 64 HD2 HIS 64 5.284 14.654 -1.034
383 HE1 HIS 64 HE1 HIS 64 4.700 16.484 2.755
Start of MODEL 7
1 H1 VAL 1 H VAL 1 -15.513 1.242 4.508
2 HA VAL 1 HA VAL 1 -12.863 1.006 5.387
3 HB VAL 1 HB VAL 1 -12.655 -1.475 5.188
4 HG11 VAL 1 1HG1 VAL 1 -12.734 -0.455 7.417
5 HG12 VAL 1 2HG1 VAL 1 -14.507 -0.587 7.438
6 HG13 VAL 1 3HG1 VAL 1 -13.499 -2.049 7.413
7 HG21 VAL 1 3HG2 VAL 1 -15.707 -1.503 5.339
8 HG22 VAL 1 1HG2 VAL 1 -14.733 -1.961 3.923
9 HG23 VAL 1 2HG2 VAL 1 -14.637 -2.913 5.409
10 H ARG 2 H ARG 2 -11.532 -0.045 3.576
11 HA ARG 2 HA ARG 2 -12.835 -0.486 1.020
12 HB3 ARG 2 HB2 ARG 2 -12.825 1.952 0.939
13 HG3 ARG 2 HG2 ARG 2 -9.885 1.726 1.752
14 HD3 ARG 2 HD2 ARG 2 -11.480 3.918 0.427
15 HE ARG 2 HE ARG 2 -10.805 5.416 1.970
16 HH11 ARG 2 2HH2 ARG 2 -8.209 2.973 2.091
17 HH12 ARG 2 1HH2 ARG 2 -7.232 4.063 3.086
18 HH21 ARG 2 1HH1 ARG 2 -9.530 6.636 3.053
19 HH22 ARG 2 2HH1 ARG 2 -7.999 6.082 3.685
20 H ASP 3 H ASP 3 -11.000 -0.687 -0.656
21 HA ASP 3 HA ASP 3 -8.558 -1.940 0.545
22 HB3 ASP 3 HB2 ASP 3 -8.301 -3.126 -1.592
23 H ALA 4 H ALA 4 -6.578 -1.086 -0.340
24 HA ALA 4 HA ALA 4 -6.627 0.810 -2.492
25 HB1 ALA 4 HB3 ALA 4 -6.108 2.852 -1.300
26 HB2 ALA 4 HB1 ALA 4 -7.694 2.278 -0.774
27 HB3 ALA 4 HB2 ALA 4 -6.273 2.050 0.267
28 H TYR 5 H TYR 5 -4.551 1.930 -2.705
29 HA TYR 5 HA TYR 5 -2.240 0.274 -2.058
30 HB3 TYR 5 HB2 TYR 5 -1.014 2.063 -3.200
31 HD1 TYR 5 HD1 TYR 5 -0.892 0.122 -4.784
32 HD2 TYR 5 HD2 TYR 5 -4.230 2.855 -4.764
33 HE1 TYR 5 HE1 TYR 5 -1.610 -0.728 -6.987
34 HE2 TYR 5 HE2 TYR 5 -5.048 1.869 -6.880
35 HH TYR 5 HH TYR 5 -3.486 -0.911 -8.454
36 H ILE 6 H ILE 6 -1.835 0.249 0.204
37 HA ILE 6 HA ILE 6 -2.463 2.403 1.899
38 HB ILE 6 HB ILE 6 -2.085 0.107 2.634
39 HG13 ILE 6 2HG1 ILE 6 -1.967 2.056 4.156
40 HG21 ILE 6 1HG2 ILE 6 0.879 0.603 2.102
41 HG22 ILE 6 2HG2 ILE 6 0.200 -0.819 2.906
42 HG23 ILE 6 3HG2 ILE 6 -0.165 -0.512 1.212
43 HD11 ILE 6 3HD1 ILE 6 -1.802 -0.321 4.959
44 HD12 ILE 6 1HD1 ILE 6 -0.039 -0.108 5.025
45 HD13 ILE 6 2HD1 ILE 6 -1.088 0.903 6.038
46 H ALA 7 H ALA 7 -1.256 4.100 2.728
47 HA ALA 7 HA ALA 7 1.212 4.852 1.175
48 HB1 ALA 7 HB3 ALA 7 -1.148 6.563 2.036
49 HB2 ALA 7 HB1 ALA 7 0.367 7.170 1.342
50 HB3 ALA 7 HB2 ALA 7 -0.693 6.114 0.378
51 H GLN 8 H GLN 8 2.892 5.685 2.278
52 HA GLN 8 HA GLN 8 2.794 5.969 5.219
53 HB3 GLN 8 HB2 GLN 8 5.185 6.564 4.945
54 HG3 GLN 8 HG2 GLN 8 4.560 4.031 3.381
55 HE21 GLN 8 1HE2 GLN 8 6.730 4.106 2.291
56 HE22 GLN 8 2HE2 GLN 8 8.164 4.021 3.286
57 H ASN 9 H ASN 9 3.733 8.004 6.070
58 HA ASN 9 HA ASN 9 2.641 10.511 5.099
59 HB3 ASN 9 HB2 ASN 9 4.721 9.736 7.169
60 HD21 ASN 9 1HD2 ASN 9 6.077 11.517 6.080
61 HD22 ASN 9 2HD2 ASN 9 5.787 13.147 6.698
62 H TYR 10 H TYR 10 5.387 11.061 2.693
63 HA TYR 10 HA TYR 10 2.421 11.059 3.092
64 HB3 TYR 10 HB2 TYR 10 2.732 13.212 1.653
65 HD1 TYR 10 HD2 TYR 10 0.745 13.048 3.304
66 HD2 TYR 10 HD1 TYR 10 4.715 14.307 4.421
67 HE1 TYR 10 HE2 TYR 10 -0.172 14.162 5.323
68 HE2 TYR 10 HE1 TYR 10 3.787 15.465 6.402
69 HH TYR 10 HH TYR 10 1.912 15.774 7.720
70 H ASN 11 H ASN 11 1.897 9.468 1.769
71 HA ASN 11 HA ASN 11 1.097 8.677 -0.154
72 HB3 ASN 11 HB2 ASN 11 2.505 10.534 -2.004
73 HD21 ASN 11 1HD2 ASN 11 1.310 10.792 -3.901
74 HD22 ASN 11 2HD2 ASN 11 -0.197 9.927 -4.199
75 H CYS 12 H CYS 12 3.955 8.237 0.910
76 HA CYS 12 HA CYS 12 5.298 7.242 -1.556
77 HB3 CYS 12 HB2 CYS 12 7.255 7.045 -0.159
78 H VAL 13 H VAL 13 5.528 5.063 -1.896
79 HA VAL 13 HA VAL 13 3.803 3.261 -0.363
80 HB VAL 13 HB VAL 13 4.522 1.567 -1.996
81 HG11 VAL 13 1HG1 VAL 13 2.627 3.023 -2.519
82 HG12 VAL 13 2HG1 VAL 13 3.714 4.213 -3.272
83 HG13 VAL 13 3HG1 VAL 13 3.531 2.607 -3.986
84 HG21 VAL 13 3HG2 VAL 13 6.864 2.333 -2.388
85 HG22 VAL 13 1HG2 VAL 13 5.946 2.107 -3.884
86 HG23 VAL 13 2HG2 VAL 13 6.237 3.741 -3.276
87 H TYR 14 H TYR 14 4.969 0.964 0.030
88 HA TYR 14 HA TYR 14 7.360 1.456 1.754
89 HB3 TYR 14 HB2 TYR 14 6.836 -0.765 2.670
90 HD1 TYR 14 HD1 TYR 14 6.943 1.026 4.456
91 HD2 TYR 14 HD2 TYR 14 3.346 0.222 2.221
92 HE1 TYR 14 HE1 TYR 14 5.587 2.148 6.205
93 HE2 TYR 14 HE2 TYR 14 2.010 1.311 4.003
94 HH TYR 14 HH TYR 14 2.019 2.183 6.160
95 H HIS 15 H HIS 15 9.099 -0.132 1.557
96 HA HIS 15 HA HIS 15 9.708 -0.858 -1.194
97 HB3 HIS 15 HB2 HIS 15 11.156 -1.469 1.409
98 HD1 HIS 15 HD1 HIS 15 12.178 -0.827 -2.305
99 HD2 HIS 15 HD2 HIS 15 12.725 -3.499 0.903
100 HE1 HIS 15 HE1 HIS 15 13.857 -2.582 -3.090
101 H CYS 16 H CYS 16 7.608 -2.095 -1.293
102 HA CYS 16 HA CYS 16 7.527 -4.696 -0.017
103 HB3 CYS 16 HB2 CYS 16 5.680 -3.103 -1.384
104 H ALA 17 H ALA 17 7.816 -6.705 -0.951
105 HA ALA 17 HA ALA 17 9.513 -6.867 -3.409
106 HB1 ALA 17 HB3 ALA 17 11.003 -6.873 -1.467
107 HB2 ALA 17 HB1 ALA 17 10.071 -8.188 -0.721
108 HB3 ALA 17 HB2 ALA 17 10.957 -8.471 -2.236
109 H ARG 18 H ARG 18 7.787 -8.784 -0.911
110 HA ARG 18 HA ARG 18 6.621 -10.503 -3.063
111 HB3 ARG 18 HB2 ARG 18 6.538 -12.302 -1.404
112 HG3 ARG 18 HG2 ARG 18 8.858 -12.812 -0.960
113 HD3 ARG 18 HD2 ARG 18 9.873 -12.654 -3.187
114 HE ARG 18 HE ARG 18 7.180 -12.453 -4.244
115 HH11 ARG 18 2HH2 ARG 18 9.266 -14.543 -2.340
116 HH12 ARG 18 1HH2 ARG 18 8.405 -16.014 -2.678
117 HH21 ARG 18 1HH1 ARG 18 5.947 -14.355 -4.672
118 HH22 ARG 18 2HH1 ARG 18 6.457 -15.892 -4.056
119 H ASP 19 H ASP 19 4.362 -10.812 -2.892
120 HA ASP 19 HA ASP 19 2.667 -9.071 -1.723
121 HB3 ASP 19 HB2 ASP 19 0.996 -10.909 -1.914
122 H ALA 20 H ALA 20 4.038 -11.947 -0.153
123 HA ALA 20 HA ALA 20 2.685 -11.910 2.284
124 HB1 ALA 20 HB3 ALA 20 4.689 -13.022 3.212
125 HB2 ALA 20 HB1 ALA 20 4.275 -13.675 1.615
126 HB3 ALA 20 HB2 ALA 20 5.631 -12.536 1.787
127 H TYR 21 H TYR 21 5.530 -9.878 1.349
128 HA TYR 21 HA TYR 21 5.978 -8.699 3.909
129 HB3 TYR 21 HB2 TYR 21 6.335 -7.537 1.110
130 HD1 TYR 21 HD1 TYR 21 5.582 -5.264 1.800
131 HD2 TYR 21 HD2 TYR 21 8.909 -7.278 3.672
132 HE1 TYR 21 HE1 TYR 21 6.352 -3.122 2.723
133 HE2 TYR 21 HE2 TYR 21 9.711 -5.102 4.552
134 HH TYR 21 HH TYR 21 7.866 -2.079 4.130
135 H CYS 22 H CYS 22 3.885 -7.673 1.147
136 HA CYS 22 HA CYS 22 2.838 -5.390 2.533
137 HB3 CYS 22 HB2 CYS 22 0.968 -5.530 0.868
138 H ASN 23 H ASN 23 1.618 -8.759 2.161
139 HA ASN 23 HA ASN 23 -0.845 -8.306 3.422
140 HB3 ASN 23 HB2 ASN 23 0.769 -10.887 3.512
141 HD21 ASN 23 1HD2 ASN 23 -0.532 -11.344 5.531
142 HD22 ASN 23 2HD2 ASN 23 -2.225 -11.742 5.338
143 H GLU 24 H GLU 24 2.288 -9.328 4.882
144 HA GLU 24 HA GLU 24 1.450 -9.364 7.572
145 HB3 GLU 24 HB2 GLU 24 4.138 -8.622 6.303
146 HG3 GLU 24 HG2 GLU 24 3.250 -9.080 9.168
147 H LEU 25 H LEU 25 2.860 -6.621 5.647
148 HA LEU 25 HA LEU 25 2.787 -4.741 7.721
149 HB3 LEU 25 HB2 LEU 25 2.383 -4.171 4.736
150 HG LEU 25 HG LEU 25 3.253 -2.576 7.130
151 HD11 LEU 25 1HD1 LEU 25 4.559 -2.254 4.399
152 HD12 LEU 25 2HD1 LEU 25 4.746 -1.172 5.799
153 HD13 LEU 25 3HD1 LEU 25 5.367 -2.825 5.877
154 HD21 LEU 25 3HD2 LEU 25 2.132 -1.737 4.416
155 HD22 LEU 25 1HD2 LEU 25 1.126 -2.099 5.827
156 HD23 LEU 25 2HD2 LEU 25 2.257 -0.745 5.886
157 H CYS 26 H CYS 26 0.231 -5.621 5.440
158 HA CYS 26 HA CYS 26 -1.665 -3.604 6.070
159 HB3 CYS 26 HB2 CYS 26 -3.283 -5.147 5.010
160 H THR 27 H THR 27 -1.354 -7.037 7.214
161 HA THR 27 HA THR 27 -3.419 -6.791 9.189
162 HB THR 27 HB THR 27 -2.438 -8.813 10.193
163 HG1 THR 27 HG1 THR 27 -0.318 -8.188 8.474
164 HG21 THR 27 3HG2 THR 27 -2.665 -8.897 7.150
165 HG22 THR 27 1HG2 THR 27 -2.785 -10.280 8.252
166 HG23 THR 27 2HG2 THR 27 -4.003 -8.991 8.306
167 H LYS 28 H LYS 28 0.000 -5.913 9.320
168 HA LYS 28 HA LYS 28 0.156 -5.434 12.124
169 HB3 LYS 28 HB2 LYS 28 2.276 -4.187 11.035
170 HG3 LYS 28 HG2 LYS 28 3.334 -6.378 10.362
171 HD3 LYS 28 HD2 LYS 28 1.914 -6.471 13.059
172 HE3 LYS 28 HE2 LYS 28 2.964 -8.647 12.414
173 HZ1 LYS 28 HZ3 LYS 28 4.887 -8.024 11.137
174 HZ2 LYS 28 HZ1 LYS 28 5.463 -7.055 12.336
175 HZ3 LYS 28 HZ2 LYS 28 5.406 -8.688 12.478
176 H ASN 29 H ASN 29 -0.986 -3.542 9.346
177 HA ASN 29 HA ASN 29 -0.843 -0.994 10.897
178 HB3 ASN 29 HB2 ASN 29 -1.981 -0.173 8.696
179 HD21 ASN 29 1HD2 ASN 29 1.041 -2.127 8.577
180 HD22 ASN 29 2HD2 ASN 29 2.104 -0.722 8.435
181 H GLY 30 H GLY 30 -3.255 -2.955 9.159
182 HA2 GLY 30 HA2 GLY 30 -5.329 -3.302 10.750
183 HA3 GLY 30 HA3 GLY 30 -5.498 -1.553 10.503
184 H ALA 31 H ALA 31 -4.618 -4.352 8.379
185 HA ALA 31 HA ALA 31 -7.120 -4.050 6.865
186 HB1 ALA 31 HB3 ALA 31 -5.397 -4.367 4.781
187 HB2 ALA 31 HB1 ALA 31 -6.039 -2.799 5.296
188 HB3 ALA 31 HB2 ALA 31 -4.415 -3.306 5.812
189 H LYS 32 H LYS 32 -7.613 -6.077 5.704
190 HA LYS 32 HA LYS 32 -6.764 -8.112 7.601
191 HB3 LYS 32 HB2 LYS 32 -9.113 -7.706 6.705
192 HG3 LYS 32 HG2 LYS 32 -8.411 -9.907 4.729
193 HD3 LYS 32 HD2 LYS 32 -10.503 -9.231 3.660
194 HE3 LYS 32 HE2 LYS 32 -10.783 -9.416 6.696
195 HZ1 LYS 32 HZ3 LYS 32 -13.118 -9.227 6.455
196 HZ2 LYS 32 HZ1 LYS 32 -12.387 -7.841 5.966
197 HZ3 LYS 32 HZ2 LYS 32 -12.987 -8.865 4.847
198 H SER 33 H SER 33 -5.809 -7.312 4.341
199 HA SER 33 HA SER 33 -3.760 -9.310 4.333
200 HB3 SER 33 HB2 SER 33 -5.416 -10.912 3.749
201 HG SER 33 HG SER 33 -6.528 -8.973 1.991
202 H GLY 34 H GLY 34 -2.636 -9.273 2.042
203 HA2 GLY 34 HA2 GLY 34 -3.032 -6.692 0.654
204 HA3 GLY 34 HA3 GLY 34 -1.498 -6.930 1.519
205 H SER 35 H SER 35 -1.242 -6.405 -1.072
206 HA SER 35 HA SER 35 0.034 -8.851 -1.984
207 HB3 SER 35 HB2 SER 35 -1.071 -9.149 -4.022
208 HG SER 35 HG SER 35 -2.470 -9.498 -2.131
209 H CYS 36 H CYS 36 1.475 -8.357 -3.873
210 HA CYS 36 HA CYS 36 2.599 -5.568 -3.726
211 HB3 CYS 36 HB2 CYS 36 4.532 -6.973 -4.931
212 HA PRO 37 HA PRO 37 1.113 -5.768 -8.161
213 HB3 PRO 37 HB2 PRO 37 -0.592 -4.256 -7.860
214 HG3 PRO 37 HG2 PRO 37 -0.575 -2.718 -6.016
215 HD3 PRO 37 HD2 PRO 37 -0.369 -4.987 -5.193
216 H TYR 38 H TYR 38 3.223 -6.321 -8.623
217 HA TYR 38 HA TYR 38 5.193 -4.105 -8.992
218 HB3 TYR 38 HB2 TYR 38 6.551 -6.060 -9.978
219 HD1 TYR 38 HD1 TYR 38 5.560 -4.767 -6.720
220 HD2 TYR 38 HD2 TYR 38 8.169 -7.493 -8.819
221 HE1 TYR 38 HE1 TYR 38 7.397 -4.232 -5.162
222 HE2 TYR 38 HE2 TYR 38 9.974 -7.002 -7.202
223 HH TYR 38 HH TYR 38 9.589 -4.724 -4.516
224 H LEU 39 H LEU 39 6.137 -3.956 -11.009
225 HA LEU 39 HA LEU 39 5.893 -3.167 -13.156
226 HB3 LEU 39 HB2 LEU 39 5.717 -4.966 -14.826
227 HG LEU 39 HG LEU 39 7.186 -6.004 -12.359
228 HD11 LEU 39 1HD1 LEU 39 6.739 -7.739 -14.051
229 HD12 LEU 39 2HD1 LEU 39 7.461 -6.712 -15.308
230 HD13 LEU 39 3HD1 LEU 39 8.463 -7.336 -13.980
231 HD21 LEU 39 3HD2 LEU 39 8.057 -3.793 -13.005
232 HD22 LEU 39 1HD2 LEU 39 9.203 -5.054 -13.469
233 HD23 LEU 39 2HD2 LEU 39 8.166 -4.311 -14.704
234 H GLY 40 H GLY 40 3.655 -2.445 -11.681
235 HA2 GLY 40 HA2 GLY 40 1.425 -2.595 -13.678
236 HA3 GLY 40 HA3 GLY 40 1.213 -3.269 -12.052
237 H GLU 41 H GLU 41 -0.253 -1.822 -11.190
238 HA GLU 41 HA GLU 41 -0.264 0.943 -11.771
239 HB3 GLU 41 HB2 GLU 41 -1.907 1.211 -10.133
240 HG3 GLU 41 HG2 GLU 41 -2.244 -0.789 -11.893
241 H HIS 42 H HIS 42 0.582 2.654 -10.776
242 HA HIS 42 HA HIS 42 2.298 3.883 -9.811
243 HB3 HIS 42 HB2 HIS 42 2.738 3.436 -7.399
244 HD1 HIS 42 HD1 HIS 42 0.208 4.866 -9.241
245 HD2 HIS 42 HD2 HIS 42 0.235 2.818 -5.564
246 HE1 HIS 42 HE1 HIS 42 -1.855 5.647 -7.950
247 H LYS 43 H LYS 43 2.937 1.294 -11.368
248 HA LYS 43 HA LYS 43 4.606 0.131 -12.066
249 HB3 LYS 43 HB2 LYS 43 6.533 1.847 -10.467
250 HG3 LYS 43 HG2 LYS 43 7.472 -0.291 -11.409
251 HD3 LYS 43 HD2 LYS 43 6.730 1.022 -14.061
252 HE3 LYS 43 HE2 LYS 43 8.477 -1.410 -13.418
253 HZ1 LYS 43 HZ3 LYS 43 7.163 -1.750 -15.406
254 HZ2 LYS 43 HZ1 LYS 43 7.691 -0.328 -16.045
255 HZ3 LYS 43 HZ2 LYS 43 8.749 -1.557 -15.784
256 H PHE 44 H PHE 44 5.491 0.836 -8.672
257 HA PHE 44 HA PHE 44 5.346 -2.047 -7.970
258 HB3 PHE 44 HB2 PHE 44 7.427 -1.877 -6.729
259 HD1 PHE 44 HD1 PHE 44 7.362 -3.590 -8.736
260 HD2 PHE 44 HD2 PHE 44 9.156 0.313 -8.873
261 HE1 PHE 44 HE1 PHE 44 8.868 -4.357 -10.546
262 HE2 PHE 44 HE2 PHE 44 10.685 -0.456 -10.661
263 HZ PHE 44 HZ PHE 44 10.536 -2.790 -11.514
264 H ALA 45 H ALA 45 3.824 -2.066 -6.280
265 HA ALA 45 HA ALA 45 4.201 -0.138 -4.078
266 HB1 ALA 45 HB3 ALA 45 2.724 1.098 -5.608
267 HB2 ALA 45 HB1 ALA 45 1.600 -0.270 -5.679
268 HB3 ALA 45 HB2 ALA 45 1.826 0.623 -4.161
269 H CYS 46 H CYS 46 2.300 -0.587 -2.434
270 HA CYS 46 HA CYS 46 1.747 -3.511 -2.242
271 HB3 CYS 46 HB2 CYS 46 0.929 -2.783 0.116
272 H TYR 47 H TYR 47 -0.409 -4.070 -1.908
273 HA TYR 47 HA TYR 47 -2.482 -1.940 -2.182
274 HB3 TYR 47 HB2 TYR 47 -2.646 -4.640 -3.579
275 HD1 TYR 47 HD1 TYR 47 -4.946 -2.518 -2.379
276 HD2 TYR 47 HD2 TYR 47 -3.191 -3.419 -6.235
277 HE1 TYR 47 HE1 TYR 47 -6.709 -1.233 -3.506
278 HE2 TYR 47 HE2 TYR 47 -5.061 -2.277 -7.338
279 HH TYR 47 HH TYR 47 -6.753 -0.755 -7.043
280 H CYS 48 H CYS 48 -3.318 -2.001 -0.128
281 HA CYS 48 HA CYS 48 -3.540 -4.578 1.329
282 HB3 CYS 48 HB2 CYS 48 -4.290 -3.081 3.207
283 H LYS 49 H LYS 49 -5.486 -5.169 2.301
284 HA LYS 49 HA LYS 49 -7.911 -4.201 0.893
285 HB3 LYS 49 HB2 LYS 49 -8.769 -6.535 1.271
286 HG3 LYS 49 HG2 LYS 49 -7.861 -5.691 -0.944
287 HD3 LYS 49 HD2 LYS 49 -5.603 -7.636 -0.279
288 HE3 LYS 49 HE2 LYS 49 -6.216 -5.833 -2.680
289 HZ1 LYS 49 HZ3 LYS 49 -3.905 -7.663 -2.484
290 HZ2 LYS 49 HZ1 LYS 49 -4.240 -6.538 -3.615
291 HZ3 LYS 49 HZ2 LYS 49 -3.822 -6.060 -2.094
292 H ASP 50 H ASP 50 -9.618 -3.775 2.093
293 HA ASP 50 HA ASP 50 -10.938 -3.284 3.864
294 HB3 ASP 50 HB2 ASP 50 -9.534 -5.321 5.614
295 H LEU 51 H LEU 51 -8.876 -1.581 3.561
296 HA LEU 51 HA LEU 51 -7.662 -0.863 6.132
297 HB3 LEU 51 HB2 LEU 51 -7.284 1.354 4.893
298 HG LEU 51 HG LEU 51 -6.176 -1.160 3.588
299 HD11 LEU 51 1HD1 LEU 51 -4.517 0.446 2.550
300 HD12 LEU 51 2HD1 LEU 51 -6.173 0.580 1.939
301 HD13 LEU 51 3HD1 LEU 51 -5.546 1.782 3.095
302 HD21 LEU 51 3HD2 LEU 51 -4.901 0.909 5.433
303 HD22 LEU 51 1HD2 LEU 51 -5.432 -0.688 5.966
304 HD23 LEU 51 2HD2 LEU 51 -4.121 -0.548 4.787
305 HA PRO 52 HA PRO 52 -11.491 1.513 7.156
306 HB3 PRO 52 HB2 PRO 52 -11.016 1.135 9.406
307 HG3 PRO 52 HG2 PRO 52 -8.762 1.063 10.214
308 HD3 PRO 52 HD2 PRO 52 -8.809 -0.560 8.492
309 H ASP 53 H ASP 53 -11.989 3.655 6.506
310 HA ASP 53 HA ASP 53 -10.332 4.693 4.587
311 HB3 ASP 53 HB2 ASP 53 -12.527 6.187 6.052
312 H ASN 54 H ASN 54 -10.361 5.468 7.981
313 HA ASN 54 HA ASN 54 -8.910 7.782 8.301
314 HB3 ASN 54 HB2 ASN 54 -8.492 5.101 9.691
315 HD21 ASN 54 1HD2 ASN 54 -6.356 5.227 10.479
316 HD22 ASN 54 2HD2 ASN 54 -5.818 6.616 11.410
317 H VAL 55 H VAL 55 -7.567 4.628 7.170
318 HA VAL 55 HA VAL 55 -4.855 5.730 7.107
319 HB VAL 55 HB VAL 55 -5.900 3.090 6.044
320 HG11 VAL 55 1HG1 VAL 55 -3.445 2.489 6.144
321 HG12 VAL 55 2HG1 VAL 55 -3.797 3.742 4.942
322 HG13 VAL 55 3HG1 VAL 55 -3.077 4.176 6.509
323 HG21 VAL 55 3HG2 VAL 55 -6.154 3.252 8.504
324 HG22 VAL 55 1HG2 VAL 55 -4.844 2.146 8.081
325 HG23 VAL 55 2HG2 VAL 55 -4.467 3.785 8.651
326 HA PRO 56 HA PRO 56 -6.057 7.616 3.227
327 HB3 PRO 56 HB2 PRO 56 -4.675 9.371 3.802
328 HG3 PRO 56 HG2 PRO 56 -2.567 8.997 4.890
329 HD3 PRO 56 HD2 PRO 56 -4.243 7.936 6.209
330 H ILE 57 H ILE 57 -5.743 7.410 0.953
331 HA ILE 57 HA ILE 57 -4.551 4.852 0.062
332 HB ILE 57 HB ILE 57 -5.717 5.196 -1.968
333 HG13 ILE 57 2HG1 ILE 57 -5.341 7.565 -2.391
334 HG21 ILE 57 1HG2 ILE 57 -7.975 5.073 -1.217
335 HG22 ILE 57 2HG2 ILE 57 -6.994 4.541 0.154
336 HG23 ILE 57 3HG2 ILE 57 -7.674 6.179 0.140
337 HD11 ILE 57 3HD1 ILE 57 -7.450 8.225 -3.298
338 HD12 ILE 57 1HD1 ILE 57 -7.280 6.471 -3.515
339 HD13 ILE 57 2HD1 ILE 57 -8.340 7.123 -2.239
340 H ARG 58 H ARG 58 -2.947 4.829 -1.610
341 HA ARG 58 HA ARG 58 -1.187 7.109 -1.772
342 HB3 ARG 58 HB2 ARG 58 -1.117 4.794 -3.722
343 HG3 ARG 58 HG2 ARG 58 1.317 4.973 -3.258
344 HD3 ARG 58 HD2 ARG 58 -0.016 7.520 -4.195
345 HE ARG 58 HE ARG 58 2.615 7.337 -3.608
346 HH11 ARG 58 2HH2 ARG 58 0.495 8.345 -6.220
347 HH12 ARG 58 1HH2 ARG 58 1.720 9.362 -6.963
348 HH21 ARG 58 1HH1 ARG 58 4.074 8.908 -4.487
349 HH22 ARG 58 2HH1 ARG 58 3.525 9.848 -5.872
350 H VAL 59 H VAL 59 -1.956 8.966 -2.852
351 HA VAL 59 HA VAL 59 -4.060 8.641 -4.891
352 HB VAL 59 HB VAL 59 -4.124 11.072 -4.987
353 HG11 VAL 59 1HG1 VAL 59 -5.460 9.874 -3.309
354 HG12 VAL 59 2HG1 VAL 59 -4.137 10.022 -2.129
355 HG13 VAL 59 3HG1 VAL 59 -4.965 11.472 -2.729
356 HG21 VAL 59 3HG2 VAL 59 -2.868 12.520 -3.559
357 HG22 VAL 59 1HG2 VAL 59 -1.997 11.172 -2.832
358 HG23 VAL 59 2HG2 VAL 59 -1.721 11.603 -4.542
359 HA PRO 60 HA PRO 60 -1.165 8.513 -8.223
360 HB3 PRO 60 HB2 PRO 60 -2.994 7.873 -9.480
361 HG3 PRO 60 HG2 PRO 60 -5.074 9.082 -9.407
362 HD3 PRO 60 HD2 PRO 60 -4.564 8.307 -7.216
363 H GLY 61 H GLY 61 -0.132 10.393 -6.782
364 HA2 GLY 61 HA2 GLY 61 0.757 12.423 -8.745
365 HA3 GLY 61 HA3 GLY 61 -0.024 13.008 -7.266
366 H LYS 62 H LYS 62 1.806 14.010 -6.502
367 HA LYS 62 HA LYS 62 4.443 13.045 -6.452
368 HB3 LYS 62 HB2 LYS 62 3.067 15.057 -4.615
369 HG3 LYS 62 HG2 LYS 62 5.967 14.858 -5.548
370 HD3 LYS 62 HD2 LYS 62 4.506 17.055 -4.013
371 HE3 LYS 62 HE2 LYS 62 7.434 16.804 -4.884
372 HZ1 LYS 62 HZ3 LYS 62 7.707 18.843 -3.682
373 HZ2 LYS 62 HZ1 LYS 62 6.643 19.075 -4.911
374 HZ3 LYS 62 HZ2 LYS 62 6.099 18.948 -3.361
375 H CYS 63 H CYS 63 5.753 12.641 -4.434
376 HA CYS 63 HA CYS 63 4.371 11.589 -2.083
377 HB3 CYS 63 HB2 CYS 63 6.046 10.007 -3.947
378 H HIS 64 H HIS 64 5.671 12.127 -0.190
379 HA HIS 64 HA HIS 64 8.307 13.314 -0.543
380 HB3 HIS 64 HB2 HIS 64 7.053 15.256 -1.198
381 HD1 HIS 64 HD1 HIS 64 5.808 16.115 2.237
382 HD2 HIS 64 HD2 HIS 64 4.342 14.696 -1.448
383 HE1 HIS 64 HE1 HIS 64 3.288 16.499 2.250
Start of MODEL 8
1 H1 VAL 1 H VAL 1 -15.296 -0.056 3.551
2 HA VAL 1 HA VAL 1 -12.921 0.954 4.665
3 HB VAL 1 HB VAL 1 -11.691 -1.181 4.906
4 HG11 VAL 1 1HG1 VAL 1 -12.526 -1.810 7.081
5 HG12 VAL 1 2HG1 VAL 1 -12.756 -0.061 6.900
6 HG13 VAL 1 3HG1 VAL 1 -14.136 -1.153 6.724
7 HG21 VAL 1 3HG2 VAL 1 -12.941 -3.308 5.150
8 HG22 VAL 1 1HG2 VAL 1 -14.434 -2.513 4.639
9 HG23 VAL 1 2HG2 VAL 1 -13.082 -2.668 3.500
10 H ARG 2 H ARG 2 -11.114 0.597 3.046
11 HA ARG 2 HA ARG 2 -12.281 0.344 0.307
12 HB3 ARG 2 HB2 ARG 2 -10.725 2.109 -0.271
13 HG3 ARG 2 HG2 ARG 2 -12.974 2.442 1.295
14 HD3 ARG 2 HD2 ARG 2 -11.520 2.903 3.358
15 HE ARG 2 HE ARG 2 -10.830 5.442 1.909
16 HH11 ARG 2 2HH2 ARG 2 -9.580 2.693 3.787
17 HH12 ARG 2 1HH2 ARG 2 -8.410 3.682 4.596
18 HH21 ARG 2 1HH1 ARG 2 -8.934 6.549 2.624
19 HH22 ARG 2 2HH1 ARG 2 -7.785 5.713 3.628
20 H ASP 3 H ASP 3 -10.662 0.012 -1.372
21 HA ASP 3 HA ASP 3 -8.286 -1.622 -0.543
22 HB3 ASP 3 HB2 ASP 3 -8.109 -1.825 -3.146
23 H ALA 4 H ALA 4 -6.237 -0.738 -1.085
24 HA ALA 4 HA ALA 4 -6.014 1.561 -2.769
25 HB1 ALA 4 HB3 ALA 4 -7.053 2.839 -0.954
26 HB2 ALA 4 HB1 ALA 4 -6.005 2.055 0.241
27 HB3 ALA 4 HB2 ALA 4 -5.319 3.176 -0.940
28 H TYR 5 H TYR 5 -3.833 2.536 -2.566
29 HA TYR 5 HA TYR 5 -1.717 0.569 -1.918
30 HB3 TYR 5 HB2 TYR 5 -0.286 2.446 -2.760
31 HD1 TYR 5 HD2 TYR 5 -0.553 0.012 -4.022
32 HD2 TYR 5 HD1 TYR 5 -2.543 3.681 -5.104
33 HE1 TYR 5 HE2 TYR 5 -0.629 -0.729 -6.365
34 HE2 TYR 5 HE1 TYR 5 -2.573 2.956 -7.465
35 HH TYR 5 HH TYR 5 -0.704 0.157 -8.582
36 H ILE 6 H ILE 6 -1.059 0.536 0.275
37 HA ILE 6 HA ILE 6 -1.876 2.648 2.044
38 HB ILE 6 HB ILE 6 -1.518 0.284 2.682
39 HG13 ILE 6 2HG1 ILE 6 -1.545 2.287 4.258
40 HG21 ILE 6 1HG2 ILE 6 0.586 -0.176 1.443
41 HG22 ILE 6 2HG2 ILE 6 1.459 0.931 2.517
42 HG23 ILE 6 3HG2 ILE 6 0.764 -0.563 3.155
43 HD11 ILE 6 3HD1 ILE 6 -0.015 -0.145 5.218
44 HD12 ILE 6 1HD1 ILE 6 -0.982 0.983 6.188
45 HD13 ILE 6 2HD1 ILE 6 -1.775 -0.068 4.992
46 H ALA 7 H ALA 7 -0.576 4.282 3.013
47 HA ALA 7 HA ALA 7 2.063 4.839 1.715
48 HB1 ALA 7 HB3 ALA 7 0.396 6.420 0.863
49 HB2 ALA 7 HB1 ALA 7 -0.091 6.830 2.525
50 HB3 ALA 7 HB2 ALA 7 1.551 7.216 1.961
51 H GLN 8 H GLN 8 3.692 5.331 3.116
52 HA GLN 8 HA GLN 8 3.168 4.870 5.965
53 HB3 GLN 8 HB2 GLN 8 4.975 3.729 4.749
54 HG3 GLN 8 HG2 GLN 8 6.612 6.272 4.955
55 HE21 GLN 8 1HE2 GLN 8 7.294 3.936 2.423
56 HE22 GLN 8 2HE2 GLN 8 8.668 3.276 3.275
57 H ASN 9 H ASN 9 4.941 7.361 4.130
58 HA ASN 9 HA ASN 9 4.021 9.697 5.422
59 HB3 ASN 9 HB2 ASN 9 6.626 9.592 6.608
60 HD21 ASN 9 1HD2 ASN 9 3.407 8.651 7.883
61 HD22 ASN 9 2HD2 ASN 9 3.202 10.120 8.842
62 H TYR 10 H TYR 10 6.082 10.688 2.583
63 HA TYR 10 HA TYR 10 3.301 10.139 3.550
64 HB3 TYR 10 HB2 TYR 10 3.545 12.775 2.389
65 HD1 TYR 10 HD1 TYR 10 1.091 12.247 2.833
66 HD2 TYR 10 HD2 TYR 10 3.989 12.584 6.012
67 HE1 TYR 10 HE1 TYR 10 -0.741 12.303 4.507
68 HE2 TYR 10 HE2 TYR 10 2.163 12.635 7.673
69 HH TYR 10 HH TYR 10 -0.125 12.559 8.014
70 H ASN 11 H ASN 11 2.085 9.345 1.997
71 HA ASN 11 HA ASN 11 1.456 8.591 -0.018
72 HB3 ASN 11 HB2 ASN 11 2.890 10.614 -1.662
73 HD21 ASN 11 1HD2 ASN 11 1.998 10.262 -3.604
74 HD22 ASN 11 2HD2 ASN 11 0.336 9.777 -3.904
75 H CYS 12 H CYS 12 3.987 7.639 1.140
76 HA CYS 12 HA CYS 12 5.431 6.759 -1.338
77 HB3 CYS 12 HB2 CYS 12 7.465 6.748 -0.065
78 H VAL 13 H VAL 13 5.423 4.504 -1.493
79 HA VAL 13 HA VAL 13 3.797 3.020 0.415
80 HB VAL 13 HB VAL 13 4.300 1.072 -0.983
81 HG11 VAL 13 1HG1 VAL 13 3.150 1.788 -2.988
82 HG12 VAL 13 2HG1 VAL 13 2.455 2.627 -1.592
83 HG13 VAL 13 3HG1 VAL 13 3.568 3.481 -2.687
84 HG21 VAL 13 3HG2 VAL 13 6.019 2.921 -2.703
85 HG22 VAL 13 1HG2 VAL 13 6.636 1.623 -1.665
86 HG23 VAL 13 2HG2 VAL 13 5.597 1.234 -3.040
87 H TYR 14 H TYR 14 4.576 1.054 1.539
88 HA TYR 14 HA TYR 14 7.290 1.296 2.692
89 HB3 TYR 14 HB2 TYR 14 6.667 -0.783 3.856
90 HD1 TYR 14 HD1 TYR 14 7.195 0.959 5.564
91 HD2 TYR 14 HD2 TYR 14 3.301 0.594 3.766
92 HE1 TYR 14 HE1 TYR 14 6.183 2.059 7.532
93 HE2 TYR 14 HE2 TYR 14 2.289 1.726 5.721
94 HH TYR 14 HH TYR 14 4.229 2.820 8.515
95 H HIS 15 H HIS 15 8.165 1.298 0.508
96 HA HIS 15 HA HIS 15 8.259 -0.232 -1.595
97 HB3 HIS 15 HB2 HIS 15 10.709 0.409 0.073
98 HD1 HIS 15 HD1 HIS 15 11.604 -1.999 -1.193
99 HD2 HIS 15 HD2 HIS 15 11.012 1.499 -3.452
100 HE1 HIS 15 HE1 HIS 15 12.977 -2.272 -3.359
101 H CYS 16 H CYS 16 7.334 -2.285 -1.354
102 HA CYS 16 HA CYS 16 8.314 -4.092 0.589
103 HB3 CYS 16 HB2 CYS 16 5.976 -3.992 -0.020
104 H ALA 17 H ALA 17 9.769 -5.648 0.530
105 HA ALA 17 HA ALA 17 11.190 -6.489 -1.842
106 HB1 ALA 17 HB3 ALA 17 12.121 -8.214 -0.353
107 HB2 ALA 17 HB1 ALA 17 12.188 -6.612 0.406
108 HB3 ALA 17 HB2 ALA 17 10.949 -7.784 0.910
109 H ARG 18 H ARG 18 8.336 -7.692 -0.014
110 HA ARG 18 HA ARG 18 7.617 -9.373 -2.291
111 HB3 ARG 18 HB2 ARG 18 7.092 -11.293 -0.643
112 HG3 ARG 18 HG2 ARG 18 9.316 -12.208 -0.411
113 HD3 ARG 18 HD2 ARG 18 10.038 -12.344 -2.707
114 HE ARG 18 HE ARG 18 7.956 -13.475 -2.438
115 HH11 ARG 18 2HH2 ARG 18 7.613 -10.351 -4.227
116 HH12 ARG 18 1HH2 ARG 18 5.873 -10.634 -4.404
117 HH21 ARG 18 1HH1 ARG 18 5.658 -13.739 -2.980
118 HH22 ARG 18 2HH1 ARG 18 4.890 -12.351 -3.759
119 H ASP 19 H ASP 19 5.462 -10.030 -2.332
120 HA ASP 19 HA ASP 19 3.349 -8.569 -1.449
121 HB3 ASP 19 HB2 ASP 19 2.063 -10.682 -1.675
122 H ALA 20 H ALA 20 4.500 -11.555 0.162
123 HA ALA 20 HA ALA 20 2.816 -11.523 2.349
124 HB1 ALA 20 HB3 ALA 20 4.452 -13.004 3.444
125 HB2 ALA 20 HB1 ALA 20 4.241 -13.429 1.736
126 HB3 ALA 20 HB2 ALA 20 5.692 -12.540 2.259
127 H TYR 21 H TYR 21 6.114 -10.039 2.253
128 HA TYR 21 HA TYR 21 6.140 -9.016 4.909
129 HB3 TYR 21 HB2 TYR 21 7.342 -8.079 2.277
130 HD1 TYR 21 HD1 TYR 21 8.325 -7.565 5.864
131 HD2 TYR 21 HD2 TYR 21 7.208 -5.721 2.134
132 HE1 TYR 21 HE1 TYR 21 8.744 -5.334 6.841
133 HE2 TYR 21 HE2 TYR 21 7.629 -3.482 3.113
134 HH TYR 21 HH TYR 21 8.713 -3.053 6.488
135 H CYS 22 H CYS 22 4.903 -7.466 1.902
136 HA CYS 22 HA CYS 22 3.953 -5.165 3.363
137 HB3 CYS 22 HB2 CYS 22 2.854 -6.281 0.764
138 H ASN 23 H ASN 23 2.392 -8.246 2.480
139 HA ASN 23 HA ASN 23 -0.215 -7.696 3.356
140 HB3 ASN 23 HB2 ASN 23 1.259 -9.973 2.444
141 HD21 ASN 23 1HD2 ASN 23 -1.225 -9.898 5.151
142 HD22 ASN 23 2HD2 ASN 23 -0.792 -11.515 5.670
143 H GLU 24 H GLU 24 2.566 -8.986 5.242
144 HA GLU 24 HA GLU 24 1.322 -9.238 7.746
145 HB3 GLU 24 HB2 GLU 24 4.161 -8.521 6.879
146 HG3 GLU 24 HG2 GLU 24 3.172 -9.197 9.651
147 H LEU 25 H LEU 25 3.053 -6.448 6.302
148 HA LEU 25 HA LEU 25 2.551 -4.613 8.369
149 HB3 LEU 25 HB2 LEU 25 2.756 -3.900 5.405
150 HG LEU 25 HG LEU 25 3.037 -2.390 7.993
151 HD11 LEU 25 1HD1 LEU 25 5.340 -2.466 7.085
152 HD12 LEU 25 2HD1 LEU 25 4.730 -1.891 5.516
153 HD13 LEU 25 3HD1 LEU 25 4.627 -0.854 6.960
154 HD21 LEU 25 3HD2 LEU 25 2.341 -1.505 5.149
155 HD22 LEU 25 1HD2 LEU 25 1.128 -1.976 6.344
156 HD23 LEU 25 2HD2 LEU 25 2.145 -0.573 6.650
157 H CYS 26 H CYS 26 0.486 -5.325 5.535
158 HA CYS 26 HA CYS 26 -1.510 -3.387 5.907
159 HB3 CYS 26 HB2 CYS 26 -2.987 -4.893 4.645
160 H THR 27 H THR 27 -1.376 -6.821 7.110
161 HA THR 27 HA THR 27 -3.763 -6.554 8.662
162 HB THR 27 HB THR 27 -2.793 -8.610 9.855
163 HG1 THR 27 HG1 THR 27 -0.552 -7.942 8.867
164 HG21 THR 27 3HG2 THR 27 -4.435 -8.679 8.005
165 HG22 THR 27 1HG2 THR 27 -3.127 -8.550 6.817
166 HG23 THR 27 2HG2 THR 27 -3.257 -9.999 7.838
167 H LYS 28 H LYS 28 -0.394 -5.773 9.475
168 HA LYS 28 HA LYS 28 -0.909 -5.244 12.239
169 HB3 LYS 28 HB2 LYS 28 1.144 -3.494 11.150
170 HG3 LYS 28 HG2 LYS 28 1.188 -6.118 12.721
171 HD3 LYS 28 HD2 LYS 28 3.423 -5.379 13.505
172 HE3 LYS 28 HE2 LYS 28 3.433 -5.730 10.469
173 HZ1 LYS 28 HZ3 LYS 28 5.277 -6.751 12.527
174 HZ2 LYS 28 HZ1 LYS 28 5.352 -7.054 10.938
175 HZ3 LYS 28 HZ2 LYS 28 5.607 -5.525 11.466
176 H ASN 29 H ASN 29 -1.400 -3.346 9.289
177 HA ASN 29 HA ASN 29 -2.189 -0.931 10.803
178 HB3 ASN 29 HB2 ASN 29 -2.764 -0.112 8.461
179 HD21 ASN 29 1HD2 ASN 29 0.321 -1.979 8.755
180 HD22 ASN 29 2HD2 ASN 29 1.315 -0.538 8.958
181 H GLY 30 H GLY 30 -3.732 -3.784 9.581
182 HA2 GLY 30 HA2 GLY 30 -5.816 -4.425 10.519
183 HA3 GLY 30 HA3 GLY 30 -6.358 -2.747 10.570
184 H ALA 31 H ALA 31 -4.740 -3.906 7.683
185 HA ALA 31 HA ALA 31 -7.285 -4.042 6.142
186 HB1 ALA 31 HB3 ALA 31 -5.328 -4.203 4.290
187 HB2 ALA 31 HB1 ALA 31 -5.942 -2.657 4.907
188 HB3 ALA 31 HB2 ALA 31 -4.426 -3.331 5.536
189 H LYS 32 H LYS 32 -7.785 -5.954 5.052
190 HA LYS 32 HA LYS 32 -7.273 -8.235 6.600
191 HB3 LYS 32 HB2 LYS 32 -9.194 -7.800 5.014
192 HG3 LYS 32 HG2 LYS 32 -7.476 -9.442 3.087
193 HD3 LYS 32 HD2 LYS 32 -9.941 -9.697 2.797
194 HE3 LYS 32 HE2 LYS 32 -9.647 -6.689 2.403
195 HZ1 LYS 32 HZ3 LYS 32 -11.027 -7.494 0.603
196 HZ2 LYS 32 HZ1 LYS 32 -12.088 -8.149 1.713
197 HZ3 LYS 32 HZ2 LYS 32 -11.778 -6.530 1.695
198 H SER 33 H SER 33 -5.535 -7.138 3.712
199 HA SER 33 HA SER 33 -3.238 -8.731 4.139
200 HB3 SER 33 HB2 SER 33 -4.687 -10.619 3.417
201 HG SER 33 HG SER 33 -5.047 -9.226 0.969
202 H GLY 34 H GLY 34 -2.133 -8.747 1.630
203 HA2 GLY 34 HA2 GLY 34 -2.957 -6.565 -0.017
204 HA3 GLY 34 HA3 GLY 34 -1.432 -6.225 0.854
205 H SER 35 H SER 35 -0.995 -6.264 -1.682
206 HA SER 35 HA SER 35 0.640 -8.593 -2.142
207 HB3 SER 35 HB2 SER 35 -1.740 -8.011 -3.959
208 HG SER 35 HG SER 35 0.597 -9.571 -4.424
209 H CYS 36 H CYS 36 2.032 -8.174 -3.981
210 HA CYS 36 HA CYS 36 2.616 -5.237 -4.209
211 HB3 CYS 36 HB2 CYS 36 4.959 -6.021 -4.434
212 HA PRO 37 HA PRO 37 2.218 -6.515 -8.633
213 HB3 PRO 37 HB2 PRO 37 0.291 -5.281 -8.968
214 HG3 PRO 37 HG2 PRO 37 -0.316 -3.501 -7.495
215 HD3 PRO 37 HD2 PRO 37 0.081 -5.393 -6.094
216 H TYR 38 H TYR 38 4.220 -6.472 -9.470
217 HA TYR 38 HA TYR 38 6.112 -4.226 -8.955
218 HB3 TYR 38 HB2 TYR 38 7.718 -5.806 -10.062
219 HD1 TYR 38 HD1 TYR 38 8.552 -4.773 -7.898
220 HD2 TYR 38 HD2 TYR 38 5.898 -8.167 -7.934
221 HE1 TYR 38 HE1 TYR 38 8.924 -5.084 -5.480
222 HE2 TYR 38 HE2 TYR 38 6.253 -8.464 -5.507
223 HH TYR 38 HH TYR 38 8.221 -6.205 -3.562
224 H LEU 39 H LEU 39 4.378 -5.925 -11.495
225 HA LEU 39 HA LEU 39 5.095 -3.785 -13.459
226 HB3 LEU 39 HB2 LEU 39 6.122 -5.743 -14.192
227 HG LEU 39 HG LEU 39 5.078 -7.515 -12.879
228 HD11 LEU 39 1HD1 LEU 39 2.896 -8.506 -13.656
229 HD12 LEU 39 2HD1 LEU 39 2.709 -6.946 -12.865
230 HD13 LEU 39 3HD1 LEU 39 2.626 -7.057 -14.643
231 HD21 LEU 39 3HD2 LEU 39 6.277 -8.053 -14.970
232 HD22 LEU 39 1HD2 LEU 39 4.971 -9.206 -14.648
233 HD23 LEU 39 2HD2 LEU 39 4.753 -7.943 -15.876
234 H GLY 40 H GLY 40 2.704 -4.172 -11.441
235 HA2 GLY 40 HA2 GLY 40 0.465 -4.746 -13.325
236 HA3 GLY 40 HA3 GLY 40 0.417 -4.774 -11.568
237 H GLU 41 H GLU 41 -1.036 -3.267 -10.923
238 HA GLU 41 HA GLU 41 -1.792 -0.923 -12.333
239 HB3 GLU 41 HB2 GLU 41 -2.876 -0.332 -10.165
240 HG3 GLU 41 HG2 GLU 41 -3.252 -3.254 -10.946
241 H HIS 42 H HIS 42 -0.746 0.987 -12.481
242 HA HIS 42 HA HIS 42 1.066 2.371 -12.493
243 HB3 HIS 42 HB2 HIS 42 1.635 3.373 -10.234
244 HD1 HIS 42 HD1 HIS 42 0.630 5.274 -11.892
245 HD2 HIS 42 HD2 HIS 42 -2.069 2.834 -9.807
246 HE1 HIS 42 HE1 HIS 42 -1.652 6.408 -12.068
247 H LYS 43 H LYS 43 1.634 -0.400 -12.647
248 HA LYS 43 HA LYS 43 3.210 -1.844 -12.742
249 HB3 LYS 43 HB2 LYS 43 5.599 -0.914 -12.794
250 HG3 LYS 43 HG2 LYS 43 4.357 -1.791 -14.711
251 HD3 LYS 43 HD2 LYS 43 3.767 0.913 -15.784
252 HE3 LYS 43 HE2 LYS 43 3.211 -1.173 -17.043
253 HZ1 LYS 43 HZ3 LYS 43 1.258 -1.610 -14.837
254 HZ2 LYS 43 HZ1 LYS 43 1.125 -2.283 -16.328
255 HZ3 LYS 43 HZ2 LYS 43 2.381 -2.656 -15.366
256 H PHE 44 H PHE 44 4.880 0.267 -10.371
257 HA PHE 44 HA PHE 44 5.210 -2.192 -8.725
258 HB3 PHE 44 HB2 PHE 44 7.148 0.042 -9.150
259 HD1 PHE 44 HD1 PHE 44 6.340 -2.933 -6.929
260 HD2 PHE 44 HD2 PHE 44 9.214 0.147 -7.927
261 HE1 PHE 44 HE1 PHE 44 7.417 -3.225 -4.751
262 HE2 PHE 44 HE2 PHE 44 10.393 -0.298 -5.804
263 HZ PHE 44 HZ PHE 44 9.483 -1.960 -4.189
264 H ALA 45 H ALA 45 4.056 -2.104 -6.871
265 HA ALA 45 HA ALA 45 4.413 0.034 -5.005
266 HB1 ALA 45 HB3 ALA 45 1.968 0.677 -4.850
267 HB2 ALA 45 HB1 ALA 45 2.698 1.180 -6.376
268 HB3 ALA 45 HB2 ALA 45 1.684 -0.270 -6.329
269 H CYS 46 H CYS 46 2.519 -0.511 -3.150
270 HA CYS 46 HA CYS 46 1.938 -3.426 -3.200
271 HB3 CYS 46 HB2 CYS 46 2.534 -1.854 -0.685
272 H TYR 47 H TYR 47 -0.160 -3.749 -3.283
273 HA TYR 47 HA TYR 47 -2.113 -1.649 -2.504
274 HB3 TYR 47 HB2 TYR 47 -3.432 -4.023 -3.184
275 HD1 TYR 47 HD1 TYR 47 -5.000 -2.029 -2.990
276 HD2 TYR 47 HD2 TYR 47 -2.170 -2.556 -6.199
277 HE1 TYR 47 HE1 TYR 47 -6.407 -0.629 -4.467
278 HE2 TYR 47 HE2 TYR 47 -3.480 -0.992 -7.592
279 HH TYR 47 HH TYR 47 -5.734 -0.482 -7.965
280 H CYS 48 H CYS 48 -3.044 -1.770 -0.532
281 HA CYS 48 HA CYS 48 -3.063 -4.362 0.952
282 HB3 CYS 48 HB2 CYS 48 -3.813 -2.957 2.897
283 H LYS 49 H LYS 49 -5.164 -4.857 1.829
284 HA LYS 49 HA LYS 49 -7.473 -3.792 0.247
285 HB3 LYS 49 HB2 LYS 49 -8.215 -6.177 0.201
286 HG3 LYS 49 HG2 LYS 49 -6.444 -7.158 -1.271
287 HD3 LYS 49 HD2 LYS 49 -6.980 -4.213 -1.805
288 HE3 LYS 49 HE2 LYS 49 -6.628 -6.488 -3.775
289 HZ1 LYS 49 HZ3 LYS 49 -6.869 -4.793 -5.388
290 HZ2 LYS 49 HZ1 LYS 49 -8.084 -4.514 -4.286
291 HZ3 LYS 49 HZ2 LYS 49 -6.751 -3.587 -4.277
292 H ASP 50 H ASP 50 -9.288 -3.279 1.395
293 HA ASP 50 HA ASP 50 -10.585 -2.706 3.086
294 HB3 ASP 50 HB2 ASP 50 -10.490 -4.257 5.187
295 H LEU 51 H LEU 51 -8.434 -1.262 2.719
296 HA LEU 51 HA LEU 51 -7.079 -0.453 5.137
297 HB3 LEU 51 HB2 LEU 51 -7.080 1.805 3.902
298 HG LEU 51 HG LEU 51 -5.491 1.345 2.286
299 HD11 LEU 51 1HD1 LEU 51 -4.812 1.057 4.669
300 HD12 LEU 51 2HD1 LEU 51 -4.917 -0.699 4.450
301 HD13 LEU 51 3HD1 LEU 51 -3.777 0.248 3.485
302 HD21 LEU 51 3HD2 LEU 51 -5.969 -1.635 2.426
303 HD22 LEU 51 1HD2 LEU 51 -6.832 -0.597 1.273
304 HD23 LEU 51 2HD2 LEU 51 -5.079 -0.661 1.218
305 HA PRO 52 HA PRO 52 -10.974 1.305 6.794
306 HB3 PRO 52 HB2 PRO 52 -10.384 0.470 8.873
307 HG3 PRO 52 HG2 PRO 52 -8.094 0.354 9.568
308 HD3 PRO 52 HD2 PRO 52 -8.131 -0.806 7.506
309 H ASP 53 H ASP 53 -11.760 3.404 6.813
310 HA ASP 53 HA ASP 53 -10.936 5.127 5.019
311 HB3 ASP 53 HB2 ASP 53 -12.410 6.765 6.057
312 H ASN 54 H ASN 54 -10.101 5.511 8.437
313 HA ASN 54 HA ASN 54 -8.778 7.949 8.390
314 HB3 ASN 54 HB2 ASN 54 -8.103 5.473 10.033
315 HD21 ASN 54 1HD2 ASN 54 -6.033 5.772 10.872
316 HD22 ASN 54 2HD2 ASN 54 -5.489 7.320 11.494
317 H VAL 55 H VAL 55 -7.438 4.776 7.353
318 HA VAL 55 HA VAL 55 -4.717 5.762 7.349
319 HB VAL 55 HB VAL 55 -5.939 3.264 6.132
320 HG11 VAL 55 1HG1 VAL 55 -3.561 2.461 6.066
321 HG12 VAL 55 2HG1 VAL 55 -3.861 3.786 4.932
322 HG13 VAL 55 3HG1 VAL 55 -3.018 4.095 6.466
323 HG21 VAL 55 3HG2 VAL 55 -4.908 2.152 8.072
324 HG22 VAL 55 1HG2 VAL 55 -4.256 3.699 8.647
325 HG23 VAL 55 2HG2 VAL 55 -6.005 3.419 8.645
326 HA PRO 56 HA PRO 56 -5.535 7.945 3.519
327 HB3 PRO 56 HB2 PRO 56 -4.129 9.582 4.376
328 HG3 PRO 56 HG2 PRO 56 -2.097 9.006 5.531
329 HD3 PRO 56 HD2 PRO 56 -3.887 7.935 6.670
330 H ILE 57 H ILE 57 -5.063 7.819 1.286
331 HA ILE 57 HA ILE 57 -3.893 5.238 0.423
332 HB ILE 57 HB ILE 57 -5.182 5.398 -1.493
333 HG13 ILE 57 2HG1 ILE 57 -6.638 7.177 -2.189
334 HG21 ILE 57 1HG2 ILE 57 -6.997 6.405 0.741
335 HG22 ILE 57 2HG2 ILE 57 -7.445 5.406 -0.651
336 HG23 ILE 57 3HG2 ILE 57 -6.370 4.762 0.603
337 HD11 ILE 57 3HD1 ILE 57 -6.456 9.452 -1.467
338 HD12 ILE 57 1HD1 ILE 57 -6.920 8.491 -0.061
339 HD13 ILE 57 2HD1 ILE 57 -5.244 9.066 -0.249
340 H ARG 58 H ARG 58 -2.314 5.143 -1.196
341 HA ARG 58 HA ARG 58 -0.583 7.445 -1.460
342 HB3 ARG 58 HB2 ARG 58 -0.335 4.929 -3.129
343 HG3 ARG 58 HG2 ARG 58 2.074 5.243 -2.438
344 HD3 ARG 58 HD2 ARG 58 0.736 7.370 -4.113
345 HE ARG 58 HE ARG 58 3.402 7.331 -3.341
346 HH11 ARG 58 2HH2 ARG 58 1.256 8.186 -5.972
347 HH12 ARG 58 1HH2 ARG 58 2.517 9.053 -6.840
348 HH21 ARG 58 1HH1 ARG 58 5.015 8.529 -4.526
349 HH22 ARG 58 2HH1 ARG 58 4.420 9.460 -5.893
350 H VAL 59 H VAL 59 -1.561 9.144 -2.643
351 HA VAL 59 HA VAL 59 -3.344 8.548 -4.859
352 HB VAL 59 HB VAL 59 -3.469 10.926 -5.253
353 HG11 VAL 59 1HG1 VAL 59 -4.390 11.620 -3.111
354 HG12 VAL 59 2HG1 VAL 59 -4.798 9.927 -3.433
355 HG13 VAL 59 3HG1 VAL 59 -3.518 10.327 -2.268
356 HG21 VAL 59 3HG2 VAL 59 -1.089 11.582 -4.855
357 HG22 VAL 59 1HG2 VAL 59 -2.276 12.601 -4.033
358 HG23 VAL 59 2HG2 VAL 59 -1.380 11.396 -3.109
359 HA PRO 60 HA PRO 60 -0.247 7.991 -7.922
360 HB3 PRO 60 HB2 PRO 60 -1.985 7.156 -9.175
361 HG3 PRO 60 HG2 PRO 60 -4.053 8.352 -9.446
362 HD3 PRO 60 HD2 PRO 60 -3.697 7.928 -7.136
363 H GLY 61 H GLY 61 0.644 10.130 -6.696
364 HA2 GLY 61 HA2 GLY 61 1.882 11.631 -8.902
365 HA3 GLY 61 HA3 GLY 61 0.945 12.595 -7.749
366 H LYS 62 H LYS 62 2.291 13.519 -6.352
367 HA LYS 62 HA LYS 62 4.990 12.967 -6.041
368 HB3 LYS 62 HB2 LYS 62 3.914 15.152 -5.729
369 HG3 LYS 62 HG2 LYS 62 2.957 14.050 -3.043
370 HD3 LYS 62 HD2 LYS 62 2.721 16.841 -4.276
371 HE3 LYS 62 HE2 LYS 62 1.950 17.416 -1.927
372 HZ1 LYS 62 HZ3 LYS 62 -0.272 16.628 -2.176
373 HZ2 LYS 62 HZ1 LYS 62 0.293 17.113 -3.639
374 HZ3 LYS 62 HZ2 LYS 62 0.170 15.506 -3.289
375 H CYS 63 H CYS 63 6.059 12.945 -3.739
376 HA CYS 63 HA CYS 63 4.849 11.358 -1.664
377 HB3 CYS 63 HB2 CYS 63 6.838 10.230 -3.614
378 H HIS 64 H HIS 64 5.764 12.189 0.254
379 HA HIS 64 HA HIS 64 8.101 14.031 -0.003
380 HB3 HIS 64 HB2 HIS 64 7.394 14.968 2.063
381 HD1 HIS 64 HD1 HIS 64 4.252 15.260 2.747
382 HD2 HIS 64 HD2 HIS 64 6.064 15.379 -1.053
383 HE1 HIS 64 HE1 HIS 64 2.659 16.534 1.215
Start of MODEL 9
1 H1 VAL 1 H VAL 1 -14.603 1.579 4.631
2 HA VAL 1 HA VAL 1 -11.979 0.768 5.265
3 HB VAL 1 HB VAL 1 -12.322 -1.675 4.861
4 HG11 VAL 1 1HG1 VAL 1 -13.097 -2.250 7.121
5 HG12 VAL 1 2HG1 VAL 1 -11.981 -0.878 7.147
6 HG13 VAL 1 3HG1 VAL 1 -13.729 -0.605 7.341
7 HG21 VAL 1 3HG2 VAL 1 -14.554 -1.600 3.782
8 HG22 VAL 1 1HG2 VAL 1 -14.542 -2.682 5.179
9 HG23 VAL 1 2HG2 VAL 1 -15.283 -1.080 5.318
10 H ARG 2 H ARG 2 -10.916 -0.148 3.306
11 HA ARG 2 HA ARG 2 -12.381 -0.260 0.811
12 HB3 ARG 2 HB2 ARG 2 -12.249 2.159 0.921
13 HG3 ARG 2 HG2 ARG 2 -9.279 1.785 1.563
14 HD3 ARG 2 HD2 ARG 2 -10.911 4.117 0.577
15 HE ARG 2 HE ARG 2 -10.230 5.419 2.274
16 HH11 ARG 2 2HH2 ARG 2 -7.592 3.048 2.057
17 HH12 ARG 2 1HH2 ARG 2 -6.587 4.057 3.107
18 HH21 ARG 2 1HH1 ARG 2 -8.930 6.568 3.420
19 HH22 ARG 2 2HH1 ARG 2 -7.365 5.988 3.934
20 H ASP 3 H ASP 3 -10.648 -0.422 -0.991
21 HA ASP 3 HA ASP 3 -8.280 -1.936 0.022
22 HB3 ASP 3 HB2 ASP 3 -8.219 -3.186 -2.008
23 H ALA 4 H ALA 4 -6.341 -0.955 -0.591
24 HA ALA 4 HA ALA 4 -6.322 1.089 -2.711
25 HB1 ALA 4 HB3 ALA 4 -6.191 1.912 0.216
26 HB2 ALA 4 HB1 ALA 4 -5.881 2.956 -1.188
27 HB3 ALA 4 HB2 ALA 4 -7.507 2.296 -0.922
28 H TYR 5 H TYR 5 -4.227 2.151 -2.884
29 HA TYR 5 HA TYR 5 -1.976 0.413 -2.174
30 HB3 TYR 5 HB2 TYR 5 -0.668 2.367 -3.147
31 HD1 TYR 5 HD1 TYR 5 -0.309 -0.131 -3.820
32 HD2 TYR 5 HD2 TYR 5 -3.093 2.524 -5.764
33 HE1 TYR 5 HE1 TYR 5 -0.509 -1.717 -5.698
34 HE2 TYR 5 HE2 TYR 5 -3.270 0.941 -7.661
35 HH TYR 5 HH TYR 5 -1.920 -1.087 -8.643
36 H ILE 6 H ILE 6 -1.145 0.474 -0.117
37 HA ILE 6 HA ILE 6 -2.080 2.520 1.676
38 HB ILE 6 HB ILE 6 -1.539 0.180 2.249
39 HG13 ILE 6 2HG1 ILE 6 -1.791 2.041 3.888
40 HG21 ILE 6 1HG2 ILE 6 0.659 0.074 0.986
41 HG22 ILE 6 2HG2 ILE 6 1.378 1.064 2.259
42 HG23 ILE 6 3HG2 ILE 6 0.755 -0.558 2.628
43 HD11 ILE 6 3HD1 ILE 6 -0.880 0.818 5.795
44 HD12 ILE 6 1HD1 ILE 6 -1.678 -0.271 4.645
45 HD13 ILE 6 2HD1 ILE 6 0.094 -0.196 4.719
46 H ALA 7 H ALA 7 -0.871 4.217 2.704
47 HA ALA 7 HA ALA 7 1.822 4.809 1.660
48 HB1 ALA 7 HB3 ALA 7 1.178 7.140 1.210
49 HB2 ALA 7 HB1 ALA 7 0.293 6.023 0.153
50 HB3 ALA 7 HB2 ALA 7 -0.526 6.760 1.546
51 H GLN 8 H GLN 8 2.962 6.313 3.003
52 HA GLN 8 HA GLN 8 1.749 6.969 5.643
53 HB3 GLN 8 HB2 GLN 8 3.439 5.080 5.682
54 HG3 GLN 8 HG2 GLN 8 5.647 7.074 5.383
55 HE21 GLN 8 1HE2 GLN 8 5.090 4.520 3.063
56 HE22 GLN 8 2HE2 GLN 8 6.205 3.351 3.760
57 H ASN 9 H ASN 9 3.333 8.726 6.608
58 HA ASN 9 HA ASN 9 3.252 11.177 5.441
59 HB3 ASN 9 HB2 ASN 9 5.158 11.767 6.863
60 HD21 ASN 9 1HD2 ASN 9 3.807 12.830 8.327
61 HD22 ASN 9 2HD2 ASN 9 2.665 11.996 9.364
62 H TYR 10 H TYR 10 5.714 11.247 2.753
63 HA TYR 10 HA TYR 10 2.814 11.456 3.454
64 HB3 TYR 10 HB2 TYR 10 3.690 13.770 1.999
65 HD1 TYR 10 HD1 TYR 10 1.200 13.910 2.302
66 HD2 TYR 10 HD2 TYR 10 3.922 13.965 5.645
67 HE1 TYR 10 HE1 TYR 10 -0.624 14.703 3.770
68 HE2 TYR 10 HE2 TYR 10 2.083 14.751 7.120
69 HH TYR 10 HH TYR 10 -1.231 15.309 5.915
70 H ASN 11 H ASN 11 2.202 9.907 2.176
71 HA ASN 11 HA ASN 11 1.187 9.183 0.298
72 HB3 ASN 11 HB2 ASN 11 2.888 10.673 -1.659
73 HD21 ASN 11 1HD2 ASN 11 1.913 10.786 -3.674
74 HD22 ASN 11 2HD2 ASN 11 0.386 10.001 -4.040
75 H CYS 12 H CYS 12 3.812 8.421 1.632
76 HA CYS 12 HA CYS 12 5.375 7.362 -0.688
77 HB3 CYS 12 HB2 CYS 12 7.195 7.164 0.904
78 H VAL 13 H VAL 13 5.681 5.247 -1.006
79 HA VAL 13 HA VAL 13 3.982 3.343 0.450
80 HB VAL 13 HB VAL 13 4.767 1.701 -1.174
81 HG11 VAL 13 1HG1 VAL 13 2.838 3.164 -1.708
82 HG12 VAL 13 2HG1 VAL 13 3.939 4.297 -2.529
83 HG13 VAL 13 3HG1 VAL 13 3.722 2.654 -3.158
84 HG21 VAL 13 3HG2 VAL 13 7.081 2.477 -1.577
85 HG22 VAL 13 1HG2 VAL 13 6.176 2.312 -3.084
86 HG23 VAL 13 2HG2 VAL 13 6.463 3.922 -2.404
87 H TYR 14 H TYR 14 4.828 1.466 1.522
88 HA TYR 14 HA TYR 14 7.403 1.862 2.882
89 HB3 TYR 14 HB2 TYR 14 6.855 -0.251 3.987
90 HD1 TYR 14 HD1 TYR 14 6.753 1.460 5.798
91 HD2 TYR 14 HD2 TYR 14 3.389 0.632 3.245
92 HE1 TYR 14 HE1 TYR 14 5.213 2.299 7.546
93 HE2 TYR 14 HE2 TYR 14 1.857 1.429 5.008
94 HH TYR 14 HH TYR 14 1.701 1.834 7.375
95 H HIS 15 H HIS 15 8.896 -0.200 2.844
96 HA HIS 15 HA HIS 15 9.763 -0.489 0.094
97 HB3 HIS 15 HB2 HIS 15 10.827 -1.798 2.619
98 HD1 HIS 15 HD1 HIS 15 11.006 -2.906 -0.694
99 HD2 HIS 15 HD2 HIS 15 13.846 -1.227 1.938
100 HE1 HIS 15 HE1 HIS 15 13.289 -3.626 -1.524
101 H CYS 16 H CYS 16 7.618 -1.490 -0.551
102 HA CYS 16 HA CYS 16 7.230 -4.304 -0.134
103 HB3 CYS 16 HB2 CYS 16 6.304 -2.371 -2.159
104 H ALA 17 H ALA 17 7.773 -6.001 -1.550
105 HA ALA 17 HA ALA 17 10.191 -6.099 -3.075
106 HB1 ALA 17 HB3 ALA 17 10.422 -6.911 -0.132
107 HB2 ALA 17 HB1 ALA 17 11.618 -7.272 -1.395
108 HB3 ALA 17 HB2 ALA 17 11.306 -5.593 -0.925
109 H ARG 18 H ARG 18 8.083 -7.737 -0.707
110 HA ARG 18 HA ARG 18 7.555 -9.931 -2.648
111 HB3 ARG 18 HB2 ARG 18 7.056 -11.390 -0.714
112 HG3 ARG 18 HG2 ARG 18 9.220 -11.757 0.375
113 HD3 ARG 18 HD2 ARG 18 8.809 -12.686 -1.942
114 HE ARG 18 HE ARG 18 9.602 -10.122 -2.763
115 HH11 ARG 18 2HH2 ARG 18 10.608 -13.391 -3.597
116 HH12 ARG 18 1HH2 ARG 18 11.147 -12.958 -5.194
117 HH21 ARG 18 1HH1 ARG 18 10.184 -9.529 -4.703
118 HH22 ARG 18 2HH1 ARG 18 10.894 -10.618 -5.886
119 H ASP 19 H ASP 19 5.347 -10.729 -2.402
120 HA ASP 19 HA ASP 19 3.330 -8.680 -2.026
121 HB3 ASP 19 HB2 ASP 19 3.112 -10.397 -3.789
122 H ALA 20 H ALA 20 4.447 -11.709 -0.500
123 HA ALA 20 HA ALA 20 2.799 -11.786 1.721
124 HB1 ALA 20 HB3 ALA 20 4.428 -13.548 1.151
125 HB2 ALA 20 HB1 ALA 20 5.771 -12.494 1.650
126 HB3 ALA 20 HB2 ALA 20 4.593 -13.066 2.852
127 H TYR 21 H TYR 21 5.867 -9.976 1.501
128 HA TYR 21 HA TYR 21 5.939 -8.785 4.059
129 HB3 TYR 21 HB2 TYR 21 6.799 -7.774 1.326
130 HD1 TYR 21 HD2 TYR 21 5.967 -5.443 1.533
131 HD2 TYR 21 HD1 TYR 21 8.662 -7.155 4.433
132 HE1 TYR 21 HE2 TYR 21 6.451 -3.186 2.416
133 HE2 TYR 21 HE1 TYR 21 9.225 -4.886 5.237
134 HH TYR 21 HH TYR 21 8.868 -2.630 4.984
135 H CYS 22 H CYS 22 4.304 -7.667 1.055
136 HA CYS 22 HA CYS 22 3.192 -5.324 2.284
137 HB3 CYS 22 HB2 CYS 22 2.479 -6.901 -0.219
138 H ASN 23 H ASN 23 1.803 -8.616 1.761
139 HA ASN 23 HA ASN 23 -0.749 -8.078 2.882
140 HB3 ASN 23 HB2 ASN 23 0.875 -10.645 3.013
141 HD21 ASN 23 1HD2 ASN 23 -0.080 -11.287 5.061
142 HD22 ASN 23 2HD2 ASN 23 -1.791 -11.656 5.142
143 H GLU 24 H GLU 24 2.246 -9.215 4.534
144 HA GLU 24 HA GLU 24 1.200 -9.290 7.159
145 HB3 GLU 24 HB2 GLU 24 4.007 -8.789 6.046
146 HG3 GLU 24 HG2 GLU 24 3.018 -9.049 8.894
147 H LEU 25 H LEU 25 2.754 -6.596 5.339
148 HA LEU 25 HA LEU 25 2.782 -4.826 7.531
149 HB3 LEU 25 HB2 LEU 25 2.552 -3.987 4.596
150 HG LEU 25 HG LEU 25 3.527 -2.748 7.172
151 HD11 LEU 25 1HD1 LEU 25 5.087 -1.303 5.971
152 HD12 LEU 25 2HD1 LEU 25 5.595 -2.993 5.868
153 HD13 LEU 25 3HD1 LEU 25 4.814 -2.224 4.470
154 HD21 LEU 25 3HD2 LEU 25 2.473 -1.469 4.616
155 HD22 LEU 25 1HD2 LEU 25 1.404 -2.013 5.912
156 HD23 LEU 25 2HD2 LEU 25 2.599 -0.769 6.252
157 H CYS 26 H CYS 26 0.435 -5.273 4.934
158 HA CYS 26 HA CYS 26 -1.461 -3.317 5.533
159 HB3 CYS 26 HB2 CYS 26 -3.034 -4.889 4.317
160 H THR 27 H THR 27 -1.407 -6.796 6.686
161 HA THR 27 HA THR 27 -3.687 -6.419 8.370
162 HB THR 27 HB THR 27 -2.803 -8.489 9.526
163 HG1 THR 27 HG1 THR 27 -1.059 -9.488 8.353
164 HG21 THR 27 3HG2 THR 27 -3.219 -9.941 7.565
165 HG22 THR 27 1HG2 THR 27 -4.366 -8.592 7.608
166 HG23 THR 27 2HG2 THR 27 -2.997 -8.556 6.476
167 H LYS 28 H LYS 28 -0.196 -6.016 9.000
168 HA LYS 28 HA LYS 28 -0.396 -5.311 11.726
169 HB3 LYS 28 HB2 LYS 28 1.605 -3.729 10.209
170 HG3 LYS 28 HG2 LYS 28 1.844 -5.977 12.268
171 HD3 LYS 28 HD2 LYS 28 4.054 -4.965 12.754
172 HE3 LYS 28 HE2 LYS 28 5.370 -5.538 10.802
173 HZ1 LYS 28 HZ3 LYS 28 3.091 -7.386 10.708
174 HZ2 LYS 28 HZ1 LYS 28 4.660 -7.703 10.375
175 HZ3 LYS 28 HZ2 LYS 28 4.228 -7.416 11.912
176 H ASN 29 H ASN 29 -1.091 -3.425 8.824
177 HA ASN 29 HA ASN 29 -1.636 -0.948 10.376
178 HB3 ASN 29 HB2 ASN 29 -2.094 -0.013 8.074
179 HD21 ASN 29 1HD2 ASN 29 0.760 -2.199 8.522
180 HD22 ASN 29 2HD2 ASN 29 1.923 -0.878 8.567
181 H GLY 30 H GLY 30 -3.276 -3.625 10.446
182 HA2 GLY 30 HA2 GLY 30 -5.383 -3.928 11.185
183 HA3 GLY 30 HA3 GLY 30 -5.729 -2.212 10.943
184 H ALA 31 H ALA 31 -4.555 -4.040 8.192
185 HA ALA 31 HA ALA 31 -7.202 -3.842 6.873
186 HB1 ALA 31 HB3 ALA 31 -4.887 -3.143 5.875
187 HB2 ALA 31 HB1 ALA 31 -4.656 -4.896 5.682
188 HB3 ALA 31 HB2 ALA 31 -5.990 -4.072 4.858
189 H LYS 32 H LYS 32 -7.599 -5.896 5.295
190 HA LYS 32 HA LYS 32 -7.695 -8.254 7.067
191 HB3 LYS 32 HB2 LYS 32 -8.753 -7.807 4.258
192 HG3 LYS 32 HG2 LYS 32 -9.482 -9.859 6.387
193 HD3 LYS 32 HD2 LYS 32 -10.526 -9.480 3.533
194 HE3 LYS 32 HE2 LYS 32 -12.399 -10.906 4.294
195 HZ1 LYS 32 HZ3 LYS 32 -9.843 -12.186 5.005
196 HZ2 LYS 32 HZ1 LYS 32 -11.244 -12.964 4.635
197 HZ3 LYS 32 HZ2 LYS 32 -10.464 -12.088 3.481
198 H SER 33 H SER 33 -6.094 -7.232 4.020
199 HA SER 33 HA SER 33 -3.938 -9.136 4.283
200 HB3 SER 33 HB2 SER 33 -5.523 -10.788 3.542
201 HG SER 33 HG SER 33 -6.828 -10.378 1.672
202 H GLY 34 H GLY 34 -2.735 -9.112 1.905
203 HA2 GLY 34 HA2 GLY 34 -3.367 -6.766 0.326
204 HA3 GLY 34 HA3 GLY 34 -1.905 -6.554 1.312
205 H SER 35 H SER 35 -1.457 -6.332 -1.231
206 HA SER 35 HA SER 35 0.313 -8.546 -1.904
207 HB3 SER 35 HB2 SER 35 -1.710 -9.512 -2.829
208 HG SER 35 HG SER 35 -2.232 -6.830 -3.510
209 H CYS 36 H CYS 36 1.941 -7.700 -3.332
210 HA CYS 36 HA CYS 36 1.721 -4.771 -3.849
211 HB3 CYS 36 HB2 CYS 36 4.178 -6.496 -3.624
212 HA PRO 37 HA PRO 37 1.550 -6.579 -8.064
213 HB3 PRO 37 HB2 PRO 37 -0.611 -5.941 -8.439
214 HG3 PRO 37 HG2 PRO 37 -1.554 -4.061 -7.263
215 HD3 PRO 37 HD2 PRO 37 -0.628 -5.651 -5.720
216 H TYR 38 H TYR 38 2.466 -5.983 -9.969
217 HA TYR 38 HA TYR 38 4.367 -3.732 -10.141
218 HB3 TYR 38 HB2 TYR 38 6.059 -5.222 -10.969
219 HD1 TYR 38 HD1 TYR 38 6.549 -4.226 -8.583
220 HD2 TYR 38 HD2 TYR 38 4.823 -8.106 -9.254
221 HE1 TYR 38 HE1 TYR 38 7.134 -4.886 -6.257
222 HE2 TYR 38 HE2 TYR 38 5.416 -8.776 -6.946
223 HH TYR 38 HH TYR 38 6.159 -8.038 -4.905
224 H LEU 39 H LEU 39 5.095 -3.819 -12.581
225 HA LEU 39 HA LEU 39 4.191 -3.017 -14.593
226 HB3 LEU 39 HB2 LEU 39 5.544 -4.861 -15.098
227 HG LEU 39 HG LEU 39 3.421 -6.526 -13.878
228 HD11 LEU 39 1HD1 LEU 39 4.554 -7.383 -16.571
229 HD12 LEU 39 2HD1 LEU 39 3.619 -8.400 -15.452
230 HD13 LEU 39 3HD1 LEU 39 2.853 -7.001 -16.221
231 HD21 LEU 39 3HD2 LEU 39 5.845 -6.436 -13.200
232 HD22 LEU 39 1HD2 LEU 39 5.271 -8.070 -13.584
233 HD23 LEU 39 2HD2 LEU 39 6.268 -7.179 -14.752
234 H GLY 40 H GLY 40 2.169 -2.141 -13.412
235 HA2 GLY 40 HA2 GLY 40 -0.101 -2.522 -15.049
236 HA3 GLY 40 HA3 GLY 40 -0.297 -3.442 -13.534
237 H GLU 41 H GLU 41 -2.044 -1.828 -13.079
238 HA GLU 41 HA GLU 41 -1.750 0.910 -12.805
239 HB3 GLU 41 HB2 GLU 41 -3.571 0.721 -11.119
240 HG3 GLU 41 HG2 GLU 41 -3.955 -1.120 -13.529
241 H HIS 42 H HIS 42 -0.236 1.992 -11.753
242 HA HIS 42 HA HIS 42 1.212 2.725 -10.211
243 HB3 HIS 42 HB2 HIS 42 -0.260 1.190 -8.070
244 HD1 HIS 42 HD1 HIS 42 2.623 2.236 -7.599
245 HD2 HIS 42 HD2 HIS 42 -0.910 4.448 -7.062
246 HE1 HIS 42 HE1 HIS 42 3.214 4.199 -6.036
247 H LYS 43 H LYS 43 1.854 0.340 -11.610
248 HA LYS 43 HA LYS 43 3.252 -1.673 -10.936
249 HB3 LYS 43 HB2 LYS 43 4.415 0.843 -12.172
250 HG3 LYS 43 HG2 LYS 43 5.547 -1.310 -13.496
251 HD3 LYS 43 HD2 LYS 43 6.855 0.362 -11.304
252 HE3 LYS 43 HE2 LYS 43 8.267 -1.537 -12.164
253 HZ1 LYS 43 HZ3 LYS 43 9.186 -1.230 -14.363
254 HZ2 LYS 43 HZ1 LYS 43 7.573 -1.506 -14.484
255 HZ3 LYS 43 HZ2 LYS 43 8.167 0.017 -14.678
256 H PHE 44 H PHE 44 3.865 -2.251 -8.851
257 HA PHE 44 HA PHE 44 5.397 -2.628 -7.272
258 HB3 PHE 44 HB2 PHE 44 7.029 -0.161 -7.893
259 HD1 PHE 44 HD2 PHE 44 7.335 -0.702 -5.239
260 HD2 PHE 44 HD1 PHE 44 8.799 -3.144 -8.492
261 HE1 PHE 44 HE2 PHE 44 8.890 -1.835 -3.699
262 HE2 PHE 44 HE1 PHE 44 10.366 -4.252 -6.938
263 HZ PHE 44 HZ PHE 44 10.398 -3.620 -4.529
264 H ALA 45 H ALA 45 3.277 -2.084 -6.283
265 HA ALA 45 HA ALA 45 3.962 -0.306 -4.074
266 HB1 ALA 45 HB3 ALA 45 1.870 1.076 -4.222
267 HB2 ALA 45 HB1 ALA 45 3.048 1.403 -5.498
268 HB3 ALA 45 HB2 ALA 45 1.607 0.425 -5.859
269 H CYS 46 H CYS 46 2.628 -0.622 -2.235
270 HA CYS 46 HA CYS 46 1.636 -3.368 -2.137
271 HB3 CYS 46 HB2 CYS 46 2.262 -1.285 -0.044
272 H TYR 47 H TYR 47 -0.422 -3.688 -2.816
273 HA TYR 47 HA TYR 47 -2.539 -1.728 -2.208
274 HB3 TYR 47 HB2 TYR 47 -2.838 -4.336 -3.713
275 HD1 TYR 47 HD2 TYR 47 -3.653 -0.719 -4.300
276 HD2 TYR 47 HD1 TYR 47 -5.249 -4.657 -3.599
277 HE1 TYR 47 HE2 TYR 47 -5.927 0.103 -4.829
278 HE2 TYR 47 HE1 TYR 47 -7.503 -3.842 -4.199
279 HH TYR 47 HH TYR 47 -8.331 -0.568 -4.133
280 H CYS 48 H CYS 48 -3.434 -1.903 -0.240
281 HA CYS 48 HA CYS 48 -3.608 -4.521 1.150
282 HB3 CYS 48 HB2 CYS 48 -4.403 -3.198 3.040
283 H LYS 49 H LYS 49 -5.562 -5.338 1.809
284 HA LYS 49 HA LYS 49 -7.991 -4.419 0.414
285 HB3 LYS 49 HB2 LYS 49 -8.709 -6.651 0.312
286 HG3 LYS 49 HG2 LYS 49 -6.827 -8.137 -0.405
287 HD3 LYS 49 HD2 LYS 49 -5.422 -6.333 -1.801
288 HE3 LYS 49 HE2 LYS 49 -6.919 -7.953 -2.806
289 HZ1 LYS 49 HZ3 LYS 49 -9.086 -5.994 -2.291
290 HZ2 LYS 49 HZ1 LYS 49 -9.237 -7.341 -3.191
291 HZ3 LYS 49 HZ2 LYS 49 -8.956 -7.441 -1.571
292 H ASP 50 H ASP 50 -9.776 -3.930 1.673
293 HA ASP 50 HA ASP 50 -11.038 -3.463 3.467
294 HB3 ASP 50 HB2 ASP 50 -9.705 -5.451 5.263
295 H LEU 51 H LEU 51 -8.655 -2.011 3.130
296 HA LEU 51 HA LEU 51 -7.255 -1.632 5.639
297 HB3 LEU 51 HB2 LEU 51 -7.358 0.033 3.095
298 HG LEU 51 HG LEU 51 -6.302 1.171 5.121
299 HD11 LEU 51 1HD1 LEU 51 -4.003 0.428 5.724
300 HD12 LEU 51 2HD1 LEU 51 -5.177 -0.814 6.151
301 HD13 LEU 51 3HD1 LEU 51 -4.188 -1.002 4.694
302 HD21 LEU 51 3HD2 LEU 51 -5.778 1.767 2.766
303 HD22 LEU 51 1HD2 LEU 51 -4.366 1.958 3.813
304 HD23 LEU 51 2HD2 LEU 51 -4.490 0.551 2.742
305 HA PRO 52 HA PRO 52 -10.663 1.061 7.037
306 HB3 PRO 52 HB2 PRO 52 -10.199 0.473 9.196
307 HG3 PRO 52 HG2 PRO 52 -7.964 -0.002 9.906
308 HD3 PRO 52 HD2 PRO 52 -8.374 -1.360 7.988
309 H ASP 53 H ASP 53 -11.175 3.177 6.584
310 HA ASP 53 HA ASP 53 -9.610 4.464 4.764
311 HB3 ASP 53 HB2 ASP 53 -11.801 5.719 6.447
312 H ASN 54 H ASN 54 -9.541 4.875 8.214
313 HA ASN 54 HA ASN 54 -8.182 7.214 8.743
314 HB3 ASN 54 HB2 ASN 54 -6.966 5.942 10.526
315 HD21 ASN 54 1HD2 ASN 54 -9.081 3.630 11.239
316 HD22 ASN 54 2HD2 ASN 54 -10.375 4.609 11.909
317 H VAL 55 H VAL 55 -6.777 4.270 7.230
318 HA VAL 55 HA VAL 55 -4.109 5.491 7.196
319 HB VAL 55 HB VAL 55 -5.034 2.879 5.984
320 HG11 VAL 55 1HG1 VAL 55 -2.888 3.759 5.077
321 HG12 VAL 55 2HG1 VAL 55 -2.268 3.948 6.731
322 HG13 VAL 55 3HG1 VAL 55 -2.622 2.335 6.099
323 HG21 VAL 55 3HG2 VAL 55 -3.798 3.448 8.716
324 HG22 VAL 55 1HG2 VAL 55 -5.429 2.811 8.414
325 HG23 VAL 55 2HG2 VAL 55 -4.018 1.835 8.006
326 HA PRO 56 HA PRO 56 -5.416 7.511 3.456
327 HB3 PRO 56 HB2 PRO 56 -3.990 9.219 4.077
328 HG3 PRO 56 HG2 PRO 56 -1.810 8.756 4.992
329 HD3 PRO 56 HD2 PRO 56 -3.423 7.634 6.347
330 H ILE 57 H ILE 57 -5.208 7.474 1.166
331 HA ILE 57 HA ILE 57 -4.152 4.968 0.019
332 HB ILE 57 HB ILE 57 -5.335 5.564 -1.946
333 HG13 ILE 57 2HG1 ILE 57 -4.887 7.955 -2.120
334 HG21 ILE 57 1HG2 ILE 57 -7.189 6.363 0.327
335 HG22 ILE 57 2HG2 ILE 57 -7.578 5.444 -1.143
336 HG23 ILE 57 3HG2 ILE 57 -6.579 4.711 0.115
337 HD11 ILE 57 3HD1 ILE 57 -6.999 8.785 -2.876
338 HD12 ILE 57 1HD1 ILE 57 -6.897 7.063 -3.299
339 HD13 ILE 57 2HD1 ILE 57 -7.896 7.597 -1.923
340 H ARG 58 H ARG 58 -2.576 4.985 -1.639
341 HA ARG 58 HA ARG 58 -0.704 7.226 -1.679
342 HB3 ARG 58 HB2 ARG 58 -0.571 4.835 -3.534
343 HG3 ARG 58 HG2 ARG 58 1.778 4.976 -3.178
344 HD3 ARG 58 HD2 ARG 58 0.736 7.808 -3.456
345 HE ARG 58 HE ARG 58 3.219 7.437 -3.046
346 HH11 ARG 58 2HH2 ARG 58 1.406 8.354 -5.874
347 HH12 ARG 58 1HH2 ARG 58 2.762 9.162 -6.653
348 HH21 ARG 58 1HH1 ARG 58 5.061 8.404 -4.151
349 HH22 ARG 58 2HH1 ARG 58 4.731 9.295 -5.623
350 H VAL 59 H VAL 59 -1.461 9.041 -2.894
351 HA VAL 59 HA VAL 59 -3.270 8.528 -5.172
352 HB VAL 59 HB VAL 59 -3.348 10.914 -5.505
353 HG11 VAL 59 1HG1 VAL 59 -3.720 10.168 -2.577
354 HG12 VAL 59 2HG1 VAL 59 -4.509 11.500 -3.443
355 HG13 VAL 59 3HG1 VAL 59 -4.866 9.823 -3.893
356 HG21 VAL 59 3HG2 VAL 59 -1.044 11.570 -4.806
357 HG22 VAL 59 1HG2 VAL 59 -2.322 12.530 -4.055
358 HG23 VAL 59 2HG2 VAL 59 -1.521 11.273 -3.112
359 HA PRO 60 HA PRO 60 0.110 8.073 -7.975
360 HB3 PRO 60 HB2 PRO 60 -1.489 7.150 -9.357
361 HG3 PRO 60 HG2 PRO 60 -3.596 8.240 -9.770
362 HD3 PRO 60 HD2 PRO 60 -3.398 7.836 -7.437
363 H GLY 61 H GLY 61 0.805 10.211 -6.693
364 HA2 GLY 61 HA2 GLY 61 1.862 12.040 -8.795
365 HA3 GLY 61 HA3 GLY 61 1.022 12.714 -7.387
366 H LYS 62 H LYS 62 2.722 13.672 -6.346
367 HA LYS 62 HA LYS 62 5.393 12.677 -6.191
368 HB3 LYS 62 HB2 LYS 62 5.669 14.466 -4.492
369 HG3 LYS 62 HG2 LYS 62 3.941 15.448 -6.800
370 HD3 LYS 62 HD2 LYS 62 6.042 16.765 -5.018
371 HE3 LYS 62 HE2 LYS 62 4.319 17.934 -7.264
372 HZ1 LYS 62 HZ3 LYS 62 4.754 19.493 -5.486
373 HZ2 LYS 62 HZ1 LYS 62 6.374 19.212 -5.578
374 HZ3 LYS 62 HZ2 LYS 62 5.588 19.914 -6.839
375 H CYS 63 H CYS 63 6.465 12.523 -3.913
376 HA CYS 63 HA CYS 63 4.838 11.561 -1.735
377 HB3 CYS 63 HB2 CYS 63 6.661 9.785 -3.269
378 H HIS 64 H HIS 64 5.801 12.450 0.128
379 HA HIS 64 HA HIS 64 8.331 14.017 -0.243
380 HB3 HIS 64 HB2 HIS 64 7.364 15.690 1.178
381 HD1 HIS 64 HD1 HIS 64 4.012 16.034 0.618
382 HD2 HIS 64 HD2 HIS 64 7.203 15.411 -2.048
383 HE1 HIS 64 HE1 HIS 64 3.236 16.886 -1.660
Start of MODEL 10
1 H1 VAL 1 H VAL 1 -15.415 1.454 5.178
2 HA VAL 1 HA VAL 1 -12.706 1.098 5.796
3 HB VAL 1 HB VAL 1 -12.597 -1.375 5.449
4 HG11 VAL 1 1HG1 VAL 1 -12.415 -0.469 7.719
5 HG12 VAL 1 2HG1 VAL 1 -14.180 -0.543 7.915
6 HG13 VAL 1 3HG1 VAL 1 -13.236 -2.035 7.721
7 HG21 VAL 1 3HG2 VAL 1 -14.593 -2.766 5.799
8 HG22 VAL 1 1HG2 VAL 1 -15.617 -1.325 5.913
9 HG23 VAL 1 2HG2 VAL 1 -14.810 -1.732 4.382
10 H ARG 2 H ARG 2 -11.585 0.103 3.825
11 HA ARG 2 HA ARG 2 -13.102 -0.059 1.342
12 HB3 ARG 2 HB2 ARG 2 -13.010 2.345 1.467
13 HG3 ARG 2 HG2 ARG 2 -10.092 1.987 2.255
14 HD3 ARG 2 HD2 ARG 2 -11.514 4.249 0.852
15 HE ARG 2 HE ARG 2 -10.844 5.662 2.506
16 HH11 ARG 2 2HH2 ARG 2 -8.192 3.287 2.315
17 HH12 ARG 2 1HH2 ARG 2 -7.167 4.348 3.293
18 HH21 ARG 2 1HH1 ARG 2 -9.526 6.856 3.571
19 HH22 ARG 2 2HH1 ARG 2 -7.936 6.316 4.053
20 H ASP 3 H ASP 3 -11.055 0.140 -0.483
21 HA ASP 3 HA ASP 3 -8.673 -1.164 0.616
22 HB3 ASP 3 HB2 ASP 3 -9.923 -3.018 -0.350
23 H ALA 4 H ALA 4 -6.801 -0.715 -0.829
24 HA ALA 4 HA ALA 4 -6.857 1.290 -2.842
25 HB1 ALA 4 HB3 ALA 4 -7.750 2.844 -1.124
26 HB2 ALA 4 HB1 ALA 4 -6.452 2.360 -0.011
27 HB3 ALA 4 HB2 ALA 4 -6.086 3.241 -1.498
28 H TYR 5 H TYR 5 -4.634 2.483 -2.847
29 HA TYR 5 HA TYR 5 -2.408 0.633 -2.449
30 HB3 TYR 5 HB2 TYR 5 -1.071 2.558 -3.176
31 HD1 TYR 5 HD1 TYR 5 -1.375 0.450 -4.770
32 HD2 TYR 5 HD2 TYR 5 -3.669 4.092 -5.038
33 HE1 TYR 5 HE1 TYR 5 -1.979 -0.107 -7.078
34 HE2 TYR 5 HE2 TYR 5 -4.366 3.473 -7.335
35 HH TYR 5 HH TYR 5 -3.974 0.257 -8.505
36 H ILE 6 H ILE 6 -1.551 0.380 -0.288
37 HA ILE 6 HA ILE 6 -2.340 2.302 1.712
38 HB ILE 6 HB ILE 6 -1.817 -0.054 2.136
39 HG13 ILE 6 2HG1 ILE 6 -1.889 1.782 3.868
40 HG21 ILE 6 1HG2 ILE 6 1.135 0.751 1.975
41 HG22 ILE 6 2HG2 ILE 6 0.505 -0.851 2.375
42 HG23 ILE 6 3HG2 ILE 6 0.293 -0.210 0.746
43 HD11 ILE 6 3HD1 ILE 6 -1.025 0.425 5.649
44 HD12 ILE 6 1HD1 ILE 6 -1.838 -0.603 4.455
45 HD13 ILE 6 2HD1 ILE 6 -0.064 -0.550 4.516
46 H ALA 7 H ALA 7 -1.016 3.866 2.791
47 HA ALA 7 HA ALA 7 1.618 4.469 1.625
48 HB1 ALA 7 HB3 ALA 7 -0.622 6.535 1.809
49 HB2 ALA 7 HB1 ALA 7 1.079 6.844 1.386
50 HB3 ALA 7 HB2 ALA 7 0.061 5.868 0.309
51 H GLN 8 H GLN 8 2.840 5.874 2.946
52 HA GLN 8 HA GLN 8 1.981 6.249 5.769
53 HB3 GLN 8 HB2 GLN 8 3.555 4.446 5.872
54 HG3 GLN 8 HG2 GLN 8 5.148 6.032 3.830
55 HE21 GLN 8 1HE2 GLN 8 6.972 4.281 2.986
56 HE22 GLN 8 2HE2 GLN 8 8.114 3.962 4.285
57 H ASN 9 H ASN 9 3.546 7.890 6.745
58 HA ASN 9 HA ASN 9 3.233 10.434 5.802
59 HB3 ASN 9 HB2 ASN 9 5.488 9.312 7.457
60 HD21 ASN 9 1HD2 ASN 9 6.662 10.905 8.715
61 HD22 ASN 9 2HD2 ASN 9 6.658 12.592 8.232
62 H TYR 10 H TYR 10 5.676 10.858 3.102
63 HA TYR 10 HA TYR 10 2.787 10.994 3.896
64 HB3 TYR 10 HB2 TYR 10 4.197 13.189 2.405
65 HD1 TYR 10 HD2 TYR 10 2.348 13.270 5.627
66 HD2 TYR 10 HD1 TYR 10 2.111 13.883 1.363
67 HE1 TYR 10 HE2 TYR 10 0.066 14.187 5.886
68 HE2 TYR 10 HE1 TYR 10 -0.183 14.784 1.627
69 HH TYR 10 HH TYR 10 -1.786 15.045 4.807
70 H ASN 11 H ASN 11 1.836 9.681 2.483
71 HA ASN 11 HA ASN 11 1.024 8.913 0.537
72 HB3 ASN 11 HB2 ASN 11 2.670 10.688 -1.228
73 HD21 ASN 11 1HD2 ASN 11 1.803 10.735 -3.267
74 HD22 ASN 11 2HD2 ASN 11 0.277 9.989 -3.711
75 H CYS 12 H CYS 12 3.810 8.189 1.751
76 HA CYS 12 HA CYS 12 5.272 7.373 -0.731
77 HB3 CYS 12 HB2 CYS 12 7.147 7.010 0.765
78 H VAL 13 H VAL 13 5.683 5.154 -1.137
79 HA VAL 13 HA VAL 13 3.884 3.262 0.175
80 HB VAL 13 HB VAL 13 6.087 2.580 -1.794
81 HG11 VAL 13 1HG1 VAL 13 3.363 1.390 -1.159
82 HG12 VAL 13 2HG1 VAL 13 4.311 0.942 -2.589
83 HG13 VAL 13 3HG1 VAL 13 4.957 0.609 -1.001
84 HG21 VAL 13 3HG2 VAL 13 3.322 3.658 -2.468
85 HG22 VAL 13 1HG2 VAL 13 4.857 4.461 -2.874
86 HG23 VAL 13 2HG2 VAL 13 4.436 2.940 -3.645
87 H TYR 14 H TYR 14 5.092 1.105 0.804
88 HA TYR 14 HA TYR 14 7.427 1.699 2.571
89 HB3 TYR 14 HB2 TYR 14 6.887 -0.480 3.584
90 HD1 TYR 14 HD2 TYR 14 6.870 1.316 5.343
91 HD2 TYR 14 HD1 TYR 14 3.404 0.378 2.961
92 HE1 TYR 14 HE2 TYR 14 5.394 2.105 7.168
93 HE2 TYR 14 HE1 TYR 14 1.942 1.119 4.800
94 HH TYR 14 HH TYR 14 1.870 1.672 7.130
95 H HIS 15 H HIS 15 9.166 0.066 2.500
96 HA HIS 15 HA HIS 15 9.931 -0.630 -0.204
97 HB3 HIS 15 HB2 HIS 15 11.142 -1.374 2.483
98 HD1 HIS 15 HD1 HIS 15 11.516 -3.836 1.074
99 HD2 HIS 15 HD2 HIS 15 13.574 -0.389 -0.174
100 HE1 HIS 15 HE1 HIS 15 13.489 -4.637 -0.372
101 H CYS 16 H CYS 16 8.026 -1.875 -0.785
102 HA CYS 16 HA CYS 16 7.295 -4.380 0.283
103 HB3 CYS 16 HB2 CYS 16 7.260 -3.478 -2.592
104 H ALA 17 H ALA 17 9.131 -5.533 0.975
105 HA ALA 17 HA ALA 17 11.174 -6.515 -0.755
106 HB1 ALA 17 HB3 ALA 17 11.435 -8.307 0.902
107 HB2 ALA 17 HB1 ALA 17 11.247 -6.735 1.704
108 HB3 ALA 17 HB2 ALA 17 9.887 -7.876 1.653
109 H ARG 18 H ARG 18 7.936 -7.852 0.078
110 HA ARG 18 HA ARG 18 7.798 -9.482 -2.351
111 HB3 ARG 18 HB2 ARG 18 7.196 -11.532 -0.951
112 HG3 ARG 18 HG2 ARG 18 9.364 -12.297 -0.181
113 HD3 ARG 18 HD2 ARG 18 8.700 -12.381 -2.645
114 HE ARG 18 HE ARG 18 10.294 -9.908 -2.561
115 HH11 ARG 18 2HH2 ARG 18 9.247 -12.418 -4.797
116 HH12 ARG 18 1HH2 ARG 18 9.069 -11.329 -6.140
117 HH21 ARG 18 1HH1 ARG 18 10.031 -8.472 -4.185
118 HH22 ARG 18 2HH1 ARG 18 9.624 -8.999 -5.796
119 H ASP 19 H ASP 19 5.664 -10.603 -2.438
120 HA ASP 19 HA ASP 19 3.507 -8.835 -1.933
121 HB3 ASP 19 HB2 ASP 19 3.461 -11.821 -2.562
122 H ALA 20 H ALA 20 4.005 -12.052 -0.456
123 HA ALA 20 HA ALA 20 2.184 -11.848 1.632
124 HB1 ALA 20 HB3 ALA 20 3.568 -13.520 2.800
125 HB2 ALA 20 HB1 ALA 20 3.414 -13.906 1.075
126 HB3 ALA 20 HB2 ALA 20 4.924 -13.198 1.697
127 H TYR 21 H TYR 21 5.605 -10.725 1.676
128 HA TYR 21 HA TYR 21 5.758 -9.637 4.286
129 HB3 TYR 21 HB2 TYR 21 6.932 -8.842 1.635
130 HD1 TYR 21 HD1 TYR 21 6.528 -6.405 1.724
131 HD2 TYR 21 HD2 TYR 21 8.672 -8.490 4.836
132 HE1 TYR 21 HE1 TYR 21 7.439 -4.266 2.546
133 HE2 TYR 21 HE2 TYR 21 9.778 -6.372 5.475
134 HH TYR 21 HH TYR 21 9.537 -3.552 3.341
135 H CYS 22 H CYS 22 4.502 -8.066 1.278
136 HA CYS 22 HA CYS 22 3.765 -5.714 2.784
137 HB3 CYS 22 HB2 CYS 22 2.286 -5.975 0.281
138 H ASN 23 H ASN 23 1.979 -8.634 1.852
139 HA ASN 23 HA ASN 23 -0.620 -7.872 2.752
140 HB3 ASN 23 HB2 ASN 23 0.688 -10.246 1.826
141 HD21 ASN 23 1HD2 ASN 23 -2.292 -10.624 3.699
142 HD22 ASN 23 2HD2 ASN 23 -1.643 -11.853 4.788
143 H GLU 24 H GLU 24 2.088 -9.396 4.533
144 HA GLU 24 HA GLU 24 0.971 -9.464 7.107
145 HB3 GLU 24 HB2 GLU 24 3.818 -9.214 6.026
146 HG3 GLU 24 HG2 GLU 24 2.928 -9.720 8.859
147 H LEU 25 H LEU 25 2.972 -6.897 5.561
148 HA LEU 25 HA LEU 25 2.769 -4.955 7.585
149 HB3 LEU 25 HB2 LEU 25 2.741 -4.380 4.576
150 HG LEU 25 HG LEU 25 3.320 -2.754 7.033
151 HD11 LEU 25 1HD1 LEU 25 5.488 -2.913 5.813
152 HD12 LEU 25 2HD1 LEU 25 4.670 -2.349 4.334
153 HD13 LEU 25 3HD1 LEU 25 4.781 -1.293 5.763
154 HD21 LEU 25 3HD2 LEU 25 2.263 -1.013 5.775
155 HD22 LEU 25 1HD2 LEU 25 2.331 -1.931 4.254
156 HD23 LEU 25 2HD2 LEU 25 1.218 -2.394 5.542
157 H CYS 26 H CYS 26 0.391 -5.607 4.945
158 HA CYS 26 HA CYS 26 -1.389 -3.503 5.534
159 HB3 CYS 26 HB2 CYS 26 -3.128 -4.894 4.451
160 H THR 27 H THR 27 -1.374 -6.904 6.770
161 HA THR 27 HA THR 27 -3.562 -6.481 8.552
162 HB THR 27 HB THR 27 -2.850 -8.494 9.730
163 HG1 THR 27 HG1 THR 27 -0.483 -8.125 8.274
164 HG21 THR 27 3HG2 THR 27 -2.603 -8.771 6.705
165 HG22 THR 27 1HG2 THR 27 -3.068 -10.031 7.861
166 HG23 THR 27 2HG2 THR 27 -4.121 -8.623 7.616
167 H LYS 28 H LYS 28 -0.064 -6.021 9.114
168 HA LYS 28 HA LYS 28 -0.169 -5.234 11.818
169 HB3 LYS 28 HB2 LYS 28 2.041 -4.053 10.781
170 HG3 LYS 28 HG2 LYS 28 1.553 -7.066 10.803
171 HD3 LYS 28 HD2 LYS 28 4.165 -5.522 11.187
172 HE3 LYS 28 HE2 LYS 28 3.476 -8.483 10.836
173 HZ1 LYS 28 HZ3 LYS 28 5.581 -7.663 9.769
174 HZ2 LYS 28 HZ1 LYS 28 6.208 -7.553 11.302
175 HZ3 LYS 28 HZ2 LYS 28 5.617 -8.978 10.663
176 H ASN 29 H ASN 29 -0.941 -3.503 8.827
177 HA ASN 29 HA ASN 29 -1.212 -0.911 10.268
178 HB3 ASN 29 HB2 ASN 29 -1.877 -0.125 7.936
179 HD21 ASN 29 1HD2 ASN 29 0.987 -2.294 8.328
180 HD22 ASN 29 2HD2 ASN 29 2.157 -0.974 8.247
181 H GLY 30 H GLY 30 -2.998 -3.563 10.479
182 HA2 GLY 30 HA2 GLY 30 -5.107 -3.832 11.228
183 HA3 GLY 30 HA3 GLY 30 -5.331 -2.076 11.200
184 H ALA 31 H ALA 31 -4.464 -4.084 8.371
185 HA ALA 31 HA ALA 31 -7.208 -3.690 7.232
186 HB1 ALA 31 HB3 ALA 31 -6.111 -3.934 5.031
187 HB2 ALA 31 HB1 ALA 31 -5.410 -2.587 5.943
188 HB3 ALA 31 HB2 ALA 31 -4.557 -4.137 5.843
189 H LYS 32 H LYS 32 -7.518 -5.642 5.476
190 HA LYS 32 HA LYS 32 -7.554 -8.007 7.223
191 HB3 LYS 32 HB2 LYS 32 -8.683 -7.575 4.435
192 HG3 LYS 32 HG2 LYS 32 -9.374 -9.562 6.639
193 HD3 LYS 32 HD2 LYS 32 -10.505 -9.260 3.811
194 HE3 LYS 32 HE2 LYS 32 -12.377 -10.623 4.686
195 HZ1 LYS 32 HZ3 LYS 32 -10.489 -11.879 3.866
196 HZ2 LYS 32 HZ1 LYS 32 -9.825 -11.927 5.376
197 HZ3 LYS 32 HZ2 LYS 32 -11.252 -12.688 5.079
198 H SER 33 H SER 33 -6.057 -6.969 4.164
199 HA SER 33 HA SER 33 -3.729 -8.511 4.462
200 HB3 SER 33 HB2 SER 33 -5.639 -9.684 2.381
201 HG SER 33 HG SER 33 -3.935 -11.162 2.103
202 H GLY 34 H GLY 34 -3.066 -8.775 1.689
203 HA2 GLY 34 HA2 GLY 34 -4.083 -6.758 0.011
204 HA3 GLY 34 HA3 GLY 34 -2.573 -6.151 0.734
205 H SER 35 H SER 35 -2.010 -6.209 -1.645
206 HA SER 35 HA SER 35 -0.204 -8.473 -1.927
207 HB3 SER 35 HB2 SER 35 -1.967 -9.530 -3.079
208 HG SER 35 HG SER 35 -2.526 -6.958 -4.152
209 H CYS 36 H CYS 36 1.390 -8.067 -3.598
210 HA CYS 36 HA CYS 36 1.921 -5.121 -3.865
211 HB3 CYS 36 HB2 CYS 36 3.868 -7.338 -3.372
212 HA PRO 37 HA PRO 37 2.161 -6.662 -8.244
213 HB3 PRO 37 HB2 PRO 37 0.326 -5.503 -8.971
214 HG3 PRO 37 HG2 PRO 37 -0.606 -3.758 -7.651
215 HD3 PRO 37 HD2 PRO 37 -0.284 -5.564 -6.151
216 H TYR 38 H TYR 38 4.108 -6.550 -9.159
217 HA TYR 38 HA TYR 38 6.029 -4.317 -8.613
218 HB3 TYR 38 HB2 TYR 38 7.453 -6.223 -9.916
219 HD1 TYR 38 HD1 TYR 38 6.172 -5.368 -6.511
220 HD2 TYR 38 HD2 TYR 38 9.326 -7.189 -8.830
221 HE1 TYR 38 HE1 TYR 38 7.700 -5.221 -4.578
222 HE2 TYR 38 HE2 TYR 38 10.798 -7.152 -6.841
223 HH TYR 38 HH TYR 38 9.731 -5.940 -3.663
224 H LEU 39 H LEU 39 4.474 -6.247 -11.152
225 HA LEU 39 HA LEU 39 5.194 -4.146 -13.166
226 HB3 LEU 39 HB2 LEU 39 5.244 -5.943 -14.844
227 HG LEU 39 HG LEU 39 7.083 -6.642 -12.506
228 HD11 LEU 39 1HD1 LEU 39 8.438 -7.789 -14.209
229 HD12 LEU 39 2HD1 LEU 39 6.821 -8.504 -14.097
230 HD13 LEU 39 3HD1 LEU 39 7.218 -7.420 -15.448
231 HD21 LEU 39 3HD2 LEU 39 8.788 -5.397 -13.827
232 HD22 LEU 39 1HD2 LEU 39 7.530 -4.911 -14.982
233 HD23 LEU 39 2HD2 LEU 39 7.477 -4.338 -13.299
234 H GLY 40 H GLY 40 2.997 -3.876 -11.488
235 HA2 GLY 40 HA2 GLY 40 0.719 -4.439 -13.366
236 HA3 GLY 40 HA3 GLY 40 0.620 -4.870 -11.656
237 H GLU 41 H GLU 41 -0.413 -3.337 -10.457
238 HA GLU 41 HA GLU 41 -1.263 -0.884 -11.515
239 HB3 GLU 41 HB2 GLU 41 -1.952 -0.365 -9.275
240 HG3 GLU 41 HG2 GLU 41 -2.378 -3.334 -9.848
241 H HIS 42 H HIS 42 -0.217 0.958 -11.794
242 HA HIS 42 HA HIS 42 1.499 2.503 -11.866
243 HB3 HIS 42 HB2 HIS 42 2.292 3.305 -9.643
244 HD1 HIS 42 HD1 HIS 42 -0.412 3.835 -11.540
245 HD2 HIS 42 HD2 HIS 42 -0.021 3.452 -7.367
246 HE1 HIS 42 HE1 HIS 42 -2.364 5.106 -10.501
247 H LYS 43 H LYS 43 2.197 -0.263 -12.455
248 HA LYS 43 HA LYS 43 3.628 -1.857 -12.474
249 HB3 LYS 43 HB2 LYS 43 6.006 -1.392 -12.318
250 HG3 LYS 43 HG2 LYS 43 4.548 0.495 -14.208
251 HD3 LYS 43 HD2 LYS 43 7.060 0.587 -14.253
252 HE3 LYS 43 HE2 LYS 43 6.717 -2.337 -15.115
253 HZ1 LYS 43 HZ3 LYS 43 8.303 -1.232 -16.530
254 HZ2 LYS 43 HZ1 LYS 43 9.147 -0.677 -15.229
255 HZ3 LYS 43 HZ2 LYS 43 9.061 -2.291 -15.528
256 H PHE 44 H PHE 44 4.998 0.161 -9.885
257 HA PHE 44 HA PHE 44 5.179 -2.225 -8.112
258 HB3 PHE 44 HB2 PHE 44 6.912 -0.946 -6.945
259 HD1 PHE 44 HD2 PHE 44 7.970 -3.098 -7.565
260 HD2 PHE 44 HD1 PHE 44 7.691 0.176 -10.359
261 HE1 PHE 44 HE2 PHE 44 9.670 -4.180 -9.008
262 HE2 PHE 44 HE1 PHE 44 9.440 -0.881 -11.764
263 HZ PHE 44 HZ PHE 44 10.402 -3.085 -11.112
264 H ALA 45 H ALA 45 3.513 -2.219 -6.568
265 HA ALA 45 HA ALA 45 3.296 0.092 -4.838
266 HB1 ALA 45 HB3 ALA 45 0.911 0.528 -5.152
267 HB2 ALA 45 HB1 ALA 45 1.744 0.790 -6.686
268 HB3 ALA 45 HB2 ALA 45 0.815 -0.700 -6.436
269 H CYS 46 H CYS 46 1.377 -0.458 -3.166
270 HA CYS 46 HA CYS 46 1.001 -3.387 -2.892
271 HB3 CYS 46 HB2 CYS 46 1.034 -3.153 -0.443
272 H TYR 47 H TYR 47 -1.069 -3.692 -3.197
273 HA TYR 47 HA TYR 47 -3.010 -1.568 -2.495
274 HB3 TYR 47 HB2 TYR 47 -3.634 -4.121 -3.988
275 HD1 TYR 47 HD2 TYR 47 -6.015 -3.835 -3.125
276 HD2 TYR 47 HD1 TYR 47 -3.965 -0.727 -5.281
277 HE1 TYR 47 HE2 TYR 47 -8.168 -2.729 -3.627
278 HE2 TYR 47 HE1 TYR 47 -6.097 0.498 -5.565
279 HH TYR 47 HH TYR 47 -9.154 -0.630 -4.114
280 H CYS 48 H CYS 48 -3.758 -1.731 -0.441
281 HA CYS 48 HA CYS 48 -3.872 -4.392 0.904
282 HB3 CYS 48 HB2 CYS 48 -4.310 -3.116 2.960
283 H LYS 49 H LYS 49 -5.747 -5.041 1.850
284 HA LYS 49 HA LYS 49 -8.282 -4.073 0.645
285 HB3 LYS 49 HB2 LYS 49 -8.992 -6.454 0.910
286 HG3 LYS 49 HG2 LYS 49 -7.419 -7.589 -0.691
287 HD3 LYS 49 HD2 LYS 49 -7.563 -6.078 -2.621
288 HE3 LYS 49 HE2 LYS 49 -10.121 -5.942 -0.946
289 HZ1 LYS 49 HZ3 LYS 49 -9.725 -5.845 -3.863
290 HZ2 LYS 49 HZ1 LYS 49 -11.176 -6.016 -3.094
291 HZ3 LYS 49 HZ2 LYS 49 -10.324 -4.664 -2.883
292 H ASP 50 H ASP 50 -9.721 -3.284 2.115
293 HA ASP 50 HA ASP 50 -11.038 -3.161 3.899
294 HB3 ASP 50 HB2 ASP 50 -9.508 -5.110 5.576
295 H LEU 51 H LEU 51 -9.027 -1.438 3.418
296 HA LEU 51 HA LEU 51 -7.467 -0.775 5.796
297 HB3 LEU 51 HB2 LEU 51 -7.316 1.489 4.528
298 HG LEU 51 HG LEU 51 -6.280 -1.073 3.263
299 HD11 LEU 51 1HD1 LEU 51 -4.870 0.465 1.833
300 HD12 LEU 51 2HD1 LEU 51 -6.600 0.530 1.464
301 HD13 LEU 51 3HD1 LEU 51 -5.838 1.827 2.415
302 HD21 LEU 51 3HD2 LEU 51 -5.267 -0.304 5.455
303 HD22 LEU 51 1HD2 LEU 51 -4.123 -0.235 4.106
304 HD23 LEU 51 2HD2 LEU 51 -4.897 1.249 4.687
305 HA PRO 52 HA PRO 52 -11.133 1.479 7.470
306 HB3 PRO 52 HB2 PRO 52 -10.433 0.873 9.601
307 HG3 PRO 52 HG2 PRO 52 -8.114 0.665 10.146
308 HD3 PRO 52 HD2 PRO 52 -8.363 -0.745 8.262
309 H ASP 53 H ASP 53 -11.689 3.634 7.006
310 HA ASP 53 HA ASP 53 -10.192 4.816 5.042
311 HB3 ASP 53 HB2 ASP 53 -12.306 6.176 6.739
312 H ASN 54 H ASN 54 -9.969 5.400 8.466
313 HA ASN 54 HA ASN 54 -8.558 7.773 8.728
314 HB3 ASN 54 HB2 ASN 54 -8.008 5.091 10.071
315 HD21 ASN 54 1HD2 ASN 54 -5.850 5.247 10.770
316 HD22 ASN 54 2HD2 ASN 54 -5.279 6.650 11.661
317 H VAL 55 H VAL 55 -7.280 4.664 7.444
318 HA VAL 55 HA VAL 55 -4.566 5.724 7.263
319 HB VAL 55 HB VAL 55 -5.773 3.158 6.180
320 HG11 VAL 55 1HG1 VAL 55 -3.749 3.769 4.906
321 HG12 VAL 55 2HG1 VAL 55 -2.868 4.084 6.417
322 HG13 VAL 55 3HG1 VAL 55 -3.375 2.440 6.014
323 HG21 VAL 55 3HG2 VAL 55 -5.770 3.281 8.672
324 HG22 VAL 55 1HG2 VAL 55 -4.590 2.106 8.080
325 HG23 VAL 55 2HG2 VAL 55 -4.048 3.700 8.643
326 HA PRO 56 HA PRO 56 -5.815 7.784 3.466
327 HB3 PRO 56 HB2 PRO 56 -4.285 9.418 4.062
328 HG3 PRO 56 HG2 PRO 56 -2.142 8.853 4.998
329 HD3 PRO 56 HD2 PRO 56 -3.829 7.891 6.382
330 H ILE 57 H ILE 57 -4.901 7.900 1.083
331 HA ILE 57 HA ILE 57 -4.199 5.143 0.175
332 HB ILE 57 HB ILE 57 -5.634 5.404 -1.673
333 HG13 ILE 57 2HG1 ILE 57 -5.887 8.295 -0.898
334 HG21 ILE 57 1HG2 ILE 57 -6.560 4.684 0.559
335 HG22 ILE 57 2HG2 ILE 57 -7.217 6.322 0.756
336 HG23 ILE 57 3HG2 ILE 57 -7.775 5.301 -0.580
337 HD11 ILE 57 3HD1 ILE 57 -4.752 7.645 -3.027
338 HD12 ILE 57 1HD1 ILE 57 -6.184 6.713 -3.510
339 HD13 ILE 57 2HD1 ILE 57 -6.287 8.470 -3.361
340 H ARG 58 H ARG 58 -2.612 5.036 -1.396
341 HA ARG 58 HA ARG 58 -0.833 7.255 -1.615
342 HB3 ARG 58 HB2 ARG 58 -0.710 4.950 -3.564
343 HG3 ARG 58 HG2 ARG 58 1.647 5.003 -3.003
344 HD3 ARG 58 HD2 ARG 58 0.596 7.764 -3.639
345 HE ARG 58 HE ARG 58 3.085 7.373 -2.895
346 HH11 ARG 58 2HH2 ARG 58 1.387 8.675 -5.625
347 HH12 ARG 58 1HH2 ARG 58 2.756 9.607 -6.218
348 HH21 ARG 58 1HH1 ARG 58 4.964 8.450 -3.759
349 HH22 ARG 58 2HH1 ARG 58 4.724 9.554 -5.093
350 H VAL 59 H VAL 59 -1.660 9.135 -2.667
351 HA VAL 59 HA VAL 59 -3.369 8.820 -5.025
352 HB VAL 59 HB VAL 59 -3.282 11.237 -5.267
353 HG11 VAL 59 1HG1 VAL 59 -3.855 10.312 -2.423
354 HG12 VAL 59 2HG1 VAL 59 -4.436 11.815 -3.166
355 HG13 VAL 59 3HG1 VAL 59 -4.959 10.258 -3.817
356 HG21 VAL 59 3HG2 VAL 59 -0.970 11.709 -4.439
357 HG22 VAL 59 1HG2 VAL 59 -2.224 12.721 -3.719
358 HG23 VAL 59 2HG2 VAL 59 -1.556 11.386 -2.783
359 HA PRO 60 HA PRO 60 0.057 8.460 -7.848
360 HB3 PRO 60 HB2 PRO 60 -1.535 7.597 -9.280
361 HG3 PRO 60 HG2 PRO 60 -3.656 8.679 -9.628
362 HD3 PRO 60 HD2 PRO 60 -3.459 8.148 -7.322
363 H GLY 61 H GLY 61 0.704 10.514 -6.426
364 HA2 GLY 61 HA2 GLY 61 1.736 12.512 -8.359
365 HA3 GLY 61 HA3 GLY 61 0.767 13.085 -6.989
366 H LYS 62 H LYS 62 2.282 14.041 -5.719
367 HA LYS 62 HA LYS 62 5.031 13.319 -5.535
368 HB3 LYS 62 HB2 LYS 62 4.926 14.936 -3.541
369 HG3 LYS 62 HG2 LYS 62 5.499 15.752 -5.794
370 HD3 LYS 62 HD2 LYS 62 2.504 16.401 -5.928
371 HE3 LYS 62 HE2 LYS 62 3.107 17.569 -8.075
372 HZ1 LYS 62 HZ3 LYS 62 2.793 18.905 -6.101
373 HZ2 LYS 62 HZ1 LYS 62 4.395 18.807 -5.733
374 HZ3 LYS 62 HZ2 LYS 62 3.910 19.571 -7.101
375 H CYS 63 H CYS 63 6.063 13.085 -3.235
376 HA CYS 63 HA CYS 63 4.521 11.832 -1.218
377 HB3 CYS 63 HB2 CYS 63 6.206 10.186 -2.973
378 H HIS 64 H HIS 64 5.746 12.223 0.848
379 HA HIS 64 HA HIS 64 8.178 13.942 0.483
380 HB3 HIS 64 HB2 HIS 64 7.292 15.559 1.984
381 HD1 HIS 64 HD1 HIS 64 6.817 17.403 0.227
382 HD2 HIS 64 HD2 HIS 64 4.117 14.179 0.107
383 HE1 HIS 64 HE1 HIS 64 5.008 18.010 -1.472
Start of MODEL 11
1 H1 VAL 1 H VAL 1 -15.265 0.916 4.034
2 HA VAL 1 HA VAL 1 -12.675 0.597 5.080
3 HB VAL 1 HB VAL 1 -13.707 -2.102 4.299
4 HG11 VAL 1 1HG1 VAL 1 -11.938 -1.176 6.602
5 HG12 VAL 1 2HG1 VAL 1 -12.123 -2.830 5.999
6 HG13 VAL 1 3HG1 VAL 1 -11.388 -1.591 4.964
7 HG21 VAL 1 3HG2 VAL 1 -14.452 -2.718 6.543
8 HG22 VAL 1 1HG2 VAL 1 -14.413 -1.014 7.051
9 HG23 VAL 1 2HG2 VAL 1 -15.560 -1.559 5.798
10 H ARG 2 H ARG 2 -11.240 -0.315 3.247
11 HA ARG 2 HA ARG 2 -12.541 -0.828 0.694
12 HB3 ARG 2 HB2 ARG 2 -12.565 1.602 0.598
13 HG3 ARG 2 HG2 ARG 2 -9.581 1.470 1.295
14 HD3 ARG 2 HD2 ARG 2 -11.330 3.558 0.045
15 HE ARG 2 HE ARG 2 -11.015 4.979 1.772
16 HH11 ARG 2 2HH2 ARG 2 -7.975 3.158 1.651
17 HH12 ARG 2 1HH2 ARG 2 -7.084 4.418 2.499
18 HH21 ARG 2 1HH1 ARG 2 -10.007 6.390 2.888
19 HH22 ARG 2 2HH1 ARG 2 -8.423 6.089 3.540
20 H ASP 3 H ASP 3 -10.788 -1.118 -0.988
21 HA ASP 3 HA ASP 3 -8.331 -2.313 0.215
22 HB3 ASP 3 HB2 ASP 3 -8.200 -3.799 -1.699
23 H ALA 4 H ALA 4 -6.513 -1.124 -0.399
24 HA ALA 4 HA ALA 4 -6.512 0.519 -2.824
25 HB1 ALA 4 HB3 ALA 4 -6.582 2.669 -1.695
26 HB2 ALA 4 HB1 ALA 4 -8.084 1.785 -1.391
27 HB3 ALA 4 HB2 ALA 4 -6.838 1.871 -0.122
28 H TYR 5 H TYR 5 -4.597 2.159 -2.665
29 HA TYR 5 HA TYR 5 -2.206 0.647 -1.923
30 HB3 TYR 5 HB2 TYR 5 -1.057 2.720 -2.657
31 HD1 TYR 5 HD1 TYR 5 -0.397 0.595 -3.855
32 HD2 TYR 5 HD2 TYR 5 -3.623 3.150 -5.143
33 HE1 TYR 5 HE1 TYR 5 -0.315 -0.432 -6.107
34 HE2 TYR 5 HE2 TYR 5 -3.483 2.168 -7.417
35 HH TYR 5 HH TYR 5 -1.052 -0.284 -8.227
36 H ILE 6 H ILE 6 -1.925 0.482 0.344
37 HA ILE 6 HA ILE 6 -2.422 2.638 2.121
38 HB ILE 6 HB ILE 6 -2.143 0.356 2.839
39 HG13 ILE 6 2HG1 ILE 6 -1.642 2.381 4.288
40 HG21 ILE 6 1HG2 ILE 6 -0.417 -0.487 1.314
41 HG22 ILE 6 2HG2 ILE 6 0.787 0.604 2.008
42 HG23 ILE 6 3HG2 ILE 6 0.133 -0.714 2.971
43 HD11 ILE 6 3HD1 ILE 6 -1.993 0.091 5.160
44 HD12 ILE 6 1HD1 ILE 6 -0.232 -0.172 5.111
45 HD13 ILE 6 2HD1 ILE 6 -0.913 1.101 6.147
46 H ALA 7 H ALA 7 -1.121 4.294 2.825
47 HA ALA 7 HA ALA 7 1.309 4.945 1.177
48 HB1 ALA 7 HB3 ALA 7 -0.626 6.770 2.655
49 HB2 ALA 7 HB1 ALA 7 0.794 7.281 1.725
50 HB3 ALA 7 HB2 ALA 7 -0.575 6.507 0.898
51 H GLN 8 H GLN 8 3.168 5.752 2.247
52 HA GLN 8 HA GLN 8 3.308 5.569 5.210
53 HB3 GLN 8 HB2 GLN 8 5.661 6.239 4.833
54 HG3 GLN 8 HG2 GLN 8 4.997 3.908 3.003
55 HE21 GLN 8 1HE2 GLN 8 7.121 4.023 1.925
56 HE22 GLN 8 2HE2 GLN 8 8.588 3.862 2.872
57 H ASN 9 H ASN 9 4.286 7.513 6.242
58 HA ASN 9 HA ASN 9 3.114 10.103 5.555
59 HB3 ASN 9 HB2 ASN 9 5.011 10.791 7.221
60 HD21 ASN 9 1HD2 ASN 9 2.231 8.491 7.309
61 HD22 ASN 9 2HD2 ASN 9 1.453 9.297 8.660
62 H TYR 10 H TYR 10 5.805 10.985 3.212
63 HA TYR 10 HA TYR 10 2.846 10.993 3.723
64 HB3 TYR 10 HB2 TYR 10 3.142 13.356 2.697
65 HD1 TYR 10 HD1 TYR 10 1.268 13.475 4.269
66 HD2 TYR 10 HD2 TYR 10 5.324 13.116 5.681
67 HE1 TYR 10 HE1 TYR 10 0.468 13.623 6.611
68 HE2 TYR 10 HE2 TYR 10 4.517 13.265 8.019
69 HH TYR 10 HH TYR 10 2.511 12.594 9.190
70 H ASN 11 H ASN 11 2.386 9.491 2.256
71 HA ASN 11 HA ASN 11 1.470 8.956 0.290
72 HB3 ASN 11 HB2 ASN 11 2.924 10.936 -1.410
73 HD21 ASN 11 1HD2 ASN 11 1.930 11.074 -3.379
74 HD22 ASN 11 2HD2 ASN 11 0.458 10.206 -3.774
75 H CYS 12 H CYS 12 4.322 8.337 1.289
76 HA CYS 12 HA CYS 12 5.672 7.638 -1.263
77 HB3 CYS 12 HB2 CYS 12 7.563 7.091 0.134
78 H VAL 13 H VAL 13 5.923 5.578 -1.967
79 HA VAL 13 HA VAL 13 3.970 3.626 -1.039
80 HB VAL 13 HB VAL 13 4.909 2.196 -2.809
81 HG11 VAL 13 1HG1 VAL 13 4.342 5.035 -3.742
82 HG12 VAL 13 2HG1 VAL 13 4.263 3.571 -4.736
83 HG13 VAL 13 3HG1 VAL 13 3.141 3.772 -3.383
84 HG21 VAL 13 3HG2 VAL 13 6.839 4.472 -3.425
85 HG22 VAL 13 1HG2 VAL 13 7.289 2.906 -2.709
86 HG23 VAL 13 2HG2 VAL 13 6.615 2.974 -4.343
87 H TYR 14 H TYR 14 4.847 1.278 -0.772
88 HA TYR 14 HA TYR 14 7.087 1.267 1.208
89 HB3 TYR 14 HB2 TYR 14 6.107 -0.900 1.906
90 HD1 TYR 14 HD2 TYR 14 3.211 1.348 1.108
91 HD2 TYR 14 HD1 TYR 14 6.062 0.097 4.098
92 HE1 TYR 14 HE2 TYR 14 2.009 2.640 2.811
93 HE2 TYR 14 HE1 TYR 14 4.746 1.281 5.828
94 HH TYR 14 HH TYR 14 1.917 3.318 5.051
95 H HIS 15 H HIS 15 8.738 -0.269 0.855
96 HA HIS 15 HA HIS 15 9.247 -0.922 -1.909
97 HB3 HIS 15 HB2 HIS 15 10.721 -1.860 0.586
98 HD1 HIS 15 HD1 HIS 15 12.466 -0.361 -2.415
99 HD2 HIS 15 HD2 HIS 15 11.404 -4.146 -0.901
100 HE1 HIS 15 HE1 HIS 15 13.758 -2.087 -3.780
101 H CYS 16 H CYS 16 7.560 -2.243 -2.583
102 HA CYS 16 HA CYS 16 6.525 -4.434 -1.156
103 HB3 CYS 16 HB2 CYS 16 5.918 -3.031 -3.530
104 H ALA 17 H ALA 17 8.304 -5.540 -0.379
105 HA ALA 17 HA ALA 17 10.133 -6.967 -1.983
106 HB1 ALA 17 HB3 ALA 17 9.141 -7.729 0.786
107 HB2 ALA 17 HB1 ALA 17 10.650 -8.241 0.015
108 HB3 ALA 17 HB2 ALA 17 10.411 -6.534 0.441
109 H ARG 18 H ARG 18 6.915 -7.988 -0.715
110 HA ARG 18 HA ARG 18 6.499 -9.829 -2.817
111 HB3 ARG 18 HB2 ARG 18 6.390 -11.461 -0.346
112 HG3 ARG 18 HG2 ARG 18 6.236 -12.405 -2.680
113 HD3 ARG 18 HD2 ARG 18 9.206 -11.687 -2.656
114 HE ARG 18 HE ARG 18 8.060 -13.886 -3.964
115 HH11 ARG 18 2HH2 ARG 18 9.844 -10.958 -4.767
116 HH12 ARG 18 1HH2 ARG 18 10.649 -11.606 -6.162
117 HH21 ARG 18 1HH1 ARG 18 9.111 -14.818 -5.831
118 HH22 ARG 18 2HH1 ARG 18 10.216 -13.874 -6.776
119 H ASP 19 H ASP 19 4.457 -11.032 -2.551
120 HA ASP 19 HA ASP 19 2.387 -9.321 -1.766
121 HB3 ASP 19 HB2 ASP 19 1.663 -12.204 -1.813
122 H ALA 20 H ALA 20 3.703 -12.168 -0.092
123 HA ALA 20 HA ALA 20 2.026 -12.070 2.213
124 HB1 ALA 20 HB3 ALA 20 3.758 -13.470 3.261
125 HB2 ALA 20 HB1 ALA 20 3.391 -14.029 1.618
126 HB3 ALA 20 HB2 ALA 20 4.882 -13.111 1.933
127 H TYR 21 H TYR 21 5.238 -10.608 1.593
128 HA TYR 21 HA TYR 21 5.701 -9.317 4.086
129 HB3 TYR 21 HB2 TYR 21 6.501 -8.822 1.237
130 HD1 TYR 21 HD2 TYR 21 8.371 -7.762 4.226
131 HD2 TYR 21 HD1 TYR 21 5.964 -6.467 0.887
132 HE1 TYR 21 HE2 TYR 21 9.320 -5.491 4.412
133 HE2 TYR 21 HE1 TYR 21 6.771 -4.161 1.207
134 HH TYR 21 HH TYR 21 8.916 -3.261 1.738
135 H CYS 22 H CYS 22 4.041 -8.022 1.148
136 HA CYS 22 HA CYS 22 3.178 -5.626 2.469
137 HB3 CYS 22 HB2 CYS 22 1.408 -5.582 0.656
138 H ASN 23 H ASN 23 1.630 -8.856 2.175
139 HA ASN 23 HA ASN 23 -0.746 -8.215 3.538
140 HB3 ASN 23 HB2 ASN 23 0.454 -10.576 2.567
141 HD21 ASN 23 1HD2 ASN 23 -1.075 -10.204 5.898
142 HD22 ASN 23 2HD2 ASN 23 -0.415 -11.737 6.437
143 H GLU 24 H GLU 24 2.445 -9.095 4.927
144 HA GLU 24 HA GLU 24 1.598 -9.123 7.622
145 HB3 GLU 24 HB2 GLU 24 4.270 -8.762 6.232
146 HG3 GLU 24 HG2 GLU 24 4.497 -7.572 8.347
147 H LEU 25 H LEU 25 3.102 -6.522 5.658
148 HA LEU 25 HA LEU 25 3.031 -4.413 7.550
149 HB3 LEU 25 HB2 LEU 25 2.442 -4.408 4.549
150 HG LEU 25 HG LEU 25 1.632 -2.285 5.599
151 HD11 LEU 25 1HD1 LEU 25 3.287 -0.687 6.416
152 HD12 LEU 25 2HD1 LEU 25 3.332 -2.130 7.432
153 HD13 LEU 25 3HD1 LEU 25 4.594 -1.874 6.209
154 HD21 LEU 25 3HD2 LEU 25 2.696 -0.885 3.953
155 HD22 LEU 25 1HD2 LEU 25 4.012 -2.069 3.734
156 HD23 LEU 25 2HD2 LEU 25 2.348 -2.470 3.257
157 H CYS 26 H CYS 26 0.444 -5.545 5.367
158 HA CYS 26 HA CYS 26 -1.409 -3.515 6.060
159 HB3 CYS 26 HB2 CYS 26 -3.060 -5.063 4.950
160 H THR 27 H THR 27 -1.090 -6.919 7.334
161 HA THR 27 HA THR 27 -3.280 -6.611 9.197
162 HB THR 27 HB THR 27 -2.120 -8.581 10.309
163 HG1 THR 27 HG1 THR 27 -0.324 -9.391 9.264
164 HG21 THR 27 3HG2 THR 27 -2.700 -8.770 7.307
165 HG22 THR 27 1HG2 THR 27 -2.645 -10.137 8.437
166 HG23 THR 27 2HG2 THR 27 -3.900 -8.896 8.606
167 H LYS 28 H LYS 28 0.209 -5.850 9.322
168 HA LYS 28 HA LYS 28 0.367 -5.251 12.045
169 HB3 LYS 28 HB2 LYS 28 2.301 -3.690 10.778
170 HG3 LYS 28 HG2 LYS 28 3.529 -5.992 10.444
171 HD3 LYS 28 HD2 LYS 28 4.169 -4.601 12.322
172 HE3 LYS 28 HE2 LYS 28 3.197 -5.306 14.607
173 HZ1 LYS 28 HZ3 LYS 28 1.387 -3.575 13.031
174 HZ2 LYS 28 HZ1 LYS 28 1.560 -3.635 14.644
175 HZ3 LYS 28 HZ2 LYS 28 2.803 -3.103 13.714
176 H ASN 29 H ASN 29 -0.931 -3.381 9.348
177 HA ASN 29 HA ASN 29 -1.032 -0.891 10.982
178 HB3 ASN 29 HB2 ASN 29 -2.355 -0.117 8.907
179 HD21 ASN 29 1HD2 ASN 29 0.736 -1.863 8.216
180 HD22 ASN 29 2HD2 ASN 29 1.675 -0.377 8.095
181 H GLY 30 H GLY 30 -3.261 -3.170 9.381
182 HA2 GLY 30 HA2 GLY 30 -5.018 -3.987 11.090
183 HA3 GLY 30 HA3 GLY 30 -5.518 -2.287 11.136
184 H ALA 31 H ALA 31 -4.486 -4.485 8.482
185 HA ALA 31 HA ALA 31 -7.121 -4.168 7.127
186 HB1 ALA 31 HB3 ALA 31 -5.798 -2.861 5.733
187 HB2 ALA 31 HB1 ALA 31 -4.310 -3.707 6.148
188 HB3 ALA 31 HB2 ALA 31 -5.464 -4.453 5.033
189 H LYS 32 H LYS 32 -7.717 -6.081 5.837
190 HA LYS 32 HA LYS 32 -7.267 -8.379 7.450
191 HB3 LYS 32 HB2 LYS 32 -9.288 -7.868 5.981
192 HG3 LYS 32 HG2 LYS 32 -7.835 -9.640 3.987
193 HD3 LYS 32 HD2 LYS 32 -9.454 -9.053 2.369
194 HE3 LYS 32 HE2 LYS 32 -10.895 -9.406 5.043
195 HZ1 LYS 32 HZ3 LYS 32 -12.783 -9.990 3.739
196 HZ2 LYS 32 HZ1 LYS 32 -12.321 -8.440 3.494
197 HZ3 LYS 32 HZ2 LYS 32 -12.014 -9.563 2.334
198 H SER 33 H SER 33 -5.702 -7.312 4.469
199 HA SER 33 HA SER 33 -3.410 -8.909 4.758
200 HB3 SER 33 HB2 SER 33 -4.940 -10.787 4.048
201 HG SER 33 HG SER 33 -6.280 -9.370 2.727
202 H GLY 34 H GLY 34 -2.584 -8.897 2.037
203 HA2 GLY 34 HA2 GLY 34 -3.334 -6.411 0.773
204 HA3 GLY 34 HA3 GLY 34 -1.673 -6.435 1.456
205 H SER 35 H SER 35 -1.220 -6.158 -0.911
206 HA SER 35 HA SER 35 -0.143 -8.608 -1.802
207 HB3 SER 35 HB2 SER 35 -1.016 -8.293 -4.236
208 HG SER 35 HG SER 35 -1.668 -9.974 -2.897
209 H CYS 36 H CYS 36 1.206 -8.109 -3.838
210 HA CYS 36 HA CYS 36 2.692 -5.547 -3.307
211 HB3 CYS 36 HB2 CYS 36 3.494 -8.397 -3.876
212 HA PRO 37 HA PRO 37 1.441 -5.440 -7.822
213 HB3 PRO 37 HB2 PRO 37 -0.087 -3.796 -7.702
214 HG3 PRO 37 HG2 PRO 37 -0.470 -2.762 -5.638
215 HD3 PRO 37 HD2 PRO 37 -0.060 -4.987 -4.959
216 H TYR 38 H TYR 38 2.678 -4.763 -9.601
217 HA TYR 38 HA TYR 38 5.394 -3.653 -9.012
218 HB3 TYR 38 HB2 TYR 38 6.246 -5.548 -10.527
219 HD1 TYR 38 HD2 TYR 38 7.678 -4.723 -8.528
220 HD2 TYR 38 HD1 TYR 38 4.733 -7.864 -8.325
221 HE1 TYR 38 HE2 TYR 38 8.904 -5.755 -6.638
222 HE2 TYR 38 HE1 TYR 38 5.966 -8.891 -6.441
223 HH TYR 38 HH TYR 38 8.416 -7.208 -4.702
224 H LEU 39 H LEU 39 3.030 -4.606 -11.616
225 HA LEU 39 HA LEU 39 5.176 -3.829 -13.508
226 HB3 LEU 39 HB2 LEU 39 3.920 -5.016 -15.179
227 HG LEU 39 HG LEU 39 3.898 -6.603 -12.567
228 HD11 LEU 39 1HD1 LEU 39 3.897 -7.528 -15.467
229 HD12 LEU 39 2HD1 LEU 39 3.984 -8.572 -14.031
230 HD13 LEU 39 3HD1 LEU 39 2.525 -7.615 -14.339
231 HD21 LEU 39 3HD2 LEU 39 6.081 -7.502 -13.388
232 HD22 LEU 39 1HD2 LEU 39 6.058 -6.318 -14.711
233 HD23 LEU 39 2HD2 LEU 39 6.176 -5.780 -13.021
234 H GLY 40 H GLY 40 1.663 -3.342 -13.775
235 HA2 GLY 40 HA2 GLY 40 2.076 -0.635 -14.997
236 HA3 GLY 40 HA3 GLY 40 0.622 -1.639 -15.077
237 H GLU 41 H GLU 41 0.588 -2.462 -12.453
238 HA GLU 41 HA GLU 41 -1.280 -0.992 -11.229
239 HB3 GLU 41 HB2 GLU 41 -0.908 -2.372 -9.289
240 HG3 GLU 41 HG2 GLU 41 -1.295 -3.307 -11.723
241 H HIS 42 H HIS 42 -0.093 1.083 -11.594
242 HA HIS 42 HA HIS 42 0.920 3.082 -10.847
243 HB3 HIS 42 HB2 HIS 42 0.535 1.989 -8.020
244 HD1 HIS 42 HD1 HIS 42 3.049 3.425 -7.854
245 HD2 HIS 42 HD2 HIS 42 -0.669 5.364 -7.941
246 HE1 HIS 42 HE1 HIS 42 3.407 5.704 -6.755
247 H LYS 43 H LYS 43 2.255 0.865 -11.824
248 HA LYS 43 HA LYS 43 3.936 -0.595 -11.743
249 HB3 LYS 43 HB2 LYS 43 6.171 0.532 -11.049
250 HG3 LYS 43 HG2 LYS 43 5.758 0.046 -13.303
251 HD3 LYS 43 HD2 LYS 43 4.158 2.656 -13.490
252 HE3 LYS 43 HE2 LYS 43 3.680 1.930 -15.802
253 HZ1 LYS 43 HZ3 LYS 43 5.727 3.192 -15.523
254 HZ2 LYS 43 HZ1 LYS 43 6.589 1.793 -15.370
255 HZ3 LYS 43 HZ2 LYS 43 5.829 2.138 -16.784
256 H PHE 44 H PHE 44 5.402 0.986 -8.972
257 HA PHE 44 HA PHE 44 5.343 -1.682 -7.648
258 HB3 PHE 44 HB2 PHE 44 7.310 0.625 -7.623
259 HD1 PHE 44 HD1 PHE 44 7.012 -3.035 -6.686
260 HD2 PHE 44 HD2 PHE 44 8.772 0.811 -5.806
261 HE1 PHE 44 HE1 PHE 44 8.527 -4.086 -5.057
262 HE2 PHE 44 HE2 PHE 44 10.275 -0.258 -4.163
263 HZ PHE 44 HZ PHE 44 10.206 -2.736 -3.837
264 H ALA 45 H ALA 45 4.129 -1.815 -5.778
265 HA ALA 45 HA ALA 45 4.532 0.075 -3.672
266 HB1 ALA 45 HB3 ALA 45 2.165 0.888 -3.468
267 HB2 ALA 45 HB1 ALA 45 2.896 1.465 -4.968
268 HB3 ALA 45 HB2 ALA 45 1.784 0.091 -5.007
269 H CYS 46 H CYS 46 2.787 -0.479 -1.849
270 HA CYS 46 HA CYS 46 2.061 -3.378 -1.937
271 HB3 CYS 46 HB2 CYS 46 1.525 -2.991 0.513
272 H TYR 47 H TYR 47 -0.110 -3.826 -1.640
273 HA TYR 47 HA TYR 47 -2.045 -1.556 -1.560
274 HB3 TYR 47 HB2 TYR 47 -2.452 -4.222 -2.974
275 HD1 TYR 47 HD2 TYR 47 -2.976 -0.867 -4.350
276 HD2 TYR 47 HD1 TYR 47 -4.931 -4.225 -2.489
277 HE1 TYR 47 HE2 TYR 47 -5.147 -0.105 -5.263
278 HE2 TYR 47 HE1 TYR 47 -7.061 -3.534 -3.515
279 HH TYR 47 HH TYR 47 -8.136 -1.281 -4.157
280 H CYS 48 H CYS 48 -3.675 -1.890 -0.001
281 HA CYS 48 HA CYS 48 -3.526 -4.388 1.628
282 HB3 CYS 48 HB2 CYS 48 -4.377 -3.019 3.499
283 H LYS 49 H LYS 49 -5.479 -5.106 2.515
284 HA LYS 49 HA LYS 49 -7.882 -4.335 0.950
285 HB3 LYS 49 HB2 LYS 49 -8.467 -6.752 0.979
286 HG3 LYS 49 HG2 LYS 49 -5.947 -5.801 -0.400
287 HD3 LYS 49 HD2 LYS 49 -6.971 -8.639 -0.284
288 HE3 LYS 49 HE2 LYS 49 -4.640 -7.321 -1.793
289 HZ1 LYS 49 HZ3 LYS 49 -3.864 -9.386 -0.828
290 HZ2 LYS 49 HZ1 LYS 49 -5.086 -10.229 -1.560
291 HZ3 LYS 49 HZ2 LYS 49 -3.905 -9.446 -2.422
292 H ASP 50 H ASP 50 -9.830 -4.549 2.041
293 HA ASP 50 HA ASP 50 -11.022 -3.581 3.774
294 HB3 ASP 50 HB2 ASP 50 -10.723 -5.129 5.972
295 H LEU 51 H LEU 51 -8.937 -2.104 3.338
296 HA LEU 51 HA LEU 51 -7.535 -1.443 5.834
297 HB3 LEU 51 HB2 LEU 51 -7.608 -0.030 3.153
298 HG LEU 51 HG LEU 51 -6.753 1.301 5.159
299 HD11 LEU 51 1HD1 LEU 51 -5.600 -0.490 6.416
300 HD12 LEU 51 2HD1 LEU 51 -4.519 -0.782 5.037
301 HD13 LEU 51 3HD1 LEU 51 -4.441 0.744 5.931
302 HD21 LEU 51 3HD2 LEU 51 -6.143 1.840 2.844
303 HD22 LEU 51 1HD2 LEU 51 -4.766 2.112 3.922
304 HD23 LEU 51 2HD2 LEU 51 -4.813 0.667 2.894
305 HA PRO 52 HA PRO 52 -11.208 0.995 7.015
306 HB3 PRO 52 HB2 PRO 52 -10.769 1.813 9.202
307 HG3 PRO 52 HG2 PRO 52 -10.269 -0.547 9.187
308 HD3 PRO 52 HD2 PRO 52 -8.677 -1.433 7.747
309 H ASP 53 H ASP 53 -11.962 2.911 6.149
310 HA ASP 53 HA ASP 53 -10.456 4.300 4.301
311 HB3 ASP 53 HB2 ASP 53 -12.962 5.248 5.731
312 H ASN 54 H ASN 54 -10.733 4.875 7.717
313 HA ASN 54 HA ASN 54 -9.764 7.455 8.128
314 HB3 ASN 54 HB2 ASN 54 -9.031 4.855 9.544
315 HD21 ASN 54 1HD2 ASN 54 -6.937 5.284 10.354
316 HD22 ASN 54 2HD2 ASN 54 -6.639 6.701 11.347
317 H VAL 55 H VAL 55 -7.893 4.554 7.123
318 HA VAL 55 HA VAL 55 -5.359 6.024 7.143
319 HB VAL 55 HB VAL 55 -6.037 3.310 5.953
320 HG11 VAL 55 1HG1 VAL 55 -3.601 2.904 6.125
321 HG12 VAL 55 2HG1 VAL 55 -3.929 4.288 5.077
322 HG13 VAL 55 3HG1 VAL 55 -3.359 4.539 6.747
323 HG21 VAL 55 3HG2 VAL 55 -6.503 3.233 8.360
324 HG22 VAL 55 1HG2 VAL 55 -4.996 2.377 8.026
325 HG23 VAL 55 2HG2 VAL 55 -4.945 4.014 8.711
326 HA PRO 56 HA PRO 56 -6.522 7.809 3.189
327 HB3 PRO 56 HB2 PRO 56 -4.993 9.446 3.665
328 HG3 PRO 56 HG2 PRO 56 -2.854 8.956 4.638
329 HD3 PRO 56 HD2 PRO 56 -4.598 8.114 6.047
330 H ILE 57 H ILE 57 -5.124 7.882 0.838
331 HA ILE 57 HA ILE 57 -4.401 5.117 0.087
332 HB ILE 57 HB ILE 57 -5.460 5.378 -2.088
333 HG13 ILE 57 2HG1 ILE 57 -6.220 8.152 -1.129
334 HG21 ILE 57 1HG2 ILE 57 -6.683 4.396 -0.155
335 HG22 ILE 57 2HG2 ILE 57 -7.516 5.956 0.058
336 HG23 ILE 57 3HG2 ILE 57 -7.739 5.025 -1.435
337 HD11 ILE 57 3HD1 ILE 57 -5.655 6.947 -3.887
338 HD12 ILE 57 1HD1 ILE 57 -6.028 8.648 -3.557
339 HD13 ILE 57 2HD1 ILE 57 -4.527 7.945 -2.950
340 H ARG 58 H ARG 58 -2.706 5.073 -1.436
341 HA ARG 58 HA ARG 58 -0.943 7.340 -1.370
342 HB3 ARG 58 HB2 ARG 58 -0.654 4.916 -3.203
343 HG3 ARG 58 HG2 ARG 58 1.743 5.244 -2.189
344 HD3 ARG 58 HD2 ARG 58 0.564 6.992 -4.383
345 HE ARG 58 HE ARG 58 3.027 7.344 -3.007
346 HH11 ARG 58 2HH2 ARG 58 1.897 7.522 -6.407
347 HH12 ARG 58 1HH2 ARG 58 2.751 9.067 -6.610
348 HH21 ARG 58 1HH1 ARG 58 3.833 9.253 -3.300
349 HH22 ARG 58 2HH1 ARG 58 3.794 10.065 -4.867
350 H VAL 59 H VAL 59 -1.364 9.197 -2.589
351 HA VAL 59 HA VAL 59 -3.256 9.116 -4.759
352 HB VAL 59 HB VAL 59 -1.587 11.140 -3.236
353 HG11 VAL 59 1HG1 VAL 59 -2.481 12.959 -4.567
354 HG12 VAL 59 2HG1 VAL 59 -1.342 11.941 -5.455
355 HG13 VAL 59 3HG1 VAL 59 -3.097 11.796 -5.765
356 HG21 VAL 59 3HG2 VAL 59 -3.744 10.352 -2.307
357 HG22 VAL 59 1HG2 VAL 59 -3.777 12.078 -2.702
358 HG23 VAL 59 2HG2 VAL 59 -4.574 10.910 -3.777
359 HA PRO 60 HA PRO 60 0.013 8.339 -7.770
360 HB3 PRO 60 HB2 PRO 60 -1.676 7.505 -9.104
361 HG3 PRO 60 HG2 PRO 60 -3.797 8.621 -9.307
362 HD3 PRO 60 HD2 PRO 60 -3.435 8.109 -7.007
363 H GLY 61 H GLY 61 0.962 10.277 -6.519
364 HA2 GLY 61 HA2 GLY 61 1.896 12.250 -8.491
365 HA3 GLY 61 HA3 GLY 61 0.968 12.890 -7.117
366 H LYS 62 H LYS 62 2.781 13.978 -6.293
367 HA LYS 62 HA LYS 62 5.386 12.928 -5.918
368 HB3 LYS 62 HB2 LYS 62 5.660 14.899 -4.398
369 HG3 LYS 62 HG2 LYS 62 4.150 15.611 -6.937
370 HD3 LYS 62 HD2 LYS 62 6.227 17.037 -5.201
371 HE3 LYS 62 HE2 LYS 62 6.614 17.515 -7.605
372 HZ1 LYS 62 HZ3 LYS 62 4.972 18.843 -8.741
373 HZ2 LYS 62 HZ1 LYS 62 4.357 17.355 -8.427
374 HZ3 LYS 62 HZ2 LYS 62 3.889 18.650 -7.522
375 H CYS 63 H CYS 63 6.410 13.053 -3.578
376 HA CYS 63 HA CYS 63 4.847 11.856 -1.445
377 HB3 CYS 63 HB2 CYS 63 6.472 10.253 -3.298
378 H HIS 64 H HIS 64 5.876 12.449 0.491
379 HA HIS 64 HA HIS 64 8.373 14.077 0.295
380 HB3 HIS 64 HB2 HIS 64 7.350 15.804 1.476
381 HD1 HIS 64 HD1 HIS 64 3.786 15.093 1.205
382 HD2 HIS 64 HD2 HIS 64 6.907 15.689 -1.528
383 HE1 HIS 64 HE1 HIS 64 2.692 15.575 -1.047
Start of MODEL 12
1 H1 VAL 1 H VAL 1 -14.605 0.642 3.997
2 HA VAL 1 HA VAL 1 -11.853 0.525 4.689
3 HB VAL 1 HB VAL 1 -11.646 -1.917 4.750
4 HG11 VAL 1 1HG1 VAL 1 -12.539 -2.382 6.968
5 HG12 VAL 1 2HG1 VAL 1 -11.883 -0.743 6.915
6 HG13 VAL 1 3HG1 VAL 1 -13.640 -0.996 6.860
7 HG21 VAL 1 3HG2 VAL 1 -13.604 -2.622 3.454
8 HG22 VAL 1 1HG2 VAL 1 -13.643 -3.375 5.051
9 HG23 VAL 1 2HG2 VAL 1 -14.697 -1.994 4.707
10 H ARG 2 H ARG 2 -10.595 -0.208 2.751
11 HA ARG 2 HA ARG 2 -12.167 -1.077 0.423
12 HB3 ARG 2 HB2 ARG 2 -12.313 1.338 0.168
13 HG3 ARG 2 HG2 ARG 2 -9.974 2.448 -0.275
14 HD3 ARG 2 HD2 ARG 2 -10.837 2.228 2.642
15 HE ARG 2 HE ARG 2 -10.099 4.762 1.400
16 HH11 ARG 2 2HH2 ARG 2 -8.826 2.017 3.258
17 HH12 ARG 2 1HH2 ARG 2 -7.766 3.035 4.183
18 HH21 ARG 2 1HH1 ARG 2 -8.466 6.008 2.528
19 HH22 ARG 2 2HH1 ARG 2 -7.338 5.165 3.549
20 H ASP 3 H ASP 3 -10.758 -1.890 -1.290
21 HA ASP 3 HA ASP 3 -8.109 -2.737 -0.271
22 HB3 ASP 3 HB2 ASP 3 -7.933 -4.126 -2.229
23 H ALA 4 H ALA 4 -6.381 -1.422 -0.731
24 HA ALA 4 HA ALA 4 -6.416 0.367 -3.058
25 HB1 ALA 4 HB3 ALA 4 -6.324 2.397 -1.680
26 HB2 ALA 4 HB1 ALA 4 -7.866 1.553 -1.453
27 HB3 ALA 4 HB2 ALA 4 -6.599 1.432 -0.211
28 H TYR 5 H TYR 5 -4.418 1.811 -2.962
29 HA TYR 5 HA TYR 5 -2.073 0.111 -2.333
30 HB3 TYR 5 HB2 TYR 5 -0.892 1.972 -3.504
31 HD1 TYR 5 HD2 TYR 5 -0.418 -0.298 -4.523
32 HD2 TYR 5 HD1 TYR 5 -3.763 2.151 -5.691
33 HE1 TYR 5 HE2 TYR 5 -0.192 -1.068 -6.865
34 HE2 TYR 5 HE1 TYR 5 -3.599 1.266 -7.994
35 HH TYR 5 HH TYR 5 -2.172 0.273 -9.463
36 H ILE 6 H ILE 6 -1.385 0.321 -0.143
37 HA ILE 6 HA ILE 6 -2.370 2.499 1.412
38 HB ILE 6 HB ILE 6 -1.756 0.308 2.277
39 HG13 ILE 6 2HG1 ILE 6 -1.921 2.331 3.731
40 HG21 ILE 6 1HG2 ILE 6 1.160 1.197 2.087
41 HG22 ILE 6 2HG2 ILE 6 0.561 -0.396 2.602
42 HG23 ILE 6 3HG2 ILE 6 0.410 0.115 0.924
43 HD11 ILE 6 3HD1 ILE 6 0.122 0.281 4.670
44 HD12 ILE 6 1HD1 ILE 6 -0.853 1.350 5.689
45 HD13 ILE 6 2HD1 ILE 6 -1.637 0.084 4.714
46 H ALA 7 H ALA 7 -1.380 4.348 2.231
47 HA ALA 7 HA ALA 7 1.334 5.046 1.182
48 HB1 ALA 7 HB3 ALA 7 0.569 7.415 1.375
49 HB2 ALA 7 HB1 ALA 7 -0.232 6.496 0.082
50 HB3 ALA 7 HB2 ALA 7 -1.090 6.835 1.603
51 H GLN 8 H GLN 8 2.592 6.300 2.580
52 HA GLN 8 HA GLN 8 1.698 6.746 5.370
53 HB3 GLN 8 HB2 GLN 8 3.155 4.847 5.609
54 HG3 GLN 8 HG2 GLN 8 4.926 6.279 3.604
55 HE21 GLN 8 1HE2 GLN 8 6.660 4.318 2.958
56 HE22 GLN 8 2HE2 GLN 8 7.759 4.071 4.308
57 H ASN 9 H ASN 9 3.436 8.311 6.318
58 HA ASN 9 HA ASN 9 3.309 10.839 5.294
59 HB3 ASN 9 HB2 ASN 9 5.357 11.320 6.606
60 HD21 ASN 9 1HD2 ASN 9 4.310 8.781 8.701
61 HD22 ASN 9 2HD2 ASN 9 3.055 9.707 9.505
62 H TYR 10 H TYR 10 5.668 11.071 2.533
63 HA TYR 10 HA TYR 10 2.808 11.308 3.371
64 HB3 TYR 10 HB2 TYR 10 3.709 13.674 2.001
65 HD1 TYR 10 HD1 TYR 10 3.918 13.552 5.674
66 HD2 TYR 10 HD2 TYR 10 1.259 13.933 2.300
67 HE1 TYR 10 HE1 TYR 10 2.078 14.225 7.191
68 HE2 TYR 10 HE2 TYR 10 -0.568 14.621 3.816
69 HH TYR 10 HH TYR 10 -1.204 14.996 6.003
70 H ASN 11 H ASN 11 2.156 9.809 2.059
71 HA ASN 11 HA ASN 11 1.057 9.168 0.205
72 HB3 ASN 11 HB2 ASN 11 2.699 10.701 -1.763
73 HD21 ASN 11 1HD2 ASN 11 1.616 10.983 -3.730
74 HD22 ASN 11 2HD2 ASN 11 0.100 10.163 -4.091
75 H CYS 12 H CYS 12 3.723 8.317 1.422
76 HA CYS 12 HA CYS 12 5.196 7.335 -0.985
77 HB3 CYS 12 HB2 CYS 12 7.022 6.994 0.619
78 H VAL 13 H VAL 13 5.634 5.140 -1.240
79 HA VAL 13 HA VAL 13 3.744 3.311 0.120
80 HB VAL 13 HB VAL 13 4.387 1.705 -1.589
81 HG11 VAL 13 1HG1 VAL 13 3.465 2.863 -3.528
82 HG12 VAL 13 2HG1 VAL 13 2.590 3.317 -2.054
83 HG13 VAL 13 3HG1 VAL 13 3.763 4.436 -2.780
84 HG21 VAL 13 3HG2 VAL 13 6.780 2.347 -1.918
85 HG22 VAL 13 1HG2 VAL 13 5.873 2.261 -3.435
86 HG23 VAL 13 2HG2 VAL 13 6.252 3.839 -2.727
87 H TYR 14 H TYR 14 5.351 0.932 0.013
88 HA TYR 14 HA TYR 14 7.494 1.482 2.008
89 HB3 TYR 14 HB2 TYR 14 6.777 -0.621 3.094
90 HD1 TYR 14 HD2 TYR 14 6.944 1.182 4.830
91 HD2 TYR 14 HD1 TYR 14 3.403 0.578 2.454
92 HE1 TYR 14 HE2 TYR 14 5.563 2.195 6.623
93 HE2 TYR 14 HE1 TYR 14 2.035 1.611 4.240
94 HH TYR 14 HH TYR 14 2.005 2.452 6.385
95 H HIS 15 H HIS 15 8.935 -0.465 2.183
96 HA HIS 15 HA HIS 15 9.905 -1.169 -0.438
97 HB3 HIS 15 HB2 HIS 15 11.472 -0.691 1.280
98 HD1 HIS 15 HD1 HIS 15 10.618 -0.278 3.828
99 HD2 HIS 15 HD2 HIS 15 11.387 -4.244 2.644
100 HE1 HIS 15 HE1 HIS 15 10.783 -1.661 5.959
101 H CYS 16 H CYS 16 7.982 -2.216 -1.266
102 HA CYS 16 HA CYS 16 7.046 -4.758 -0.442
103 HB3 CYS 16 HB2 CYS 16 7.236 -3.455 -3.149
104 H ALA 17 H ALA 17 8.866 -5.806 0.478
105 HA ALA 17 HA ALA 17 10.936 -6.966 -1.148
106 HB1 ALA 17 HB3 ALA 17 11.061 -6.846 1.310
107 HB2 ALA 17 HB1 ALA 17 9.696 -7.975 1.446
108 HB3 ALA 17 HB2 ALA 17 11.230 -8.518 0.736
109 H ARG 18 H ARG 18 7.588 -7.973 -0.330
110 HA ARG 18 HA ARG 18 7.378 -9.676 -2.597
111 HB3 ARG 18 HB2 ARG 18 7.042 -11.249 -0.049
112 HG3 ARG 18 HG2 ARG 18 6.641 -12.088 -2.492
113 HD3 ARG 18 HD2 ARG 18 8.988 -11.252 -3.253
114 HE ARG 18 HE ARG 18 9.732 -13.863 -1.943
115 HH11 ARG 18 2HH2 ARG 18 10.763 -10.509 -2.554
116 HH12 ARG 18 1HH2 ARG 18 12.450 -10.887 -2.516
117 HH21 ARG 18 1HH1 ARG 18 11.951 -14.299 -1.654
118 HH22 ARG 18 2HH1 ARG 18 13.122 -13.032 -1.813
119 H ASP 19 H ASP 19 5.160 -10.696 -2.606
120 HA ASP 19 HA ASP 19 3.075 -9.041 -1.898
121 HB3 ASP 19 HB2 ASP 19 2.680 -12.060 -1.897
122 H ALA 20 H ALA 20 4.311 -11.852 -0.122
123 HA ALA 20 HA ALA 20 2.712 -11.812 2.167
124 HB1 ALA 20 HB3 ALA 20 4.262 -13.627 1.593
125 HB2 ALA 20 HB1 ALA 20 5.653 -12.573 1.939
126 HB3 ALA 20 HB2 ALA 20 4.542 -13.042 3.244
127 H TYR 21 H TYR 21 5.751 -9.915 1.600
128 HA TYR 21 HA TYR 21 5.959 -8.863 4.260
129 HB3 TYR 21 HB2 TYR 21 6.876 -7.852 1.553
130 HD1 TYR 21 HD1 TYR 21 8.535 -7.236 4.799
131 HD2 TYR 21 HD2 TYR 21 6.162 -5.522 1.631
132 HE1 TYR 21 HE1 TYR 21 8.886 -4.968 5.744
133 HE2 TYR 21 HE2 TYR 21 6.425 -3.289 2.633
134 HH TYR 21 HH TYR 21 7.151 -2.123 4.487
135 H CYS 22 H CYS 22 4.358 -7.634 1.294
136 HA CYS 22 HA CYS 22 3.243 -5.329 2.611
137 HB3 CYS 22 HB2 CYS 22 1.568 -5.426 0.669
138 H ASN 23 H ASN 23 1.960 -8.638 2.080
139 HA ASN 23 HA ASN 23 -0.519 -8.286 3.334
140 HB3 ASN 23 HB2 ASN 23 0.992 -10.483 2.396
141 HD21 ASN 23 1HD2 ASN 23 -0.967 -10.396 5.509
142 HD22 ASN 23 2HD2 ASN 23 -0.178 -11.837 6.121
143 H GLU 24 H GLU 24 2.560 -9.117 4.971
144 HA GLU 24 HA GLU 24 1.598 -9.165 7.593
145 HB3 GLU 24 HB2 GLU 24 4.300 -8.383 6.395
146 HG3 GLU 24 HG2 GLU 24 3.575 -8.924 9.279
147 H LEU 25 H LEU 25 3.044 -6.418 5.782
148 HA LEU 25 HA LEU 25 2.827 -4.486 7.792
149 HB3 LEU 25 HB2 LEU 25 2.519 -3.978 4.786
150 HG LEU 25 HG LEU 25 3.174 -2.308 7.194
151 HD11 LEU 25 1HD1 LEU 25 5.372 -2.496 6.114
152 HD12 LEU 25 2HD1 LEU 25 4.663 -1.985 4.562
153 HD13 LEU 25 3HD1 LEU 25 4.696 -0.873 5.953
154 HD21 LEU 25 3HD2 LEU 25 1.125 -1.943 5.734
155 HD22 LEU 25 1HD2 LEU 25 2.193 -0.546 5.860
156 HD23 LEU 25 2HD2 LEU 25 2.217 -1.553 4.395
157 H CYS 26 H CYS 26 0.493 -5.397 5.306
158 HA CYS 26 HA CYS 26 -1.407 -3.356 5.810
159 HB3 CYS 26 HB2 CYS 26 -2.881 -4.801 4.412
160 H THR 27 H THR 27 -1.278 -6.838 6.962
161 HA THR 27 HA THR 27 -3.601 -6.566 8.617
162 HB THR 27 HB THR 27 -2.250 -8.362 10.022
163 HG1 THR 27 HG1 THR 27 -0.281 -7.857 8.671
164 HG21 THR 27 3HG2 THR 27 -4.244 -8.840 8.657
165 HG22 THR 27 1HG2 THR 27 -3.245 -8.836 7.191
166 HG23 THR 27 2HG2 THR 27 -3.008 -10.092 8.422
167 H LYS 28 H LYS 28 -0.168 -5.690 9.190
168 HA LYS 28 HA LYS 28 -0.511 -4.910 11.901
169 HB3 LYS 28 HB2 LYS 28 1.438 -3.238 10.529
170 HG3 LYS 28 HG2 LYS 28 1.638 -5.711 12.320
171 HD3 LYS 28 HD2 LYS 28 3.905 -4.869 12.883
172 HE3 LYS 28 HE2 LYS 28 3.712 -5.480 9.895
173 HZ1 LYS 28 HZ3 LYS 28 5.710 -6.699 10.323
174 HZ2 LYS 28 HZ1 LYS 28 5.945 -5.123 10.692
175 HZ3 LYS 28 HZ2 LYS 28 5.746 -6.254 11.881
176 H ASN 29 H ASN 29 -1.238 -3.266 8.864
177 HA ASN 29 HA ASN 29 -2.183 -0.824 10.277
178 HB3 ASN 29 HB2 ASN 29 -2.675 -0.070 7.911
179 HD21 ASN 29 1HD2 ASN 29 0.461 -1.834 8.264
180 HD22 ASN 29 2HD2 ASN 29 1.406 -0.359 8.431
181 H GLY 30 H GLY 30 -3.510 -3.650 10.463
182 HA2 GLY 30 HA2 GLY 30 -5.610 -4.249 11.010
183 HA3 GLY 30 HA3 GLY 30 -6.078 -2.547 10.913
184 H ALA 31 H ALA 31 -4.767 -4.272 8.116
185 HA ALA 31 HA ALA 31 -7.379 -4.080 6.733
186 HB1 ALA 31 HB3 ALA 31 -4.920 -4.935 5.300
187 HB2 ALA 31 HB1 ALA 31 -6.125 -3.705 4.850
188 HB3 ALA 31 HB2 ALA 31 -4.862 -3.297 5.985
189 H LYS 32 H LYS 32 -8.044 -6.004 5.323
190 HA LYS 32 HA LYS 32 -8.098 -8.411 6.843
191 HB3 LYS 32 HB2 LYS 32 -9.696 -7.801 4.950
192 HG3 LYS 32 HG2 LYS 32 -7.739 -9.464 3.281
193 HD3 LYS 32 HD2 LYS 32 -10.082 -9.685 2.524
194 HE3 LYS 32 HE2 LYS 32 -9.907 -6.765 2.835
195 HZ1 LYS 32 HZ3 LYS 32 -11.598 -6.245 1.386
196 HZ2 LYS 32 HZ1 LYS 32 -10.258 -6.473 0.565
197 HZ3 LYS 32 HZ2 LYS 32 -11.448 -7.645 0.512
198 H SER 33 H SER 33 -5.910 -7.350 4.269
199 HA SER 33 HA SER 33 -3.685 -8.897 4.999
200 HB3 SER 33 HB2 SER 33 -5.033 -10.843 4.185
201 HG SER 33 HG SER 33 -5.799 -10.901 2.180
202 H GLY 34 H GLY 34 -2.466 -9.019 2.423
203 HA2 GLY 34 HA2 GLY 34 -2.933 -6.510 1.061
204 HA3 GLY 34 HA3 GLY 34 -1.377 -6.619 1.935
205 H SER 35 H SER 35 -1.280 -6.337 -0.745
206 HA SER 35 HA SER 35 0.207 -8.694 -1.440
207 HB3 SER 35 HB2 SER 35 -0.952 -8.733 -3.787
208 HG SER 35 HG SER 35 -1.210 -10.348 -2.236
209 H CYS 36 H CYS 36 1.375 -8.191 -3.583
210 HA CYS 36 HA CYS 36 1.982 -5.244 -3.752
211 HB3 CYS 36 HB2 CYS 36 3.930 -7.540 -3.897
212 HA PRO 37 HA PRO 37 0.911 -6.654 -8.041
213 HB3 PRO 37 HB2 PRO 37 -1.217 -5.812 -8.073
214 HG3 PRO 37 HG2 PRO 37 -1.939 -4.276 -6.419
215 HD3 PRO 37 HD2 PRO 37 -0.877 -6.023 -5.181
216 H TYR 38 H TYR 38 2.294 -6.095 -9.623
217 HA TYR 38 HA TYR 38 4.412 -4.134 -9.073
218 HB3 TYR 38 HB2 TYR 38 5.444 -5.123 -11.072
219 HD1 TYR 38 HD2 TYR 38 4.572 -5.966 -7.780
220 HD2 TYR 38 HD1 TYR 38 6.087 -7.762 -11.389
221 HE1 TYR 38 HE2 TYR 38 5.602 -7.764 -6.447
222 HE2 TYR 38 HE1 TYR 38 7.155 -9.552 -10.048
223 HH TYR 38 HH TYR 38 7.515 -10.393 -7.940
224 H LEU 39 H LEU 39 2.900 -4.847 -12.169
225 HA LEU 39 HA LEU 39 1.774 -3.713 -13.692
226 HB3 LEU 39 HB2 LEU 39 -0.042 -2.334 -12.886
227 HG LEU 39 HG LEU 39 0.574 -4.391 -10.707
228 HD11 LEU 39 1HD1 LEU 39 -1.272 -2.759 -10.232
229 HD12 LEU 39 2HD1 LEU 39 -2.033 -3.170 -11.779
230 HD13 LEU 39 3HD1 LEU 39 -1.919 -4.392 -10.502
231 HD21 LEU 39 3HD2 LEU 39 0.668 -5.542 -12.869
232 HD22 LEU 39 1HD2 LEU 39 -0.867 -5.912 -12.082
233 HD23 LEU 39 2HD2 LEU 39 -0.822 -4.729 -13.406
234 H GLY 40 H GLY 40 1.068 -1.486 -14.559
235 HA2 GLY 40 HA2 GLY 40 3.460 0.002 -15.190
236 HA3 GLY 40 HA3 GLY 40 1.795 0.417 -15.640
237 H GLU 41 H GLU 41 0.411 1.353 -13.958
238 HA GLU 41 HA GLU 41 0.792 3.700 -12.998
239 HB3 GLU 41 HB2 GLU 41 -0.530 3.162 -10.953
240 HG3 GLU 41 HG2 GLU 41 -1.633 1.555 -13.276
241 H HIS 42 H HIS 42 1.444 1.128 -10.683
242 HA HIS 42 HA HIS 42 2.753 3.030 -8.892
243 HB3 HIS 42 HB2 HIS 42 2.155 1.049 -7.333
244 HD1 HIS 42 HD1 HIS 42 -1.085 2.140 -9.281
245 HD2 HIS 42 HD2 HIS 42 1.280 2.919 -5.878
246 HE1 HIS 42 HE1 HIS 42 -2.276 3.926 -7.970
247 H LYS 43 H LYS 43 3.778 0.527 -11.016
248 HA LYS 43 HA LYS 43 5.590 -0.888 -11.001
249 HB3 LYS 43 HB2 LYS 43 7.609 0.435 -11.054
250 HG3 LYS 43 HG2 LYS 43 5.216 2.184 -11.623
251 HD3 LYS 43 HD2 LYS 43 7.929 2.328 -12.934
252 HE3 LYS 43 HE2 LYS 43 6.279 2.777 -14.614
253 HZ1 LYS 43 HZ3 LYS 43 4.758 4.333 -12.600
254 HZ2 LYS 43 HZ1 LYS 43 4.441 4.310 -14.215
255 HZ3 LYS 43 HZ2 LYS 43 4.319 2.941 -13.317
256 H PHE 44 H PHE 44 4.477 -1.901 -8.951
257 HA PHE 44 HA PHE 44 4.883 -3.274 -7.133
258 HB3 PHE 44 HB2 PHE 44 6.956 -3.228 -5.849
259 HD1 PHE 44 HD1 PHE 44 7.366 -2.967 -9.618
260 HD2 PHE 44 HD2 PHE 44 7.863 -5.329 -6.037
261 HE1 PHE 44 HE1 PHE 44 8.420 -4.757 -10.941
262 HE2 PHE 44 HE2 PHE 44 8.982 -7.079 -7.360
263 HZ PHE 44 HZ PHE 44 9.255 -6.813 -9.819
264 H ALA 45 H ALA 45 3.188 -2.346 -5.995
265 HA ALA 45 HA ALA 45 4.142 -0.734 -3.697
266 HB1 ALA 45 HB3 ALA 45 1.744 0.062 -5.379
267 HB2 ALA 45 HB1 ALA 45 2.201 0.789 -3.829
268 HB3 ALA 45 HB2 ALA 45 3.270 0.971 -5.238
269 H CYS 46 H CYS 46 2.882 -0.998 -1.826
270 HA CYS 46 HA CYS 46 1.655 -3.599 -1.637
271 HB3 CYS 46 HB2 CYS 46 1.235 -2.939 0.725
272 H TYR 47 H TYR 47 -0.218 -3.839 -2.668
273 HA TYR 47 HA TYR 47 -2.481 -1.982 -2.307
274 HB3 TYR 47 HB2 TYR 47 -2.441 -4.701 -3.632
275 HD1 TYR 47 HD2 TYR 47 -3.742 -1.277 -4.439
276 HD2 TYR 47 HD1 TYR 47 -4.800 -5.359 -3.524
277 HE1 TYR 47 HE2 TYR 47 -6.082 -0.831 -5.110
278 HE2 TYR 47 HE1 TYR 47 -7.091 -4.938 -4.336
279 HH TYR 47 HH TYR 47 -8.362 -1.808 -4.542
280 H CYS 48 H CYS 48 -3.044 -1.959 -0.201
281 HA CYS 48 HA CYS 48 -3.179 -4.439 1.400
282 HB3 CYS 48 HB2 CYS 48 -4.110 -2.971 3.141
283 H LYS 49 H LYS 49 -5.147 -5.246 2.167
284 HA LYS 49 HA LYS 49 -7.495 -4.559 0.488
285 HB3 LYS 49 HB2 LYS 49 -8.055 -6.960 0.755
286 HG3 LYS 49 HG2 LYS 49 -5.642 -5.968 -0.808
287 HD3 LYS 49 HD2 LYS 49 -6.162 -8.228 -2.042
288 HE3 LYS 49 HE2 LYS 49 -4.636 -8.202 0.598
289 HZ1 LYS 49 HZ3 LYS 49 -4.696 -10.395 -0.622
290 HZ2 LYS 49 HZ1 LYS 49 -3.685 -9.678 -1.753
291 HZ3 LYS 49 HZ2 LYS 49 -3.213 -9.767 -0.244
292 H ASP 50 H ASP 50 -9.412 -4.415 1.486
293 HA ASP 50 HA ASP 50 -10.580 -3.155 3.003
294 HB3 ASP 50 HB2 ASP 50 -10.805 -4.366 5.312
295 H LEU 51 H LEU 51 -8.235 -1.976 2.660
296 HA LEU 51 HA LEU 51 -6.886 -1.365 5.138
297 HB3 LEU 51 HB2 LEU 51 -7.161 0.260 2.577
298 HG LEU 51 HG LEU 51 -6.186 1.447 4.639
299 HD11 LEU 51 1HD1 LEU 51 -4.888 -0.482 5.591
300 HD12 LEU 51 2HD1 LEU 51 -3.899 -0.504 4.128
301 HD13 LEU 51 3HD1 LEU 51 -3.854 0.893 5.208
302 HD21 LEU 51 3HD2 LEU 51 -4.346 2.427 3.336
303 HD22 LEU 51 1HD2 LEU 51 -4.398 1.057 2.204
304 HD23 LEU 51 2HD2 LEU 51 -5.769 2.179 2.315
305 HA PRO 52 HA PRO 52 -10.518 0.995 6.488
306 HB3 PRO 52 HB2 PRO 52 -10.034 0.415 8.647
307 HG3 PRO 52 HG2 PRO 52 -7.769 0.177 9.390
308 HD3 PRO 52 HD2 PRO 52 -7.962 -1.186 7.451
309 H ASP 53 H ASP 53 -11.241 3.102 6.476
310 HA ASP 53 HA ASP 53 -10.389 4.819 4.515
311 HB3 ASP 53 HB2 ASP 53 -12.627 4.769 5.517
312 H ASN 54 H ASN 54 -9.889 5.183 7.993
313 HA ASN 54 HA ASN 54 -8.438 7.469 8.245
314 HB3 ASN 54 HB2 ASN 54 -7.977 4.803 9.644
315 HD21 ASN 54 1HD2 ASN 54 -5.883 4.825 10.470
316 HD22 ASN 54 2HD2 ASN 54 -5.236 6.216 11.325
317 H VAL 55 H VAL 55 -7.040 4.347 7.098
318 HA VAL 55 HA VAL 55 -4.343 5.529 7.195
319 HB VAL 55 HB VAL 55 -5.203 2.763 6.323
320 HG11 VAL 55 1HG1 VAL 55 -2.471 3.973 7.002
321 HG12 VAL 55 2HG1 VAL 55 -2.779 2.266 6.672
322 HG13 VAL 55 3HG1 VAL 55 -3.009 3.471 5.386
323 HG21 VAL 55 3HG2 VAL 55 -4.007 3.750 8.957
324 HG22 VAL 55 1HG2 VAL 55 -5.675 3.194 8.746
325 HG23 VAL 55 2HG2 VAL 55 -4.337 2.061 8.526
326 HA PRO 56 HA PRO 56 -5.386 7.167 3.277
327 HB3 PRO 56 HB2 PRO 56 -4.046 8.938 3.879
328 HG3 PRO 56 HG2 PRO 56 -1.912 8.589 4.930
329 HD3 PRO 56 HD2 PRO 56 -3.558 7.479 6.236
330 H ILE 57 H ILE 57 -5.037 7.137 1.018
331 HA ILE 57 HA ILE 57 -3.881 4.626 -0.053
332 HB ILE 57 HB ILE 57 -5.233 4.975 -1.958
333 HG13 ILE 57 2HG1 ILE 57 -5.135 7.425 -2.189
334 HG21 ILE 57 1HG2 ILE 57 -6.195 4.009 0.206
335 HG22 ILE 57 2HG2 ILE 57 -6.999 5.574 0.442
336 HG23 ILE 57 3HG2 ILE 57 -7.384 4.579 -0.974
337 HD11 ILE 57 3HD1 ILE 57 -8.039 6.591 -1.885
338 HD12 ILE 57 1HD1 ILE 57 -7.370 7.883 -2.892
339 HD13 ILE 57 2HD1 ILE 57 -7.008 6.190 -3.282
340 H ARG 58 H ARG 58 -2.568 4.812 -1.995
341 HA ARG 58 HA ARG 58 -0.748 7.066 -2.111
342 HB3 ARG 58 HB2 ARG 58 -1.153 4.631 -3.903
343 HG3 ARG 58 HG2 ARG 58 0.110 6.306 -5.170
344 HD3 ARG 58 HD2 ARG 58 1.804 6.305 -2.643
345 HE ARG 58 HE ARG 58 3.557 6.421 -4.054
346 HH11 ARG 58 2HH2 ARG 58 1.033 8.605 -5.400
347 HH12 ARG 58 1HH2 ARG 58 2.233 9.554 -6.241
348 HH21 ARG 58 1HH1 ARG 58 5.035 7.744 -5.281
349 HH22 ARG 58 2HH1 ARG 58 4.398 9.071 -6.219
350 H VAL 59 H VAL 59 -1.636 9.017 -2.923
351 HA VAL 59 HA VAL 59 -3.669 8.814 -5.065
352 HB VAL 59 HB VAL 59 -3.790 11.213 -5.039
353 HG11 VAL 59 1HG1 VAL 59 -4.746 11.480 -2.812
354 HG12 VAL 59 2HG1 VAL 59 -5.134 9.874 -3.454
355 HG13 VAL 59 3HG1 VAL 59 -3.867 10.057 -2.222
356 HG21 VAL 59 3HG2 VAL 59 -1.757 11.291 -2.797
357 HG22 VAL 59 1HG2 VAL 59 -1.422 11.794 -4.477
358 HG23 VAL 59 2HG2 VAL 59 -2.637 12.641 -3.513
359 HA PRO 60 HA PRO 60 -0.580 8.746 -8.203
360 HB3 PRO 60 HB2 PRO 60 -2.337 8.118 -9.569
361 HG3 PRO 60 HG2 PRO 60 -4.420 9.324 -9.589
362 HD3 PRO 60 HD2 PRO 60 -4.025 8.518 -7.389
363 H GLY 61 H GLY 61 0.405 10.520 -6.735
364 HA2 GLY 61 HA2 GLY 61 1.282 12.726 -8.525
365 HA3 GLY 61 HA3 GLY 61 0.610 13.139 -6.934
366 H LYS 62 H LYS 62 2.658 14.017 -6.330
367 HA LYS 62 HA LYS 62 5.127 12.546 -6.333
368 HB3 LYS 62 HB2 LYS 62 5.840 14.352 -4.745
369 HG3 LYS 62 HG2 LYS 62 4.265 15.460 -7.105
370 HD3 LYS 62 HD2 LYS 62 6.686 16.452 -5.526
371 HE3 LYS 62 HE2 LYS 62 5.150 17.730 -7.849
372 HZ1 LYS 62 HZ3 LYS 62 6.841 19.406 -7.701
373 HZ2 LYS 62 HZ1 LYS 62 6.015 19.337 -6.283
374 HZ3 LYS 62 HZ2 LYS 62 7.526 18.692 -6.391
375 H CYS 63 H CYS 63 6.299 12.370 -4.097
376 HA CYS 63 HA CYS 63 4.662 11.504 -1.846
377 HB3 CYS 63 HB2 CYS 63 6.381 9.735 -3.500
378 H HIS 64 H HIS 64 5.683 12.375 -0.003
379 HA HIS 64 HA HIS 64 8.246 13.872 -0.419
380 HB3 HIS 64 HB2 HIS 64 7.328 15.564 1.030
381 HD1 HIS 64 HD1 HIS 64 3.978 15.970 0.421
382 HD2 HIS 64 HD2 HIS 64 7.197 15.282 -2.192
383 HE1 HIS 64 HE1 HIS 64 3.249 16.821 -1.874
Start of MODEL 13
1 H1 VAL 1 H VAL 1 -14.950 0.975 4.952
2 HA VAL 1 HA VAL 1 -12.210 0.735 5.532
3 HB VAL 1 HB VAL 1 -12.007 -1.724 5.222
4 HG11 VAL 1 1HG1 VAL 1 -11.956 -0.809 7.512
5 HG12 VAL 1 2HG1 VAL 1 -13.718 -1.001 7.637
6 HG13 VAL 1 3HG1 VAL 1 -12.672 -2.425 7.468
7 HG21 VAL 1 3HG2 VAL 1 -15.043 -1.780 5.554
8 HG22 VAL 1 1HG2 VAL 1 -14.137 -2.215 4.088
9 HG23 VAL 1 2HG2 VAL 1 -13.971 -3.189 5.554
10 H ARG 2 H ARG 2 -11.055 -0.123 3.548
11 HA ARG 2 HA ARG 2 -12.623 -0.456 1.111
12 HB3 ARG 2 HB2 ARG 2 -12.530 1.984 1.151
13 HG3 ARG 2 HG2 ARG 2 -9.527 1.635 1.653
14 HD3 ARG 2 HD2 ARG 2 -11.170 3.917 0.593
15 HE ARG 2 HE ARG 2 -10.437 5.301 2.207
16 HH11 ARG 2 2HH2 ARG 2 -7.803 2.915 2.037
17 HH12 ARG 2 1HH2 ARG 2 -6.781 3.967 3.027
18 HH21 ARG 2 1HH1 ARG 2 -9.120 6.485 3.280
19 HH22 ARG 2 2HH1 ARG 2 -7.548 5.929 3.789
20 H ASP 3 H ASP 3 -10.961 -0.699 -0.716
21 HA ASP 3 HA ASP 3 -8.501 -2.106 0.270
22 HB3 ASP 3 HB2 ASP 3 -8.277 -3.042 -1.906
23 H ALA 4 H ALA 4 -6.493 -1.223 -0.555
24 HA ALA 4 HA ALA 4 -6.579 1.069 -2.363
25 HB1 ALA 4 HB3 ALA 4 -7.445 2.188 -0.347
26 HB2 ALA 4 HB1 ALA 4 -6.099 1.529 0.615
27 HB3 ALA 4 HB2 ALA 4 -5.778 2.710 -0.669
28 H TYR 5 H TYR 5 -4.525 1.913 -2.849
29 HA TYR 5 HA TYR 5 -2.166 0.268 -2.375
30 HB3 TYR 5 HB2 TYR 5 -0.992 2.246 -3.301
31 HD1 TYR 5 HD1 TYR 5 -0.846 0.010 -4.615
32 HD2 TYR 5 HD2 TYR 5 -3.828 3.045 -5.332
33 HE1 TYR 5 HE1 TYR 5 -1.131 -0.814 -6.915
34 HE2 TYR 5 HE2 TYR 5 -4.099 2.223 -7.654
35 HH TYR 5 HH TYR 5 -1.971 -0.237 -9.055
36 H ILE 6 H ILE 6 -1.239 0.262 -0.252
37 HA ILE 6 HA ILE 6 -2.124 2.280 1.600
38 HB ILE 6 HB ILE 6 -1.501 -0.003 2.240
39 HG13 ILE 6 2HG1 ILE 6 -1.537 2.061 3.755
40 HG21 ILE 6 1HG2 ILE 6 0.553 -0.254 0.802
41 HG22 ILE 6 2HG2 ILE 6 1.407 0.868 1.871
42 HG23 ILE 6 3HG2 ILE 6 0.841 -0.696 2.481
43 HD11 ILE 6 3HD1 ILE 6 -1.584 -0.202 4.604
44 HD12 ILE 6 1HD1 ILE 6 0.188 -0.293 4.567
45 HD13 ILE 6 2HD1 ILE 6 -0.612 0.857 5.660
46 H ALA 7 H ALA 7 -0.969 4.043 2.471
47 HA ALA 7 HA ALA 7 1.588 4.801 1.146
48 HB1 ALA 7 HB3 ALA 7 -0.883 6.553 1.513
49 HB2 ALA 7 HB1 ALA 7 0.732 7.134 1.058
50 HB3 ALA 7 HB2 ALA 7 -0.151 6.029 -0.017
51 H GLN 8 H GLN 8 2.964 5.924 2.430
52 HA GLN 8 HA GLN 8 2.169 6.589 5.226
53 HB3 GLN 8 HB2 GLN 8 3.663 4.726 5.427
54 HG3 GLN 8 HG2 GLN 8 5.340 6.132 3.320
55 HE21 GLN 8 1HE2 GLN 8 7.096 4.280 2.600
56 HE22 GLN 8 2HE2 GLN 8 8.191 3.949 3.934
57 H ASN 9 H ASN 9 3.797 8.218 6.052
58 HA ASN 9 HA ASN 9 3.605 10.712 4.945
59 HB3 ASN 9 HB2 ASN 9 5.634 11.282 6.265
60 HD21 ASN 9 1HD2 ASN 9 4.620 8.830 8.462
61 HD22 ASN 9 2HD2 ASN 9 3.330 9.759 9.202
62 H TYR 10 H TYR 10 5.944 10.861 2.173
63 HA TYR 10 HA TYR 10 3.081 11.042 2.993
64 HB3 TYR 10 HB2 TYR 10 3.998 13.347 1.521
65 HD1 TYR 10 HD1 TYR 10 1.579 13.762 1.668
66 HD2 TYR 10 HD2 TYR 10 3.990 13.329 5.218
67 HE1 TYR 10 HE1 TYR 10 -0.315 14.546 3.052
68 HE2 TYR 10 HE2 TYR 10 2.085 14.096 6.601
69 HH TYR 10 HH TYR 10 -1.078 14.977 5.188
70 H ASN 11 H ASN 11 2.253 9.682 1.664
71 HA ASN 11 HA ASN 11 1.351 8.860 -0.191
72 HB3 ASN 11 HB2 ASN 11 2.921 10.476 -2.156
73 HD21 ASN 11 1HD2 ASN 11 1.800 10.680 -4.139
74 HD22 ASN 11 2HD2 ASN 11 0.343 9.746 -4.473
75 H CYS 12 H CYS 12 4.044 8.167 1.041
76 HA CYS 12 HA CYS 12 5.541 7.165 -1.349
77 HB3 CYS 12 HB2 CYS 12 7.398 6.942 0.208
78 H VAL 13 H VAL 13 5.905 4.953 -1.558
79 HA VAL 13 HA VAL 13 4.080 3.178 -0.060
80 HB VAL 13 HB VAL 13 4.851 1.447 -1.617
81 HG11 VAL 13 1HG1 VAL 13 2.946 2.874 -2.213
82 HG12 VAL 13 2HG1 VAL 13 4.037 4.016 -3.033
83 HG13 VAL 13 3HG1 VAL 13 3.856 2.364 -3.646
84 HG21 VAL 13 3HG2 VAL 13 6.301 1.935 -3.501
85 HG22 VAL 13 1HG2 VAL 13 6.561 3.597 -2.949
86 HG23 VAL 13 2HG2 VAL 13 7.189 2.231 -2.000
87 H TYR 14 H TYR 14 5.351 0.907 0.359
88 HA TYR 14 HA TYR 14 7.669 1.522 2.139
89 HB3 TYR 14 HB2 TYR 14 7.203 -0.706 3.089
90 HD1 TYR 14 HD1 TYR 14 7.196 1.150 4.821
91 HD2 TYR 14 HD2 TYR 14 3.690 0.076 2.553
92 HE1 TYR 14 HE1 TYR 14 5.768 2.230 6.524
93 HE2 TYR 14 HE2 TYR 14 2.263 1.166 4.267
94 HH TYR 14 HH TYR 14 3.617 2.712 7.182
95 H HIS 15 H HIS 15 9.468 -0.008 2.013
96 HA HIS 15 HA HIS 15 10.191 -0.645 -0.734
97 HB3 HIS 15 HB2 HIS 15 11.617 -1.242 1.880
98 HD1 HIS 15 HD1 HIS 15 12.130 -3.604 0.296
99 HD2 HIS 15 HD2 HIS 15 13.785 0.092 -0.834
100 HE1 HIS 15 HE1 HIS 15 14.083 -4.124 -1.304
101 H CYS 16 H CYS 16 8.261 -1.994 -1.039
102 HA CYS 16 HA CYS 16 7.626 -4.427 0.037
103 HB3 CYS 16 HB2 CYS 16 7.693 -3.568 -2.844
104 H ALA 17 H ALA 17 9.156 -5.787 0.855
105 HA ALA 17 HA ALA 17 11.306 -6.915 -0.770
106 HB1 ALA 17 HB3 ALA 17 11.433 -6.854 1.693
107 HB2 ALA 17 HB1 ALA 17 10.003 -7.904 1.803
108 HB3 ALA 17 HB2 ALA 17 11.503 -8.519 1.079
109 H ARG 18 H ARG 18 7.885 -7.671 -0.016
110 HA ARG 18 HA ARG 18 7.557 -9.286 -2.315
111 HB3 ARG 18 HB2 ARG 18 7.328 -10.808 0.330
112 HG3 ARG 18 HG2 ARG 18 6.196 -11.926 -1.563
113 HD3 ARG 18 HD2 ARG 18 8.771 -11.240 -2.994
114 HE ARG 18 HE ARG 18 7.328 -13.450 -4.195
115 HH11 ARG 18 2HH2 ARG 18 9.923 -12.641 -1.966
116 HH12 ARG 18 1HH2 ARG 18 10.825 -14.111 -2.179
117 HH21 ARG 18 1HH1 ARG 18 8.476 -15.454 -4.513
118 HH22 ARG 18 2HH1 ARG 18 9.958 -15.760 -3.667
119 H ASP 19 H ASP 19 5.255 -10.037 -2.469
120 HA ASP 19 HA ASP 19 3.202 -8.581 -1.436
121 HB3 ASP 19 HB2 ASP 19 1.838 -10.591 -1.870
122 H ALA 20 H ALA 20 4.470 -11.614 -0.002
123 HA ALA 20 HA ALA 20 2.943 -11.750 2.314
124 HB1 ALA 20 HB3 ALA 20 4.795 -13.060 3.272
125 HB2 ALA 20 HB1 ALA 20 4.490 -13.510 1.583
126 HB3 ALA 20 HB2 ALA 20 5.887 -12.488 1.993
127 H TYR 21 H TYR 21 6.109 -10.007 2.008
128 HA TYR 21 HA TYR 21 6.246 -8.966 4.651
129 HB3 TYR 21 HB2 TYR 21 7.281 -8.112 1.955
130 HD1 TYR 21 HD1 TYR 21 8.613 -7.176 5.295
131 HD2 TYR 21 HD2 TYR 21 6.719 -5.790 1.684
132 HE1 TYR 21 HE1 TYR 21 9.141 -4.847 5.913
133 HE2 TYR 21 HE2 TYR 21 7.257 -3.445 2.302
134 HH TYR 21 HH TYR 21 9.018 -2.626 5.296
135 H CYS 22 H CYS 22 4.770 -7.542 1.704
136 HA CYS 22 HA CYS 22 3.710 -5.284 3.169
137 HB3 CYS 22 HB2 CYS 22 2.135 -5.218 1.064
138 H ASN 23 H ASN 23 2.423 -8.500 2.558
139 HA ASN 23 HA ASN 23 -0.282 -8.013 3.362
140 HB3 ASN 23 HB2 ASN 23 1.347 -10.260 2.529
141 HD21 ASN 23 1HD2 ASN 23 -1.669 -10.876 4.249
142 HD22 ASN 23 2HD2 ASN 23 -0.949 -11.980 5.432
143 H GLU 24 H GLU 24 2.609 -9.207 5.145
144 HA GLU 24 HA GLU 24 1.508 -9.380 7.704
145 HB3 GLU 24 HB2 GLU 24 4.306 -8.643 6.692
146 HG3 GLU 24 HG2 GLU 24 3.401 -9.404 9.470
147 H LEU 25 H LEU 25 3.216 -6.618 6.157
148 HA LEU 25 HA LEU 25 2.825 -4.701 8.105
149 HB3 LEU 25 HB2 LEU 25 2.699 -4.160 5.105
150 HG LEU 25 HG LEU 25 3.467 -2.530 7.536
151 HD11 LEU 25 1HD1 LEU 25 4.869 -1.088 6.114
152 HD12 LEU 25 2HD1 LEU 25 5.550 -2.718 6.211
153 HD13 LEU 25 3HD1 LEU 25 4.671 -2.211 4.750
154 HD21 LEU 25 3HD2 LEU 25 2.396 -0.721 6.290
155 HD22 LEU 25 1HD2 LEU 25 2.252 -1.744 4.843
156 HD23 LEU 25 2HD2 LEU 25 1.306 -2.110 6.289
157 H CYS 26 H CYS 26 0.542 -5.403 5.431
158 HA CYS 26 HA CYS 26 -1.519 -3.617 6.040
159 HB3 CYS 26 HB2 CYS 26 -3.021 -5.251 4.901
160 H THR 27 H THR 27 -1.137 -7.015 7.231
161 HA THR 27 HA THR 27 -3.418 -6.869 8.970
162 HB THR 27 HB THR 27 -2.550 -8.864 10.057
163 HG1 THR 27 HG1 THR 27 -0.210 -8.201 8.688
164 HG21 THR 27 3HG2 THR 27 -3.810 -9.080 7.968
165 HG22 THR 27 1HG2 THR 27 -2.313 -8.976 7.021
166 HG23 THR 27 2HG2 THR 27 -2.578 -10.348 8.111
167 H LYS 28 H LYS 28 -0.060 -5.867 9.450
168 HA LYS 28 HA LYS 28 -0.261 -5.433 12.236
169 HB3 LYS 28 HB2 LYS 28 1.390 -3.468 10.717
170 HG3 LYS 28 HG2 LYS 28 3.217 -4.379 12.022
171 HD3 LYS 28 HD2 LYS 28 1.360 -2.784 13.070
172 HE3 LYS 28 HE2 LYS 28 1.545 -4.510 15.465
173 HZ1 LYS 28 HZ3 LYS 28 -0.788 -3.320 14.112
174 HZ2 LYS 28 HZ1 LYS 28 -0.795 -3.965 15.624
175 HZ3 LYS 28 HZ2 LYS 28 0.082 -2.605 15.312
176 H ASN 29 H ASN 29 -1.189 -3.507 9.399
177 HA ASN 29 HA ASN 29 -1.879 -1.110 10.918
178 HB3 ASN 29 HB2 ASN 29 -2.769 -0.236 8.908
179 HD21 ASN 29 1HD2 ASN 29 0.025 -0.715 9.794
180 HD22 ASN 29 2HD2 ASN 29 0.961 -0.878 8.322
181 H GLY 30 H GLY 30 -3.558 -3.920 9.657
182 HA2 GLY 30 HA2 GLY 30 -5.471 -4.856 10.869
183 HA3 GLY 30 HA3 GLY 30 -6.089 -3.222 11.136
184 H ALA 31 H ALA 31 -4.654 -4.513 8.131
185 HA ALA 31 HA ALA 31 -7.284 -4.479 6.713
186 HB1 ALA 31 HB3 ALA 31 -5.401 -4.876 4.795
187 HB2 ALA 31 HB1 ALA 31 -5.964 -3.266 5.249
188 HB3 ALA 31 HB2 ALA 31 -4.450 -3.882 5.918
189 H LYS 32 H LYS 32 -7.871 -6.511 5.759
190 HA LYS 32 HA LYS 32 -7.073 -8.701 7.377
191 HB3 LYS 32 HB2 LYS 32 -9.215 -8.581 6.289
192 HG3 LYS 32 HG2 LYS 32 -8.078 -9.729 3.707
193 HD3 LYS 32 HD2 LYS 32 -10.016 -8.182 2.872
194 HE3 LYS 32 HE2 LYS 32 -10.970 -10.349 4.781
195 HZ1 LYS 32 HZ3 LYS 32 -12.241 -9.336 2.328
196 HZ2 LYS 32 HZ1 LYS 32 -12.957 -10.163 3.568
197 HZ3 LYS 32 HZ2 LYS 32 -12.460 -8.583 3.730
198 H SER 33 H SER 33 -5.690 -7.625 4.311
199 HA SER 33 HA SER 33 -3.262 -8.889 4.723
200 HB3 SER 33 HB2 SER 33 -4.891 -10.300 2.553
201 HG SER 33 HG SER 33 -3.004 -11.584 2.448
202 H GLY 34 H GLY 34 -2.452 -9.087 2.000
203 HA2 GLY 34 HA2 GLY 34 -3.485 -7.039 0.331
204 HA3 GLY 34 HA3 GLY 34 -2.028 -6.433 1.163
205 H SER 35 H SER 35 -1.406 -6.389 -1.240
206 HA SER 35 HA SER 35 0.406 -8.652 -1.679
207 HB3 SER 35 HB2 SER 35 -1.503 -9.485 -2.904
208 HG SER 35 HG SER 35 -2.537 -7.376 -3.045
209 H CYS 36 H CYS 36 1.815 -8.075 -3.689
210 HA CYS 36 HA CYS 36 2.423 -5.134 -3.646
211 HB3 CYS 36 HB2 CYS 36 4.287 -7.505 -3.607
212 HA PRO 37 HA PRO 37 1.678 -6.699 -7.948
213 HB3 PRO 37 HB2 PRO 37 -0.582 -6.298 -7.878
214 HG3 PRO 37 HG2 PRO 37 -1.504 -4.526 -6.534
215 HD3 PRO 37 HD2 PRO 37 -0.239 -5.984 -5.153
216 H TYR 38 H TYR 38 2.193 -5.739 -9.996
217 HA TYR 38 HA TYR 38 4.169 -3.517 -9.802
218 HB3 TYR 38 HB2 TYR 38 5.633 -4.854 -11.208
219 HD1 TYR 38 HD2 TYR 38 6.218 -4.271 -8.631
220 HD2 TYR 38 HD1 TYR 38 4.690 -8.041 -10.046
221 HE1 TYR 38 HE2 TYR 38 6.997 -5.368 -6.551
222 HE2 TYR 38 HE1 TYR 38 5.539 -9.147 -7.995
223 HH TYR 38 HH TYR 38 6.845 -7.301 -5.284
224 H LEU 39 H LEU 39 4.764 -2.688 -11.961
225 HA LEU 39 HA LEU 39 4.267 -1.612 -13.873
226 HB3 LEU 39 HB2 LEU 39 3.245 -2.885 -15.670
227 HG LEU 39 HG LEU 39 4.746 -4.851 -13.884
228 HD11 LEU 39 1HD1 LEU 39 5.252 -5.985 -16.001
229 HD12 LEU 39 2HD1 LEU 39 3.501 -5.895 -15.738
230 HD13 LEU 39 3HD1 LEU 39 4.281 -4.793 -16.893
231 HD21 LEU 39 3HD2 LEU 39 6.147 -2.863 -14.241
232 HD22 LEU 39 1HD2 LEU 39 6.729 -4.185 -15.256
233 HD23 LEU 39 2HD2 LEU 39 5.770 -2.879 -15.980
234 H GLY 40 H GLY 40 2.363 -0.917 -15.432
235 HA2 GLY 40 HA2 GLY 40 0.676 0.631 -15.576
236 HA3 GLY 40 HA3 GLY 40 -0.262 -0.600 -14.711
237 H GLU 41 H GLU 41 -1.437 1.137 -13.715
238 HA GLU 41 HA GLU 41 -0.589 3.171 -12.236
239 HB3 GLU 41 HB2 GLU 41 -2.662 3.303 -11.267
240 HG3 GLU 41 HG2 GLU 41 -4.366 2.566 -12.724
241 H HIS 42 H HIS 42 -0.273 -0.180 -11.194
242 HA HIS 42 HA HIS 42 0.260 0.381 -8.409
243 HB3 HIS 42 HB2 HIS 42 0.749 -1.837 -8.159
244 HD1 HIS 42 HD1 HIS 42 0.454 -2.835 -11.768
245 HD2 HIS 42 HD2 HIS 42 -1.893 -2.433 -8.326
246 HE1 HIS 42 HE1 HIS 42 -1.736 -4.091 -12.231
247 H LYS 43 H LYS 43 2.261 -0.027 -11.314
248 HA LYS 43 HA LYS 43 4.494 0.283 -11.703
249 HB3 LYS 43 HB2 LYS 43 4.047 2.762 -10.023
250 HG3 LYS 43 HG2 LYS 43 5.282 2.620 -12.792
251 HD3 LYS 43 HD2 LYS 43 4.888 4.856 -11.927
252 HE3 LYS 43 HE2 LYS 43 4.864 4.753 -9.552
253 HZ1 LYS 43 HZ3 LYS 43 6.742 4.029 -8.265
254 HZ2 LYS 43 HZ1 LYS 43 6.252 2.809 -9.235
255 HZ3 LYS 43 HZ2 LYS 43 7.603 3.656 -9.618
256 H PHE 44 H PHE 44 4.190 -1.420 -9.463
257 HA PHE 44 HA PHE 44 5.361 -2.373 -7.764
258 HB3 PHE 44 HB2 PHE 44 7.423 -0.141 -7.870
259 HD1 PHE 44 HD2 PHE 44 7.623 -0.425 -5.360
260 HD2 PHE 44 HD1 PHE 44 8.509 -3.555 -8.203
261 HE1 PHE 44 HE2 PHE 44 9.059 -1.546 -3.693
262 HE2 PHE 44 HE1 PHE 44 9.882 -4.704 -6.497
263 HZ PHE 44 HZ PHE 44 10.163 -3.708 -4.241
264 H ALA 45 H ALA 45 3.549 -2.011 -6.468
265 HA ALA 45 HA ALA 45 3.988 -0.132 -4.287
266 HB1 ALA 45 HB3 ALA 45 1.714 0.889 -4.471
267 HB2 ALA 45 HB1 ALA 45 2.746 1.337 -5.835
268 HB3 ALA 45 HB2 ALA 45 1.494 0.089 -6.041
269 H CYS 46 H CYS 46 2.013 -0.506 -2.677
270 HA CYS 46 HA CYS 46 1.403 -3.423 -2.718
271 HB3 CYS 46 HB2 CYS 46 1.505 -3.265 -0.223
272 H TYR 47 H TYR 47 -0.606 -3.952 -2.653
273 HA TYR 47 HA TYR 47 -2.652 -1.870 -2.100
274 HB3 TYR 47 HB2 TYR 47 -3.023 -4.442 -3.655
275 HD1 TYR 47 HD1 TYR 47 -3.760 -0.841 -4.318
276 HD2 TYR 47 HD2 TYR 47 -5.440 -4.691 -3.373
277 HE1 TYR 47 HE1 TYR 47 -6.020 0.033 -4.805
278 HE2 TYR 47 HE2 TYR 47 -7.680 -3.858 -4.036
279 HH TYR 47 HH TYR 47 -8.302 -0.438 -4.785
280 H CYS 48 H CYS 48 -3.447 -2.063 -0.086
281 HA CYS 48 HA CYS 48 -3.560 -4.706 1.276
282 HB3 CYS 48 HB2 CYS 48 -4.384 -3.434 3.200
283 H LYS 49 H LYS 49 -5.462 -5.559 1.923
284 HA LYS 49 HA LYS 49 -7.947 -4.673 0.604
285 HB3 LYS 49 HB2 LYS 49 -8.641 -7.066 1.242
286 HG3 LYS 49 HG2 LYS 49 -7.222 -8.256 -0.399
287 HD3 LYS 49 HD2 LYS 49 -7.907 -5.444 -1.325
288 HE3 LYS 49 HE2 LYS 49 -7.909 -8.076 -2.775
289 HZ1 LYS 49 HZ3 LYS 49 -8.900 -6.473 -4.534
290 HZ2 LYS 49 HZ1 LYS 49 -9.915 -7.093 -3.385
291 HZ3 LYS 49 HZ2 LYS 49 -9.402 -5.586 -3.216
292 H ASP 50 H ASP 50 -9.770 -4.175 1.703
293 HA ASP 50 HA ASP 50 -11.007 -3.388 3.453
294 HB3 ASP 50 HB2 ASP 50 -10.775 -5.250 5.478
295 H LEU 51 H LEU 51 -8.730 -2.046 3.276
296 HA LEU 51 HA LEU 51 -7.383 -1.707 5.837
297 HB3 LEU 51 HB2 LEU 51 -7.404 -0.008 3.307
298 HG LEU 51 HG LEU 51 -6.266 0.993 5.372
299 HD11 LEU 51 1HD1 LEU 51 -5.196 -1.116 6.240
300 HD12 LEU 51 2HD1 LEU 51 -4.221 -1.201 4.767
301 HD13 LEU 51 3HD1 LEU 51 -4.003 0.141 5.902
302 HD21 LEU 51 3HD2 LEU 51 -4.668 0.410 2.833
303 HD22 LEU 51 1HD2 LEU 51 -5.791 1.759 3.099
304 HD23 LEU 51 2HD2 LEU 51 -4.269 1.683 3.996
305 HA PRO 52 HA PRO 52 -10.699 1.069 7.175
306 HB3 PRO 52 HB2 PRO 52 -10.141 0.564 9.345
307 HG3 PRO 52 HG2 PRO 52 -7.867 0.201 9.999
308 HD3 PRO 52 HD2 PRO 52 -8.256 -1.271 8.168
309 H ASP 53 H ASP 53 -11.243 3.159 6.642
310 HA ASP 53 HA ASP 53 -9.735 4.386 4.725
311 HB3 ASP 53 HB2 ASP 53 -11.916 5.656 6.407
312 H ASN 54 H ASN 54 -9.629 4.964 8.161
313 HA ASN 54 HA ASN 54 -8.260 7.315 8.555
314 HB3 ASN 54 HB2 ASN 54 -7.676 4.569 9.745
315 HD21 ASN 54 1HD2 ASN 54 -5.505 4.705 10.412
316 HD22 ASN 54 2HD2 ASN 54 -4.947 6.042 11.407
317 H VAL 55 H VAL 55 -6.867 4.306 7.153
318 HA VAL 55 HA VAL 55 -4.203 5.519 7.021
319 HB VAL 55 HB VAL 55 -5.184 2.892 5.899
320 HG11 VAL 55 1HG1 VAL 55 -2.769 2.319 5.890
321 HG12 VAL 55 2HG1 VAL 55 -3.081 3.718 4.847
322 HG13 VAL 55 3HG1 VAL 55 -2.369 3.947 6.459
323 HG21 VAL 55 3HG2 VAL 55 -5.441 2.902 8.351
324 HG22 VAL 55 1HG2 VAL 55 -4.070 1.891 7.891
325 HG23 VAL 55 2HG2 VAL 55 -3.786 3.520 8.538
326 HA PRO 56 HA PRO 56 -5.585 7.485 3.261
327 HB3 PRO 56 HB2 PRO 56 -4.132 9.196 3.810
328 HG3 PRO 56 HG2 PRO 56 -1.952 8.739 4.721
329 HD3 PRO 56 HD2 PRO 56 -3.564 7.676 6.122
330 H ILE 57 H ILE 57 -5.366 7.394 0.948
331 HA ILE 57 HA ILE 57 -4.341 4.824 -0.082
332 HB ILE 57 HB ILE 57 -5.571 5.280 -2.046
333 HG13 ILE 57 2HG1 ILE 57 -5.112 7.634 -2.427
334 HG21 ILE 57 1HG2 ILE 57 -7.803 5.249 -1.204
335 HG22 ILE 57 2HG2 ILE 57 -6.791 4.598 0.085
336 HG23 ILE 57 3HG2 ILE 57 -7.381 6.266 0.190
337 HD11 ILE 57 3HD1 ILE 57 -7.229 8.436 -3.188
338 HD12 ILE 57 1HD1 ILE 57 -7.174 6.684 -3.462
339 HD13 ILE 57 2HD1 ILE 57 -8.118 7.355 -2.109
340 H ARG 58 H ARG 58 -2.719 4.748 -1.699
341 HA ARG 58 HA ARG 58 -0.930 7.027 -1.895
342 HB3 ARG 58 HB2 ARG 58 -0.756 4.615 -3.716
343 HG3 ARG 58 HG2 ARG 58 1.660 4.817 -3.046
344 HD3 ARG 58 HD2 ARG 58 0.365 7.206 -4.371
345 HE ARG 58 HE ARG 58 2.947 7.185 -3.495
346 HH11 ARG 58 2HH2 ARG 58 1.056 7.950 -6.362
347 HH12 ARG 58 1HH2 ARG 58 2.336 8.912 -7.078
348 HH21 ARG 58 1HH1 ARG 58 4.404 8.751 -4.327
349 HH22 ARG 58 2HH1 ARG 58 4.006 9.532 -5.852
350 H VAL 59 H VAL 59 -1.475 8.795 -3.192
351 HA VAL 59 HA VAL 59 -3.535 8.382 -5.286
352 HB VAL 59 HB VAL 59 -3.582 10.811 -5.484
353 HG11 VAL 59 1HG1 VAL 59 -4.579 11.290 -3.310
354 HG12 VAL 59 2HG1 VAL 59 -5.028 9.666 -3.856
355 HG13 VAL 59 3HG1 VAL 59 -3.789 9.872 -2.596
356 HG21 VAL 59 3HG2 VAL 59 -2.418 12.302 -4.011
357 HG22 VAL 59 1HG2 VAL 59 -1.592 10.971 -3.202
358 HG23 VAL 59 2HG2 VAL 59 -1.220 11.361 -4.903
359 HA PRO 60 HA PRO 60 -0.460 8.149 -8.454
360 HB3 PRO 60 HB2 PRO 60 -2.210 7.458 -9.792
361 HG3 PRO 60 HG2 PRO 60 -4.300 8.649 -9.861
362 HD3 PRO 60 HD2 PRO 60 -3.905 7.944 -7.625
363 H GLY 61 H GLY 61 0.507 10.042 -7.035
364 HA2 GLY 61 HA2 GLY 61 1.401 12.112 -8.973
365 HA3 GLY 61 HA3 GLY 61 0.669 12.635 -7.443
366 H LYS 62 H LYS 62 2.665 13.632 -6.894
367 HA LYS 62 HA LYS 62 5.202 12.325 -6.767
368 HB3 LYS 62 HB2 LYS 62 5.778 14.258 -5.260
369 HG3 LYS 62 HG2 LYS 62 4.273 14.920 -7.825
370 HD3 LYS 62 HD2 LYS 62 4.374 16.936 -6.523
371 HE3 LYS 62 HE2 LYS 62 6.163 16.521 -4.910
372 HZ1 LYS 62 HZ3 LYS 62 8.010 16.742 -7.205
373 HZ2 LYS 62 HZ1 LYS 62 8.444 16.680 -5.621
374 HZ3 LYS 62 HZ2 LYS 62 7.738 15.376 -6.322
375 H CYS 63 H CYS 63 6.403 12.235 -4.581
376 HA CYS 63 HA CYS 63 4.826 11.447 -2.267
377 HB3 CYS 63 HB2 CYS 63 6.582 9.644 -3.835
378 H HIS 64 H HIS 64 6.091 12.116 -0.343
379 HA HIS 64 HA HIS 64 8.658 13.453 -0.726
380 HB3 HIS 64 HB2 HIS 64 7.256 15.204 -1.614
381 HD1 HIS 64 HD1 HIS 64 5.864 16.342 1.667
382 HD2 HIS 64 HD2 HIS 64 4.603 14.374 -1.837
383 HE1 HIS 64 HE1 HIS 64 3.323 16.521 1.598
Start of MODEL 14
1 H1 VAL 1 H VAL 1 -16.257 -0.448 2.191
2 HA VAL 1 HA VAL 1 -14.424 0.855 3.627
3 HB VAL 1 HB VAL 1 -13.278 -1.945 3.635
4 HG11 VAL 1 1HG1 VAL 1 -11.977 -0.942 5.496
5 HG12 VAL 1 2HG1 VAL 1 -11.939 0.176 4.126
6 HG13 VAL 1 3HG1 VAL 1 -13.046 0.468 5.484
7 HG21 VAL 1 3HG2 VAL 1 -15.318 -2.374 4.862
8 HG22 VAL 1 1HG2 VAL 1 -13.973 -2.236 5.994
9 HG23 VAL 1 2HG2 VAL 1 -15.111 -0.884 5.819
10 H ARG 2 H ARG 2 -12.058 -0.796 2.344
11 HA ARG 2 HA ARG 2 -12.574 -0.785 -0.475
12 HB3 ARG 2 HB2 ARG 2 -12.709 1.683 -0.038
13 HG3 ARG 2 HG2 ARG 2 -9.802 1.455 0.865
14 HD3 ARG 2 HD2 ARG 2 -11.848 3.681 1.200
15 HE ARG 2 HE ARG 2 -9.873 3.014 2.933
16 HH11 ARG 2 2HH2 ARG 2 -10.327 5.819 0.839
17 HH12 ARG 2 1HH2 ARG 2 -9.326 6.841 1.834
18 HH21 ARG 2 1HH1 ARG 2 -8.504 4.390 4.141
19 HH22 ARG 2 2HH1 ARG 2 -7.879 5.847 3.422
20 H ASP 3 H ASP 3 -10.622 -1.214 -1.625
21 HA ASP 3 HA ASP 3 -8.250 -2.086 -0.023
22 HB3 ASP 3 HB2 ASP 3 -7.720 -3.485 -2.013
23 H ALA 4 H ALA 4 -6.265 -1.107 -0.720
24 HA ALA 4 HA ALA 4 -6.363 0.954 -2.811
25 HB1 ALA 4 HB3 ALA 4 -6.101 2.817 -1.256
26 HB2 ALA 4 HB1 ALA 4 -7.661 2.020 -0.996
27 HB3 ALA 4 HB2 ALA 4 -6.320 1.728 0.133
28 H TYR 5 H TYR 5 -4.264 2.369 -2.549
29 HA TYR 5 HA TYR 5 -2.063 0.405 -2.305
30 HB3 TYR 5 HB2 TYR 5 -0.717 2.329 -3.202
31 HD1 TYR 5 HD2 TYR 5 -0.659 -0.083 -4.300
32 HD2 TYR 5 HD1 TYR 5 -3.194 3.174 -5.541
33 HE1 TYR 5 HE2 TYR 5 -0.808 -1.059 -6.567
34 HE2 TYR 5 HE1 TYR 5 -3.269 2.241 -7.821
35 HH TYR 5 HH TYR 5 -2.912 0.211 -9.084
36 H ILE 6 H ILE 6 -0.938 0.298 -0.350
37 HA ILE 6 HA ILE 6 -1.667 2.222 1.691
38 HB ILE 6 HB ILE 6 -1.208 -0.168 2.098
39 HG13 ILE 6 2HG1 ILE 6 -1.123 1.745 3.832
40 HG21 ILE 6 1HG2 ILE 6 0.808 -0.409 0.669
41 HG22 ILE 6 2HG2 ILE 6 1.736 0.580 1.803
42 HG23 ILE 6 3HG2 ILE 6 1.109 -0.995 2.310
43 HD11 ILE 6 3HD1 ILE 6 0.308 -0.870 4.381
44 HD12 ILE 6 1HD1 ILE 6 -0.401 0.215 5.598
45 HD13 ILE 6 2HD1 ILE 6 -1.441 -0.600 4.403
46 H ALA 7 H ALA 7 -0.340 3.802 2.677
47 HA ALA 7 HA ALA 7 2.265 4.429 1.390
48 HB1 ALA 7 HB3 ALA 7 0.585 6.034 0.506
49 HB2 ALA 7 HB1 ALA 7 0.120 6.452 2.168
50 HB3 ALA 7 HB2 ALA 7 1.758 6.817 1.591
51 H GLN 8 H GLN 8 3.821 5.000 2.883
52 HA GLN 8 HA GLN 8 3.186 4.522 5.709
53 HB3 GLN 8 HB2 GLN 8 5.139 3.531 4.542
54 HG3 GLN 8 HG2 GLN 8 6.552 6.187 4.885
55 HE21 GLN 8 1HE2 GLN 8 7.456 4.163 2.234
56 HE22 GLN 8 2HE2 GLN 8 8.862 3.502 3.037
57 H ASN 9 H ASN 9 4.803 7.107 3.848
58 HA ASN 9 HA ASN 9 3.641 9.369 5.031
59 HB3 ASN 9 HB2 ASN 9 6.264 9.507 6.236
60 HD21 ASN 9 1HD2 ASN 9 3.078 8.406 7.487
61 HD22 ASN 9 2HD2 ASN 9 2.790 9.866 8.442
62 H TYR 10 H TYR 10 5.965 10.754 2.532
63 HA TYR 10 HA TYR 10 3.132 10.667 3.524
64 HB3 TYR 10 HB2 TYR 10 3.945 13.057 2.075
65 HD1 TYR 10 HD2 TYR 10 3.578 12.088 5.694
66 HD2 TYR 10 HD1 TYR 10 2.097 14.454 2.409
67 HE1 TYR 10 HE2 TYR 10 1.727 12.917 7.125
68 HE2 TYR 10 HE1 TYR 10 0.242 15.263 3.830
69 HH TYR 10 HH TYR 10 -0.773 15.161 5.905
70 H ASN 11 H ASN 11 2.037 9.503 2.049
71 HA ASN 11 HA ASN 11 1.346 8.624 0.108
72 HB3 ASN 11 HB2 ASN 11 2.680 10.559 -1.708
73 HD21 ASN 11 1HD2 ASN 11 1.690 10.299 -3.622
74 HD22 ASN 11 2HD2 ASN 11 0.063 9.699 -3.866
75 H CYS 12 H CYS 12 4.203 8.027 1.171
76 HA CYS 12 HA CYS 12 5.494 7.163 -1.387
77 HB3 CYS 12 HB2 CYS 12 7.510 6.974 -0.089
78 H VAL 13 H VAL 13 5.600 4.978 -1.738
79 HA VAL 13 HA VAL 13 3.954 3.206 -0.149
80 HB VAL 13 HB VAL 13 4.793 1.448 -1.667
81 HG11 VAL 13 1HG1 VAL 13 3.969 3.998 -3.117
82 HG12 VAL 13 2HG1 VAL 13 3.862 2.350 -3.747
83 HG13 VAL 13 3HG1 VAL 13 2.880 2.817 -2.346
84 HG21 VAL 13 3HG2 VAL 13 6.501 3.612 -2.985
85 HG22 VAL 13 1HG2 VAL 13 7.128 2.268 -2.010
86 HG23 VAL 13 2HG2 VAL 13 6.282 1.941 -3.526
87 H TYR 14 H TYR 14 4.813 1.161 0.796
88 HA TYR 14 HA TYR 14 7.439 1.427 2.157
89 HB3 TYR 14 HB2 TYR 14 6.875 -0.880 2.967
90 HD1 TYR 14 HD2 TYR 14 7.460 0.730 4.832
91 HD2 TYR 14 HD1 TYR 14 3.480 0.332 3.231
92 HE1 TYR 14 HE2 TYR 14 6.528 1.657 6.922
93 HE2 TYR 14 HE1 TYR 14 2.549 1.306 5.314
94 HH TYR 14 HH TYR 14 4.612 2.282 8.060
95 H HIS 15 H HIS 15 8.974 -0.398 1.788
96 HA HIS 15 HA HIS 15 9.844 -0.646 -0.832
97 HB3 HIS 15 HB2 HIS 15 10.209 -2.544 1.521
98 HD1 HIS 15 HD1 HIS 15 10.736 -2.859 -2.059
99 HD2 HIS 15 HD2 HIS 15 12.981 -3.450 1.452
100 HE1 HIS 15 HE1 HIS 15 12.660 -4.421 -2.674
101 H CYS 16 H CYS 16 7.558 -2.722 0.904
102 HA CYS 16 HA CYS 16 6.487 -4.613 0.418
103 HB3 CYS 16 HB2 CYS 16 5.443 -3.037 -1.309
104 H ALA 17 H ALA 17 8.987 -5.029 0.917
105 HA ALA 17 HA ALA 17 10.780 -6.227 -0.737
106 HB1 ALA 17 HB3 ALA 17 9.957 -7.226 2.024
107 HB2 ALA 17 HB1 ALA 17 11.493 -7.574 1.200
108 HB3 ALA 17 HB2 ALA 17 11.106 -5.912 1.682
109 H ARG 18 H ARG 18 7.786 -7.744 0.452
110 HA ARG 18 HA ARG 18 7.592 -9.040 -2.031
111 HB3 ARG 18 HB2 ARG 18 7.171 -11.009 0.222
112 HG3 ARG 18 HG2 ARG 18 6.626 -11.373 -2.303
113 HD3 ARG 18 HD2 ARG 18 9.028 -10.551 -2.999
114 HE ARG 18 HE ARG 18 9.606 -13.457 -2.547
115 HH11 ARG 18 2HH2 ARG 18 10.713 -10.106 -1.892
116 HH12 ARG 18 1HH2 ARG 18 12.338 -10.595 -1.590
117 HH21 ARG 18 1HH1 ARG 18 11.730 -14.065 -2.016
118 HH22 ARG 18 2HH1 ARG 18 12.905 -12.873 -1.569
119 H ASP 19 H ASP 19 5.280 -9.780 -2.328
120 HA ASP 19 HA ASP 19 3.216 -8.423 -1.250
121 HB3 ASP 19 HB2 ASP 19 1.866 -10.429 -1.831
122 H ALA 20 H ALA 20 4.583 -11.451 0.074
123 HA ALA 20 HA ALA 20 2.929 -11.743 2.309
124 HB1 ALA 20 HB3 ALA 20 4.514 -13.466 1.538
125 HB2 ALA 20 HB1 ALA 20 5.886 -12.459 2.055
126 HB3 ALA 20 HB2 ALA 20 4.755 -13.108 3.260
127 H TYR 21 H TYR 21 6.006 -9.869 2.102
128 HA TYR 21 HA TYR 21 6.060 -9.092 4.865
129 HB3 TYR 21 HB2 TYR 21 7.211 -7.847 2.351
130 HD1 TYR 21 HD1 TYR 21 8.325 -7.891 5.926
131 HD2 TYR 21 HD2 TYR 21 7.017 -5.499 2.588
132 HE1 TYR 21 HE1 TYR 21 8.836 -5.834 7.199
133 HE2 TYR 21 HE2 TYR 21 7.521 -3.436 3.871
134 HH TYR 21 HH TYR 21 8.817 -3.525 7.193
135 H CYS 22 H CYS 22 4.715 -7.522 1.911
136 HA CYS 22 HA CYS 22 3.668 -5.283 3.401
137 HB3 CYS 22 HB2 CYS 22 2.556 -6.413 0.817
138 H ASN 23 H ASN 23 2.314 -8.503 2.681
139 HA ASN 23 HA ASN 23 -0.336 -7.968 3.535
140 HB3 ASN 23 HB2 ASN 23 1.170 -10.622 3.608
141 HD21 ASN 23 1HD2 ASN 23 -0.341 -11.080 5.516
142 HD22 ASN 23 2HD2 ASN 23 -1.996 -11.486 5.116
143 H GLU 24 H GLU 24 2.495 -9.322 5.267
144 HA GLU 24 HA GLU 24 1.449 -9.543 7.871
145 HB3 GLU 24 HB2 GLU 24 4.196 -8.845 6.726
146 HG3 GLU 24 HG2 GLU 24 3.535 -9.560 9.583
147 H LEU 25 H LEU 25 3.103 -6.726 6.344
148 HA LEU 25 HA LEU 25 2.760 -4.894 8.454
149 HB3 LEU 25 HB2 LEU 25 2.805 -4.349 5.440
150 HG LEU 25 HG LEU 25 3.255 -2.597 7.851
151 HD11 LEU 25 1HD1 LEU 25 4.715 -1.157 6.526
152 HD12 LEU 25 2HD1 LEU 25 5.453 -2.755 6.652
153 HD13 LEU 25 3HD1 LEU 25 4.634 -2.270 5.145
154 HD21 LEU 25 3HD2 LEU 25 2.232 -0.898 6.398
155 HD22 LEU 25 1HD2 LEU 25 2.251 -2.016 5.018
156 HD23 LEU 25 2HD2 LEU 25 1.176 -2.306 6.393
157 H CYS 26 H CYS 26 0.491 -5.674 5.812
158 HA CYS 26 HA CYS 26 -1.443 -3.664 6.372
159 HB3 CYS 26 HB2 CYS 26 -2.992 -5.234 5.076
160 H THR 27 H THR 27 -1.282 -7.134 7.380
161 HA THR 27 HA THR 27 -3.557 -6.988 9.107
162 HB THR 27 HB THR 27 -2.664 -9.026 10.161
163 HG1 THR 27 HG1 THR 27 -0.361 -8.308 8.769
164 HG21 THR 27 3HG2 THR 27 -2.523 -9.023 7.111
165 HG22 THR 27 1HG2 THR 27 -2.763 -10.436 8.155
166 HG23 THR 27 2HG2 THR 27 -3.993 -9.159 8.093
167 H LYS 28 H LYS 28 -0.156 -6.165 9.716
168 HA LYS 28 HA LYS 28 -0.422 -5.646 12.499
169 HB3 LYS 28 HB2 LYS 28 1.754 -4.240 11.627
170 HG3 LYS 28 HG2 LYS 28 1.488 -7.284 11.610
171 HD3 LYS 28 HD2 LYS 28 3.922 -5.520 12.147
172 HE3 LYS 28 HE2 LYS 28 3.554 -8.562 12.047
173 HZ1 LYS 28 HZ3 LYS 28 5.668 -7.999 11.158
174 HZ2 LYS 28 HZ1 LYS 28 6.036 -7.007 12.423
175 HZ3 LYS 28 HZ2 LYS 28 5.874 -8.638 12.616
176 H ASN 29 H ASN 29 -1.127 -3.712 9.599
177 HA ASN 29 HA ASN 29 -1.353 -1.203 11.145
178 HB3 ASN 29 HB2 ASN 29 -2.460 -0.486 8.887
179 HD21 ASN 29 1HD2 ASN 29 0.707 -2.231 8.975
180 HD22 ASN 29 2HD2 ASN 29 1.657 -0.751 8.812
181 H GLY 30 H GLY 30 -3.466 -3.656 9.739
182 HA2 GLY 30 HA2 GLY 30 -5.559 -4.163 10.985
183 HA3 GLY 30 HA3 GLY 30 -5.878 -2.424 11.057
184 H ALA 31 H ALA 31 -4.672 -4.558 8.429
185 HA ALA 31 HA ALA 31 -7.145 -4.199 6.828
186 HB1 ALA 31 HB3 ALA 31 -5.911 -2.755 5.533
187 HB2 ALA 31 HB1 ALA 31 -4.350 -3.295 6.202
188 HB3 ALA 31 HB2 ALA 31 -5.155 -4.254 4.954
189 H LYS 32 H LYS 32 -7.543 -6.167 5.571
190 HA LYS 32 HA LYS 32 -6.600 -8.323 7.259
191 HB3 LYS 32 HB2 LYS 32 -8.872 -8.237 6.514
192 HG3 LYS 32 HG2 LYS 32 -8.473 -9.590 3.910
193 HD3 LYS 32 HD2 LYS 32 -10.064 -7.696 3.214
194 HE3 LYS 32 HE2 LYS 32 -10.909 -9.216 5.731
195 HZ1 LYS 32 HZ3 LYS 32 -12.219 -7.225 5.184
196 HZ2 LYS 32 HZ1 LYS 32 -12.577 -7.837 3.732
197 HZ3 LYS 32 HZ2 LYS 32 -13.110 -8.611 5.090
198 H SER 33 H SER 33 -5.404 -7.152 4.192
199 HA SER 33 HA SER 33 -3.310 -9.092 4.175
200 HB3 SER 33 HB2 SER 33 -4.819 -10.716 3.364
201 HG SER 33 HG SER 33 -5.984 -8.768 1.655
202 H GLY 34 H GLY 34 -2.085 -8.938 1.918
203 HA2 GLY 34 HA2 GLY 34 -2.548 -6.453 0.478
204 HA3 GLY 34 HA3 GLY 34 -1.059 -6.458 1.458
205 H SER 35 H SER 35 -1.021 -6.189 -1.366
206 HA SER 35 HA SER 35 0.744 -8.373 -1.983
207 HB3 SER 35 HB2 SER 35 -0.355 -9.451 -3.696
208 HG SER 35 HG SER 35 -1.693 -9.599 -1.783
209 H CYS 36 H CYS 36 2.011 -7.798 -3.974
210 HA CYS 36 HA CYS 36 1.980 -4.824 -4.348
211 HB3 CYS 36 HB2 CYS 36 4.501 -6.423 -4.258
212 HA PRO 37 HA PRO 37 1.760 -6.211 -8.710
213 HB3 PRO 37 HB2 PRO 37 -0.275 -5.274 -9.092
214 HG3 PRO 37 HG2 PRO 37 -1.200 -3.684 -7.548
215 HD3 PRO 37 HD2 PRO 37 -0.466 -5.616 -6.311
216 H TYR 38 H TYR 38 3.979 -6.170 -8.721
217 HA TYR 38 HA TYR 38 5.658 -3.863 -9.144
218 HB3 TYR 38 HB2 TYR 38 6.931 -5.467 -10.580
219 HD1 TYR 38 HD2 TYR 38 5.977 -5.052 -7.158
220 HD2 TYR 38 HD1 TYR 38 8.124 -7.688 -9.829
221 HE1 TYR 38 HE2 TYR 38 7.333 -5.873 -5.277
222 HE2 TYR 38 HE1 TYR 38 9.478 -8.496 -7.928
223 HH TYR 38 HH TYR 38 9.916 -8.303 -5.681
224 H LEU 39 H LEU 39 3.471 -5.785 -11.178
225 HA LEU 39 HA LEU 39 3.426 -3.631 -13.252
226 HB3 LEU 39 HB2 LEU 39 2.611 -5.354 -14.787
227 HG LEU 39 HG LEU 39 5.157 -6.347 -13.409
228 HD11 LEU 39 1HD1 LEU 39 4.098 -8.027 -14.872
229 HD12 LEU 39 2HD1 LEU 39 4.064 -6.855 -16.207
230 HD13 LEU 39 3HD1 LEU 39 5.617 -7.433 -15.565
231 HD21 LEU 39 3HD2 LEU 39 6.325 -5.115 -15.246
232 HD22 LEU 39 1HD2 LEU 39 4.772 -4.404 -15.734
233 HD23 LEU 39 2HD2 LEU 39 5.478 -4.027 -14.145
234 H GLY 40 H GLY 40 1.551 -2.484 -13.211
235 HA2 GLY 40 HA2 GLY 40 -1.044 -3.263 -13.139
236 HA3 GLY 40 HA3 GLY 40 -0.615 -3.160 -11.413
237 H GLU 41 H GLU 41 -2.394 -1.345 -12.037
238 HA GLU 41 HA GLU 41 -1.980 0.870 -13.371
239 HB3 GLU 41 HB2 GLU 41 -3.709 1.797 -12.283
240 HG3 GLU 41 HG2 GLU 41 -5.158 0.342 -11.039
241 H HIS 42 H HIS 42 -0.874 0.610 -9.969
242 HA HIS 42 HA HIS 42 1.101 2.809 -10.446
243 HB3 HIS 42 HB2 HIS 42 0.180 1.709 -7.787
244 HD1 HIS 42 HD1 HIS 42 3.134 2.581 -8.034
245 HD2 HIS 42 HD2 HIS 42 -0.131 5.107 -7.254
246 HE1 HIS 42 HE1 HIS 42 4.097 4.691 -6.918
247 H LYS 43 H LYS 43 1.665 0.391 -11.615
248 HA LYS 43 HA LYS 43 3.172 -1.507 -10.974
249 HB3 LYS 43 HB2 LYS 43 3.461 -0.807 -13.170
250 HG3 LYS 43 HG2 LYS 43 5.058 1.366 -13.476
251 HD3 LYS 43 HD2 LYS 43 2.040 1.199 -13.317
252 HE3 LYS 43 HE2 LYS 43 3.531 3.543 -14.528
253 HZ1 LYS 43 HZ3 LYS 43 0.721 3.116 -13.714
254 HZ2 LYS 43 HZ1 LYS 43 1.306 4.479 -14.423
255 HZ3 LYS 43 HZ2 LYS 43 1.252 3.066 -15.272
256 H PHE 44 H PHE 44 4.200 -2.073 -9.231
257 HA PHE 44 HA PHE 44 5.600 -2.266 -7.507
258 HB3 PHE 44 HB2 PHE 44 7.542 -0.771 -7.168
259 HD1 PHE 44 HD1 PHE 44 8.476 -3.025 -7.218
260 HD2 PHE 44 HD2 PHE 44 7.263 -1.064 -10.865
261 HE1 PHE 44 HE1 PHE 44 9.731 -4.700 -8.539
262 HE2 PHE 44 HE2 PHE 44 8.470 -2.779 -12.183
263 HZ PHE 44 HZ PHE 44 9.738 -4.580 -11.023
264 H ALA 45 H ALA 45 3.339 -1.709 -6.783
265 HA ALA 45 HA ALA 45 3.916 -0.035 -4.439
266 HB1 ALA 45 HB3 ALA 45 1.762 1.218 -4.578
267 HB2 ALA 45 HB1 ALA 45 2.878 1.639 -5.890
268 HB3 ALA 45 HB2 ALA 45 1.503 0.553 -6.204
269 H CYS 46 H CYS 46 2.749 -0.735 -2.592
270 HA CYS 46 HA CYS 46 1.569 -3.386 -2.950
271 HB3 CYS 46 HB2 CYS 46 2.054 -1.916 -0.395
272 H TYR 47 H TYR 47 -0.425 -3.637 -3.508
273 HA TYR 47 HA TYR 47 -2.549 -1.731 -2.791
274 HB3 TYR 47 HB2 TYR 47 -2.762 -4.336 -4.329
275 HD1 TYR 47 HD1 TYR 47 -3.910 -0.748 -4.571
276 HD2 TYR 47 HD2 TYR 47 -5.090 -4.890 -4.384
277 HE1 TYR 47 HE1 TYR 47 -6.276 -0.094 -4.889
278 HE2 TYR 47 HE2 TYR 47 -7.464 -4.217 -4.654
279 HH TYR 47 HH TYR 47 -8.527 -0.965 -4.292
280 H CYS 48 H CYS 48 -2.940 -1.878 -0.688
281 HA CYS 48 HA CYS 48 -2.950 -4.411 0.827
282 HB3 CYS 48 HB2 CYS 48 -3.461 -1.600 1.726
283 H LYS 49 H LYS 49 -4.819 -4.812 2.158
284 HA LYS 49 HA LYS 49 -7.323 -4.335 0.570
285 HB3 LYS 49 HB2 LYS 49 -7.997 -6.612 1.459
286 HG3 LYS 49 HG2 LYS 49 -7.324 -6.203 -0.898
287 HD3 LYS 49 HD2 LYS 49 -4.708 -7.530 -0.053
288 HE3 LYS 49 HE2 LYS 49 -5.823 -6.561 -2.730
289 HZ1 LYS 49 HZ3 LYS 49 -3.820 -7.173 -3.687
290 HZ2 LYS 49 HZ1 LYS 49 -3.382 -6.250 -2.394
291 HZ3 LYS 49 HZ2 LYS 49 -3.217 -7.899 -2.361
292 H ASP 50 H ASP 50 -9.081 -3.646 1.599
293 HA ASP 50 HA ASP 50 -10.503 -2.932 3.230
294 HB3 ASP 50 HB2 ASP 50 -9.223 -4.825 5.206
295 H LEU 51 H LEU 51 -8.814 -1.062 2.892
296 HA LEU 51 HA LEU 51 -7.461 -0.341 5.460
297 HB3 LEU 51 HB2 LEU 51 -6.703 1.676 4.002
298 HG LEU 51 HG LEU 51 -5.557 -1.076 3.401
299 HD11 LEU 51 1HD1 LEU 51 -4.885 0.535 1.705
300 HD12 LEU 51 2HD1 LEU 51 -4.555 1.776 2.933
301 HD13 LEU 51 3HD1 LEU 51 -3.521 0.350 2.825
302 HD21 LEU 51 3HD2 LEU 51 -5.364 -0.563 5.831
303 HD22 LEU 51 1HD2 LEU 51 -3.801 -0.369 5.054
304 HD23 LEU 51 2HD2 LEU 51 -4.773 1.058 5.451
305 HA PRO 52 HA PRO 52 -11.351 1.718 6.092
306 HB3 PRO 52 HB2 PRO 52 -11.268 1.457 8.320
307 HG3 PRO 52 HG2 PRO 52 -9.182 1.217 9.420
308 HD3 PRO 52 HD2 PRO 52 -8.993 -0.212 7.521
309 H ASP 53 H ASP 53 -12.292 3.550 5.589
310 HA ASP 53 HA ASP 53 -11.849 5.289 3.805
311 HB3 ASP 53 HB2 ASP 53 -13.844 5.178 5.290
312 H ASN 54 H ASN 54 -10.744 6.149 7.016
313 HA ASN 54 HA ASN 54 -9.760 8.720 6.343
314 HB3 ASN 54 HB2 ASN 54 -10.647 8.151 8.539
315 HD21 ASN 54 1HD2 ASN 54 -11.011 5.793 8.835
316 HD22 ASN 54 2HD2 ASN 54 -9.794 4.957 9.809
317 H VAL 55 H VAL 55 -8.119 5.605 6.264
318 HA VAL 55 HA VAL 55 -5.496 6.536 6.730
319 HB VAL 55 HB VAL 55 -6.450 4.193 5.037
320 HG11 VAL 55 1HG1 VAL 55 -4.098 4.754 4.450
321 HG12 VAL 55 2HG1 VAL 55 -3.669 4.712 6.177
322 HG13 VAL 55 3HG1 VAL 55 -4.204 3.246 5.352
323 HG21 VAL 55 3HG2 VAL 55 -5.452 4.344 7.919
324 HG22 VAL 55 1HG2 VAL 55 -7.139 4.110 7.432
325 HG23 VAL 55 2HG2 VAL 55 -5.935 2.870 7.054
326 HA PRO 56 HA PRO 56 -4.932 8.838 2.881
327 HB3 PRO 56 HB2 PRO 56 -3.445 10.148 4.030
328 HG3 PRO 56 HG2 PRO 56 -1.929 9.219 5.649
329 HD3 PRO 56 HD2 PRO 56 -4.124 8.574 6.306
330 H ILE 57 H ILE 57 -5.523 7.120 1.559
331 HA ILE 57 HA ILE 57 -3.887 5.027 0.527
332 HB ILE 57 HB ILE 57 -5.292 5.011 -1.351
333 HG13 ILE 57 2HG1 ILE 57 -7.045 6.591 -1.873
334 HG21 ILE 57 1HG2 ILE 57 -7.475 4.751 -0.297
335 HG22 ILE 57 2HG2 ILE 57 -6.192 4.179 0.790
336 HG23 ILE 57 3HG2 ILE 57 -6.962 5.739 1.081
337 HD11 ILE 57 3HD1 ILE 57 -7.293 7.836 0.298
338 HD12 ILE 57 1HD1 ILE 57 -5.723 8.618 -0.024
339 HD13 ILE 57 2HD1 ILE 57 -7.081 8.868 -1.120
340 H ARG 58 H ARG 58 -2.392 4.939 -1.093
341 HA ARG 58 HA ARG 58 -0.742 7.224 -1.479
342 HB3 ARG 58 HB2 ARG 58 -0.571 4.704 -3.151
343 HG3 ARG 58 HG2 ARG 58 1.824 4.941 -2.687
344 HD3 ARG 58 HD2 ARG 58 0.611 7.499 -3.755
345 HE ARG 58 HE ARG 58 3.203 7.169 -3.287
346 HH11 ARG 58 2HH2 ARG 58 1.081 8.050 -5.915
347 HH12 ARG 58 1HH2 ARG 58 2.362 8.865 -6.820
348 HH21 ARG 58 1HH1 ARG 58 4.873 8.283 -4.518
349 HH22 ARG 58 2HH1 ARG 58 4.300 9.216 -5.897
350 H VAL 59 H VAL 59 -1.771 8.939 -2.622
351 HA VAL 59 HA VAL 59 -3.528 8.350 -4.851
352 HB VAL 59 HB VAL 59 -3.654 10.730 -5.255
353 HG11 VAL 59 1HG1 VAL 59 -4.660 11.384 -3.142
354 HG12 VAL 59 2HG1 VAL 59 -5.024 9.682 -3.475
355 HG13 VAL 59 3HG1 VAL 59 -3.785 10.109 -2.277
356 HG21 VAL 59 3HG2 VAL 59 -2.516 12.401 -3.976
357 HG22 VAL 59 1HG2 VAL 59 -1.654 11.193 -3.025
358 HG23 VAL 59 2HG2 VAL 59 -1.290 11.398 -4.757
359 HA PRO 60 HA PRO 60 -0.451 7.603 -7.792
360 HB3 PRO 60 HB2 PRO 60 -2.216 6.702 -8.967
361 HG3 PRO 60 HG2 PRO 60 -4.239 7.951 -9.380
362 HD3 PRO 60 HD2 PRO 60 -3.908 7.721 -7.041
363 H GLY 61 H GLY 61 0.447 9.896 -6.768
364 HA2 GLY 61 HA2 GLY 61 1.898 10.898 -9.102
365 HA3 GLY 61 HA3 GLY 61 0.938 12.131 -8.276
366 H LYS 62 H LYS 62 1.876 13.114 -6.610
367 HA LYS 62 HA LYS 62 4.601 13.016 -6.182
368 HB3 LYS 62 HB2 LYS 62 2.386 14.193 -4.448
369 HG3 LYS 62 HG2 LYS 62 4.603 14.570 -3.380
370 HD3 LYS 62 HD2 LYS 62 5.179 16.226 -5.890
371 HE3 LYS 62 HE2 LYS 62 7.367 16.632 -4.895
372 HZ1 LYS 62 HZ3 LYS 62 5.518 18.055 -4.082
373 HZ2 LYS 62 HZ1 LYS 62 5.431 17.114 -2.719
374 HZ3 LYS 62 HZ2 LYS 62 6.798 17.948 -3.055
375 H CYS 63 H CYS 63 5.775 12.859 -4.035
376 HA CYS 63 HA CYS 63 4.614 11.430 -1.837
377 HB3 CYS 63 HB2 CYS 63 6.437 10.096 -3.779
378 H HIS 64 H HIS 64 5.905 11.967 0.064
379 HA HIS 64 HA HIS 64 8.214 13.841 -0.354
380 HB3 HIS 64 HB2 HIS 64 7.462 14.887 1.794
381 HD1 HIS 64 HD1 HIS 64 6.642 17.290 1.467
382 HD2 HIS 64 HD2 HIS 64 4.918 14.535 -1.186
383 HE1 HIS 64 HE1 HIS 64 5.194 18.631 -0.146
Start of MODEL 15
1 H1 VAL 1 H VAL 1 -15.567 0.492 3.486
2 HA VAL 1 HA VAL 1 -12.993 0.690 4.572
3 HB VAL 1 HB VAL 1 -12.478 -1.774 4.607
4 HG11 VAL 1 1HG1 VAL 1 -12.727 -0.510 6.688
5 HG12 VAL 1 2HG1 VAL 1 -14.480 -0.808 6.691
6 HG13 VAL 1 3HG1 VAL 1 -13.345 -2.158 6.880
7 HG21 VAL 1 3HG2 VAL 1 -14.284 -3.393 4.932
8 HG22 VAL 1 1HG2 VAL 1 -15.510 -2.131 4.734
9 HG23 VAL 1 2HG2 VAL 1 -14.478 -2.597 3.363
10 H ARG 2 H ARG 2 -11.413 -0.364 2.976
11 HA ARG 2 HA ARG 2 -12.509 -0.435 0.198
12 HB3 ARG 2 HB2 ARG 2 -11.729 1.902 1.137
13 HG3 ARG 2 HG2 ARG 2 -9.033 1.077 0.128
14 HD3 ARG 2 HD2 ARG 2 -8.115 2.538 1.669
15 HE ARG 2 HE ARG 2 -10.711 3.838 0.788
16 HH11 ARG 2 2HH2 ARG 2 -7.456 4.290 2.059
17 HH12 ARG 2 1HH2 ARG 2 -7.653 5.992 2.232
18 HH21 ARG 2 1HH1 ARG 2 -10.855 5.934 0.712
19 HH22 ARG 2 2HH1 ARG 2 -9.778 6.857 1.666
20 H ASP 3 H ASP 3 -10.532 -0.911 -1.323
21 HA ASP 3 HA ASP 3 -8.292 -2.285 0.064
22 HB3 ASP 3 HB2 ASP 3 -7.940 -3.705 -1.880
23 H ALA 4 H ALA 4 -6.314 -1.317 -0.560
24 HA ALA 4 HA ALA 4 -6.245 0.601 -2.775
25 HB1 ALA 4 HB3 ALA 4 -5.831 2.555 -1.290
26 HB2 ALA 4 HB1 ALA 4 -7.491 1.965 -1.217
27 HB3 ALA 4 HB2 ALA 4 -6.349 1.580 0.101
28 H TYR 5 H TYR 5 -4.153 1.921 -2.628
29 HA TYR 5 HA TYR 5 -1.931 0.067 -2.012
30 HB3 TYR 5 HB2 TYR 5 -0.599 1.906 -3.077
31 HD1 TYR 5 HD2 TYR 5 -0.167 -0.457 -3.947
32 HD2 TYR 5 HD1 TYR 5 -3.335 2.027 -5.465
33 HE1 TYR 5 HE2 TYR 5 0.242 -1.335 -6.235
34 HE2 TYR 5 HE1 TYR 5 -2.943 1.144 -7.732
35 HH TYR 5 HH TYR 5 0.099 -0.587 -8.464
36 H ILE 6 H ILE 6 -1.162 0.192 0.091
37 HA ILE 6 HA ILE 6 -2.089 2.322 1.762
38 HB ILE 6 HB ILE 6 -1.622 0.042 2.483
39 HG13 ILE 6 2HG1 ILE 6 -1.784 2.051 4.020
40 HG21 ILE 6 1HG2 ILE 6 0.578 -0.301 1.308
41 HG22 ILE 6 2HG2 ILE 6 1.343 0.809 2.460
42 HG23 ILE 6 3HG2 ILE 6 0.662 -0.724 3.019
43 HD11 ILE 6 3HD1 ILE 6 -0.149 -0.276 5.089
44 HD12 ILE 6 1HD1 ILE 6 -1.237 0.812 5.979
45 HD13 ILE 6 2HD1 ILE 6 -1.903 -0.316 4.783
46 H ALA 7 H ALA 7 -0.873 3.964 2.869
47 HA ALA 7 HA ALA 7 1.813 4.576 1.840
48 HB1 ALA 7 HB3 ALA 7 -0.511 6.549 1.692
49 HB2 ALA 7 HB1 ALA 7 1.198 6.916 1.368
50 HB3 ALA 7 HB2 ALA 7 0.325 5.793 0.316
51 H GLN 8 H GLN 8 2.831 6.281 3.084
52 HA GLN 8 HA GLN 8 1.815 6.764 5.826
53 HB3 GLN 8 HB2 GLN 8 3.223 4.836 6.144
54 HG3 GLN 8 HG2 GLN 8 5.123 6.205 4.202
55 HE21 GLN 8 1HE2 GLN 8 6.868 4.394 3.559
56 HE22 GLN 8 2HE2 GLN 8 7.829 3.917 4.955
57 H ASN 9 H ASN 9 3.305 8.387 6.879
58 HA ASN 9 HA ASN 9 3.337 10.864 5.880
59 HB3 ASN 9 HB2 ASN 9 5.185 11.363 7.409
60 HD21 ASN 9 1HD2 ASN 9 3.968 12.273 9.061
61 HD22 ASN 9 2HD2 ASN 9 2.704 11.413 9.922
62 H TYR 10 H TYR 10 5.884 11.145 3.288
63 HA TYR 10 HA TYR 10 2.979 11.383 3.934
64 HB3 TYR 10 HB2 TYR 10 4.018 13.560 2.340
65 HD1 TYR 10 HD1 TYR 10 3.845 13.743 6.034
66 HD2 TYR 10 HD2 TYR 10 1.622 14.078 2.355
67 HE1 TYR 10 HE1 TYR 10 1.933 14.704 7.277
68 HE2 TYR 10 HE2 TYR 10 -0.289 15.049 3.604
69 HH TYR 10 HH TYR 10 -0.222 15.532 7.141
70 H ASN 11 H ASN 11 2.103 10.038 2.630
71 HA ASN 11 HA ASN 11 1.209 9.186 0.806
72 HB3 ASN 11 HB2 ASN 11 2.891 10.759 -1.131
73 HD21 ASN 11 1HD2 ASN 11 1.900 10.945 -3.148
74 HD22 ASN 11 2HD2 ASN 11 0.470 10.026 -3.577
75 H CYS 12 H CYS 12 4.003 8.391 1.946
76 HA CYS 12 HA CYS 12 5.315 7.404 -0.555
77 HB3 CYS 12 HB2 CYS 12 7.236 7.015 0.922
78 H VAL 13 H VAL 13 5.795 5.218 -0.823
79 HA VAL 13 HA VAL 13 4.035 3.326 0.563
80 HB VAL 13 HB VAL 13 5.049 1.657 -0.912
81 HG11 VAL 13 1HG1 VAL 13 4.332 4.169 -2.463
82 HG12 VAL 13 2HG1 VAL 13 4.227 2.493 -3.024
83 HG13 VAL 13 3HG1 VAL 13 3.165 3.052 -1.719
84 HG21 VAL 13 3HG2 VAL 13 7.379 2.531 -1.021
85 HG22 VAL 13 1HG2 VAL 13 6.688 2.230 -2.619
86 HG23 VAL 13 2HG2 VAL 13 6.816 3.889 -2.016
87 H TYR 14 H TYR 14 5.395 1.151 1.083
88 HA TYR 14 HA TYR 14 7.673 1.824 2.903
89 HB3 TYR 14 HB2 TYR 14 7.091 -0.376 3.968
90 HD1 TYR 14 HD1 TYR 14 3.788 1.215 3.387
91 HD2 TYR 14 HD2 TYR 14 7.211 0.903 5.981
92 HE1 TYR 14 HE1 TYR 14 2.352 1.499 5.360
93 HE2 TYR 14 HE2 TYR 14 5.796 1.512 7.909
94 HH TYR 14 HH TYR 14 2.258 1.735 7.686
95 H HIS 15 H HIS 15 9.131 -0.226 3.027
96 HA HIS 15 HA HIS 15 10.146 -0.685 0.359
97 HB3 HIS 15 HB2 HIS 15 10.980 -1.835 3.045
98 HD1 HIS 15 HD1 HIS 15 11.424 -4.059 1.267
99 HD2 HIS 15 HD2 HIS 15 13.827 -0.621 1.013
100 HE1 HIS 15 HE1 HIS 15 13.591 -4.759 0.056
101 H CYS 16 H CYS 16 8.073 -1.660 -0.432
102 HA CYS 16 HA CYS 16 7.277 -4.299 0.256
103 HB3 CYS 16 HB2 CYS 16 7.089 -2.862 -2.390
104 H ALA 17 H ALA 17 9.185 -5.410 0.778
105 HA ALA 17 HA ALA 17 11.096 -6.274 -1.183
106 HB1 ALA 17 HB3 ALA 17 10.101 -7.690 1.328
107 HB2 ALA 17 HB1 ALA 17 11.571 -8.087 0.414
108 HB3 ALA 17 HB2 ALA 17 11.441 -6.525 1.248
109 H ARG 18 H ARG 18 7.816 -7.420 -0.299
110 HA ARG 18 HA ARG 18 7.496 -8.775 -2.760
111 HB3 ARG 18 HB2 ARG 18 7.482 -10.626 -0.323
112 HG3 ARG 18 HG2 ARG 18 6.433 -11.666 -2.266
113 HD3 ARG 18 HD2 ARG 18 8.869 -10.614 -3.766
114 HE ARG 18 HE ARG 18 7.106 -12.460 -5.174
115 HH11 ARG 18 2HH2 ARG 18 10.050 -12.270 -3.260
116 HH12 ARG 18 1HH2 ARG 18 10.816 -13.667 -3.952
117 HH21 ARG 18 1HH1 ARG 18 8.072 -14.343 -6.136
118 HH22 ARG 18 2HH1 ARG 18 9.638 -14.888 -5.626
119 H ASP 19 H ASP 19 5.307 -9.832 -2.877
120 HA ASP 19 HA ASP 19 3.144 -8.664 -1.714
121 HB3 ASP 19 HB2 ASP 19 1.970 -10.729 -2.338
122 H ALA 20 H ALA 20 5.095 -11.343 -0.363
123 HA ALA 20 HA ALA 20 3.429 -11.863 1.897
124 HB1 ALA 20 HB3 ALA 20 5.184 -13.419 1.143
125 HB2 ALA 20 HB1 ALA 20 6.445 -12.243 1.576
126 HB3 ALA 20 HB2 ALA 20 5.429 -12.966 2.841
127 H TYR 21 H TYR 21 6.399 -9.812 1.641
128 HA TYR 21 HA TYR 21 6.338 -8.723 4.268
129 HB3 TYR 21 HB2 TYR 21 7.256 -7.564 1.617
130 HD1 TYR 21 HD1 TYR 21 6.248 -5.296 2.045
131 HD2 TYR 21 HD2 TYR 21 9.097 -7.089 4.740
132 HE1 TYR 21 HE1 TYR 21 6.692 -3.081 3.047
133 HE2 TYR 21 HE2 TYR 21 9.597 -4.861 5.684
134 HH TYR 21 HH TYR 21 9.134 -2.611 5.608
135 H CYS 22 H CYS 22 4.722 -7.695 1.246
136 HA CYS 22 HA CYS 22 3.468 -5.423 2.452
137 HB3 CYS 22 HB2 CYS 22 2.845 -7.118 -0.001
138 H ASN 23 H ASN 23 2.201 -8.780 2.028
139 HA ASN 23 HA ASN 23 -0.379 -8.254 3.137
140 HB3 ASN 23 HB2 ASN 23 1.298 -10.783 3.267
141 HD21 ASN 23 1HD2 ASN 23 0.409 -11.445 5.321
142 HD22 ASN 23 2HD2 ASN 23 -1.297 -11.809 5.476
143 H GLU 24 H GLU 24 2.685 -9.259 4.728
144 HA GLU 24 HA GLU 24 1.841 -9.286 7.393
145 HB3 GLU 24 HB2 GLU 24 4.451 -8.698 5.926
146 HG3 GLU 24 HG2 GLU 24 5.322 -9.347 8.328
147 H LEU 25 H LEU 25 3.378 -6.565 5.661
148 HA LEU 25 HA LEU 25 3.187 -4.566 7.552
149 HB3 LEU 25 HB2 LEU 25 2.792 -4.412 4.532
150 HG LEU 25 HG LEU 25 2.136 -2.265 5.778
151 HD11 LEU 25 1HD1 LEU 25 5.177 -2.169 6.100
152 HD12 LEU 25 2HD1 LEU 25 4.012 -0.891 6.487
153 HD13 LEU 25 3HD1 LEU 25 4.028 -2.377 7.442
154 HD21 LEU 25 3HD2 LEU 25 4.368 -2.252 3.722
155 HD22 LEU 25 1HD2 LEU 25 2.644 -2.493 3.376
156 HD23 LEU 25 2HD2 LEU 25 3.179 -0.962 4.039
157 H CYS 26 H CYS 26 0.799 -5.288 5.037
158 HA CYS 26 HA CYS 26 -1.158 -3.396 5.605
159 HB3 CYS 26 HB2 CYS 26 -2.668 -5.013 4.397
160 H THR 27 H THR 27 -0.987 -6.831 6.821
161 HA THR 27 HA THR 27 -3.226 -6.498 8.571
162 HB THR 27 HB THR 27 -2.191 -8.539 9.734
163 HG1 THR 27 HG1 THR 27 -0.043 -7.937 8.510
164 HG21 THR 27 3HG2 THR 27 -2.762 -8.630 6.738
165 HG22 THR 27 1HG2 THR 27 -2.822 -10.012 7.848
166 HG23 THR 27 2HG2 THR 27 -3.984 -8.684 8.029
167 H LYS 28 H LYS 28 0.204 -5.732 8.995
168 HA LYS 28 HA LYS 28 0.000 -5.244 11.832
169 HB3 LYS 28 HB2 LYS 28 2.151 -3.755 10.617
170 HG3 LYS 28 HG2 LYS 28 1.947 -6.417 12.086
171 HD3 LYS 28 HD2 LYS 28 4.047 -6.543 10.890
172 HE3 LYS 28 HE2 LYS 28 5.878 -4.884 11.683
173 HZ1 LYS 28 HZ3 LYS 28 5.480 -3.432 9.845
174 HZ2 LYS 28 HZ1 LYS 28 5.114 -4.982 9.439
175 HZ3 LYS 28 HZ2 LYS 28 3.910 -3.934 9.725
176 H ASN 29 H ASN 29 -0.773 -3.361 8.971
177 HA ASN 29 HA ASN 29 -0.658 -0.786 10.450
178 HB3 ASN 29 HB2 ASN 29 -1.652 0.024 8.207
179 HD21 ASN 29 1HD2 ASN 29 1.225 -2.152 8.365
180 HD22 ASN 29 2HD2 ASN 29 2.393 -0.845 8.143
181 H GLY 30 H GLY 30 -3.067 -2.859 8.819
182 HA2 GLY 30 HA2 GLY 30 -5.120 -3.008 10.501
183 HA3 GLY 30 HA3 GLY 30 -5.306 -1.311 10.016
184 H ALA 31 H ALA 31 -4.439 -4.357 8.336
185 HA ALA 31 HA ALA 31 -6.703 -3.973 6.400
186 HB1 ALA 31 HB3 ALA 31 -4.083 -5.344 5.894
187 HB2 ALA 31 HB1 ALA 31 -5.200 -4.735 4.673
188 HB3 ALA 31 HB2 ALA 31 -4.228 -3.587 5.614
189 H LYS 32 H LYS 32 -7.350 -6.161 5.408
190 HA LYS 32 HA LYS 32 -7.042 -8.340 7.425
191 HB3 LYS 32 HB2 LYS 32 -9.260 -7.804 6.603
192 HG3 LYS 32 HG2 LYS 32 -8.410 -7.659 4.058
193 HD3 LYS 32 HD2 LYS 32 -7.962 -10.264 4.121
194 HE3 LYS 32 HE2 LYS 32 -11.016 -10.147 3.881
195 HZ1 LYS 32 HZ3 LYS 32 -10.842 -12.510 3.699
196 HZ2 LYS 32 HZ1 LYS 32 -10.021 -11.801 2.463
197 HZ3 LYS 32 HZ2 LYS 32 -9.198 -12.456 3.732
198 H SER 33 H SER 33 -5.628 -7.351 4.379
199 HA SER 33 HA SER 33 -3.599 -9.324 4.497
200 HB3 SER 33 HB2 SER 33 -5.263 -10.959 3.736
201 HG SER 33 HG SER 33 -6.565 -9.075 2.795
202 H GLY 34 H GLY 34 -2.354 -9.310 2.227
203 HA2 GLY 34 HA2 GLY 34 -2.903 -6.908 0.629
204 HA3 GLY 34 HA3 GLY 34 -1.369 -6.912 1.521
205 H SER 35 H SER 35 -1.323 -6.733 -1.192
206 HA SER 35 HA SER 35 0.541 -8.785 -1.670
207 HB3 SER 35 HB2 SER 35 -1.309 -10.103 -2.548
208 HG SER 35 HG SER 35 -2.245 -9.148 -4.590
209 H CYS 36 H CYS 36 1.740 -8.122 -3.816
210 HA CYS 36 HA CYS 36 1.720 -5.116 -3.809
211 HB3 CYS 36 HB2 CYS 36 4.091 -6.948 -3.530
212 HA PRO 37 HA PRO 37 1.689 -7.032 -8.033
213 HB3 PRO 37 HB2 PRO 37 -0.560 -6.679 -8.345
214 HG3 PRO 37 HG2 PRO 37 -1.717 -4.938 -7.157
215 HD3 PRO 37 HD2 PRO 37 -0.552 -6.299 -5.568
216 H TYR 38 H TYR 38 3.203 -6.524 -9.437
217 HA TYR 38 HA TYR 38 4.630 -3.974 -9.583
218 HB3 TYR 38 HB2 TYR 38 5.717 -5.135 -11.534
219 HD1 TYR 38 HD2 TYR 38 5.121 -7.720 -8.907
220 HD2 TYR 38 HD1 TYR 38 7.636 -4.483 -10.240
221 HE1 TYR 38 HE2 TYR 38 6.780 -8.293 -7.169
222 HE2 TYR 38 HE1 TYR 38 9.299 -5.064 -8.501
223 HH TYR 38 HH TYR 38 8.793 -7.725 -6.181
224 H LEU 39 H LEU 39 2.500 -5.916 -11.679
225 HA LEU 39 HA LEU 39 2.063 -3.682 -13.556
226 HB3 LEU 39 HB2 LEU 39 0.782 -5.330 -14.807
227 HG LEU 39 HG LEU 39 3.284 -6.705 -13.695
228 HD11 LEU 39 1HD1 LEU 39 1.735 -7.129 -16.283
229 HD12 LEU 39 2HD1 LEU 39 3.233 -7.957 -15.807
230 HD13 LEU 39 3HD1 LEU 39 1.744 -8.222 -14.882
231 HD21 LEU 39 3HD2 LEU 39 2.929 -4.839 -16.087
232 HD22 LEU 39 1HD2 LEU 39 3.901 -4.518 -14.632
233 HD23 LEU 39 2HD2 LEU 39 4.383 -5.799 -15.749
234 H GLY 40 H GLY 40 1.339 -2.774 -11.149
235 HA2 GLY 40 HA2 GLY 40 -1.581 -3.217 -10.740
236 HA3 GLY 40 HA3 GLY 40 -0.455 -2.370 -9.679
237 H GLU 41 H GLU 41 -2.772 -1.068 -10.255
238 HA GLU 41 HA GLU 41 -2.842 0.463 -12.638
239 HB3 GLU 41 HB2 GLU 41 -4.053 1.137 -9.913
240 HG3 GLU 41 HG2 GLU 41 -5.905 1.882 -11.686
241 H HIS 42 H HIS 42 -1.575 1.290 -9.376
242 HA HIS 42 HA HIS 42 -0.204 3.707 -10.427
243 HB3 HIS 42 HB2 HIS 42 0.523 4.049 -8.145
244 HD1 HIS 42 HD1 HIS 42 -2.704 4.202 -9.715
245 HD2 HIS 42 HD2 HIS 42 -1.312 4.035 -5.735
246 HE1 HIS 42 HE1 HIS 42 -4.540 5.163 -8.253
247 H LYS 43 H LYS 43 0.477 1.017 -11.545
248 HA LYS 43 HA LYS 43 2.086 -0.469 -11.803
249 HB3 LYS 43 HB2 LYS 43 4.178 1.603 -11.078
250 HG3 LYS 43 HG2 LYS 43 3.782 -0.296 -13.443
251 HD3 LYS 43 HD2 LYS 43 6.324 1.117 -12.487
252 HE3 LYS 43 HE2 LYS 43 7.152 0.593 -14.750
253 HZ1 LYS 43 HZ3 LYS 43 6.002 -1.847 -13.561
254 HZ2 LYS 43 HZ1 LYS 43 7.240 -1.786 -14.638
255 HZ3 LYS 43 HZ2 LYS 43 7.441 -1.168 -13.128
256 H PHE 44 H PHE 44 4.718 0.019 -10.000
257 HA PHE 44 HA PHE 44 4.004 -2.261 -8.447
258 HB3 PHE 44 HB2 PHE 44 6.552 -0.661 -8.574
259 HD1 PHE 44 HD2 PHE 44 5.045 -3.950 -7.368
260 HD2 PHE 44 HD1 PHE 44 8.492 -1.326 -7.392
261 HE1 PHE 44 HE2 PHE 44 6.170 -5.400 -5.765
262 HE2 PHE 44 HE1 PHE 44 9.543 -2.732 -5.649
263 HZ PHE 44 HZ PHE 44 8.383 -4.761 -4.814
264 H ALA 45 H ALA 45 2.872 -2.131 -6.560
265 HA ALA 45 HA ALA 45 4.127 -0.811 -4.359
266 HB1 ALA 45 HB3 ALA 45 2.163 0.782 -3.818
267 HB2 ALA 45 HB1 ALA 45 3.290 1.295 -5.073
268 HB3 ALA 45 HB2 ALA 45 1.726 0.629 -5.534
269 H CYS 46 H CYS 46 2.774 -0.924 -2.347
270 HA CYS 46 HA CYS 46 1.792 -3.655 -2.151
271 HB3 CYS 46 HB2 CYS 46 2.377 -1.490 -0.130
272 H TYR 47 H TYR 47 -0.254 -3.993 -2.832
273 HA TYR 47 HA TYR 47 -2.395 -2.042 -2.294
274 HB3 TYR 47 HB2 TYR 47 -2.536 -4.602 -3.897
275 HD1 TYR 47 HD1 TYR 47 -3.593 -1.049 -4.414
276 HD2 TYR 47 HD2 TYR 47 -4.926 -5.082 -3.732
277 HE1 TYR 47 HE1 TYR 47 -5.924 -0.362 -4.890
278 HE2 TYR 47 HE2 TYR 47 -7.255 -4.389 -4.193
279 HH TYR 47 HH TYR 47 -8.271 -1.154 -4.187
280 H CYS 48 H CYS 48 -3.036 -2.188 -0.243
281 HA CYS 48 HA CYS 48 -3.281 -4.749 1.198
282 HB3 CYS 48 HB2 CYS 48 -3.946 -3.340 3.063
283 H LYS 49 H LYS 49 -5.285 -5.418 2.117
284 HA LYS 49 HA LYS 49 -7.679 -4.489 0.630
285 HB3 LYS 49 HB2 LYS 49 -8.569 -6.785 1.099
286 HG3 LYS 49 HG2 LYS 49 -7.646 -6.273 -1.157
287 HD3 LYS 49 HD2 LYS 49 -5.171 -7.579 0.047
288 HE3 LYS 49 HE2 LYS 49 -5.862 -7.013 -2.881
289 HZ1 LYS 49 HZ3 LYS 49 -3.340 -7.975 -1.714
290 HZ2 LYS 49 HZ1 LYS 49 -3.537 -7.708 -3.272
291 HZ3 LYS 49 HZ2 LYS 49 -3.545 -6.435 -2.209
292 H ASP 50 H ASP 50 -9.476 -4.017 1.828
293 HA ASP 50 HA ASP 50 -10.810 -3.570 3.577
294 HB3 ASP 50 HB2 ASP 50 -9.251 -5.449 5.380
295 H LEU 51 H LEU 51 -9.128 -1.675 3.160
296 HA LEU 51 HA LEU 51 -7.821 -0.804 5.685
297 HB3 LEU 51 HB2 LEU 51 -7.597 1.266 3.822
298 HG LEU 51 HG LEU 51 -5.700 0.519 5.118
299 HD11 LEU 51 1HD1 LEU 51 -5.839 -1.993 3.412
300 HD12 LEU 51 2HD1 LEU 51 -4.449 -1.528 4.442
301 HD13 LEU 51 3HD1 LEU 51 -6.008 -1.896 5.172
302 HD21 LEU 51 3HD2 LEU 51 -3.984 0.600 3.345
303 HD22 LEU 51 1HD2 LEU 51 -5.193 0.155 2.123
304 HD23 LEU 51 2HD2 LEU 51 -5.299 1.718 2.949
305 HA PRO 52 HA PRO 52 -11.501 1.647 6.556
306 HB3 PRO 52 HB2 PRO 52 -10.813 1.576 8.774
307 HG3 PRO 52 HG2 PRO 52 -8.502 1.772 9.378
308 HD3 PRO 52 HD2 PRO 52 -8.588 -0.035 7.851
309 H ASP 53 H ASP 53 -12.276 3.364 5.392
310 HA ASP 53 HA ASP 53 -10.713 4.242 3.376
311 HB3 ASP 53 HB2 ASP 53 -13.262 5.661 4.158
312 H ASN 54 H ASN 54 -11.074 5.909 6.378
313 HA ASN 54 HA ASN 54 -10.226 8.512 5.737
314 HB3 ASN 54 HB2 ASN 54 -9.627 6.835 8.207
315 HD21 ASN 54 1HD2 ASN 54 -7.946 7.820 9.332
316 HD22 ASN 54 2HD2 ASN 54 -7.809 9.564 9.485
317 H VAL 55 H VAL 55 -8.252 5.537 5.918
318 HA VAL 55 HA VAL 55 -5.793 6.820 6.464
319 HB VAL 55 HB VAL 55 -6.409 4.374 6.667
320 HG11 VAL 55 1HG1 VAL 55 -7.244 4.123 4.275
321 HG12 VAL 55 2HG1 VAL 55 -5.547 4.147 3.756
322 HG13 VAL 55 3HG1 VAL 55 -6.128 2.877 4.850
323 HG21 VAL 55 3HG2 VAL 55 -4.094 5.109 7.017
324 HG22 VAL 55 1HG2 VAL 55 -4.177 3.504 6.281
325 HG23 VAL 55 2HG2 VAL 55 -3.757 4.901 5.277
326 HA PRO 56 HA PRO 56 -4.914 8.591 2.409
327 HB3 PRO 56 HB2 PRO 56 -3.226 9.848 3.326
328 HG3 PRO 56 HG2 PRO 56 -1.844 8.981 5.089
329 HD3 PRO 56 HD2 PRO 56 -4.137 8.763 5.747
330 H ILE 57 H ILE 57 -4.867 7.605 0.457
331 HA ILE 57 HA ILE 57 -3.620 4.940 0.054
332 HB ILE 57 HB ILE 57 -4.584 4.955 -2.084
333 HG13 ILE 57 2HG1 ILE 57 -4.229 7.264 -2.800
334 HG21 ILE 57 1HG2 ILE 57 -6.723 6.146 -0.291
335 HG22 ILE 57 2HG2 ILE 57 -6.902 4.870 -1.511
336 HG23 ILE 57 3HG2 ILE 57 -6.021 4.536 -0.013
337 HD11 ILE 57 3HD1 ILE 57 -7.210 6.701 -2.878
338 HD12 ILE 57 1HD1 ILE 57 -6.257 7.687 -3.993
339 HD13 ILE 57 2HD1 ILE 57 -6.003 5.932 -3.940
340 H ARG 58 H ARG 58 -1.910 4.759 -1.552
341 HA ARG 58 HA ARG 58 -0.003 6.931 -1.721
342 HB3 ARG 58 HB2 ARG 58 -0.347 4.298 -3.217
343 HG3 ARG 58 HG2 ARG 58 1.051 5.677 -4.682
344 HD3 ARG 58 HD2 ARG 58 2.777 6.024 -2.204
345 HE ARG 58 HE ARG 58 4.204 5.919 -4.146
346 HH11 ARG 58 2HH2 ARG 58 2.003 8.745 -4.374
347 HH12 ARG 58 1HH2 ARG 58 3.344 9.849 -4.514
348 HH21 ARG 58 1HH1 ARG 58 5.766 7.374 -5.148
349 HH22 ARG 58 2HH1 ARG 58 5.216 8.994 -5.542
350 H VAL 59 H VAL 59 -1.250 8.797 -2.617
351 HA VAL 59 HA VAL 59 -2.666 8.337 -5.109
352 HB VAL 59 HB VAL 59 -2.870 10.693 -5.437
353 HG11 VAL 59 1HG1 VAL 59 -3.469 9.835 -2.577
354 HG12 VAL 59 2HG1 VAL 59 -4.256 11.151 -3.467
355 HG13 VAL 59 3HG1 VAL 59 -4.457 9.479 -4.011
356 HG21 VAL 59 3HG2 VAL 59 -1.364 11.184 -2.858
357 HG22 VAL 59 1HG2 VAL 59 -0.717 11.531 -4.494
358 HG23 VAL 59 2HG2 VAL 59 -2.151 12.371 -3.897
359 HA PRO 60 HA PRO 60 0.808 7.528 -7.409
360 HB3 PRO 60 HB2 PRO 60 -0.681 6.501 -8.811
361 HG3 PRO 60 HG2 PRO 60 -2.679 7.600 -9.566
362 HD3 PRO 60 HD2 PRO 60 -2.648 7.527 -7.196
363 H GLY 61 H GLY 61 1.933 9.517 -6.550
364 HA2 GLY 61 HA2 GLY 61 3.666 10.285 -8.599
365 HA3 GLY 61 HA3 GLY 61 2.571 11.662 -8.406
366 H LYS 62 H LYS 62 2.831 13.000 -6.703
367 HA LYS 62 HA LYS 62 5.230 13.464 -5.488
368 HB3 LYS 62 HB2 LYS 62 2.552 14.066 -4.169
369 HG3 LYS 62 HG2 LYS 62 4.901 15.935 -4.656
370 HD3 LYS 62 HD2 LYS 62 2.656 16.112 -2.590
371 HE3 LYS 62 HE2 LYS 62 2.989 18.509 -2.692
372 HZ1 LYS 62 HZ3 LYS 62 5.704 17.387 -2.633
373 HZ2 LYS 62 HZ1 LYS 62 5.165 18.739 -1.874
374 HZ3 LYS 62 HZ2 LYS 62 4.678 17.250 -1.363
375 H CYS 63 H CYS 63 6.225 12.964 -3.425
376 HA CYS 63 HA CYS 63 4.780 11.856 -1.268
377 HB3 CYS 63 HB2 CYS 63 6.016 9.935 -3.116
378 H HIS 64 H HIS 64 6.199 12.160 0.645
379 HA HIS 64 HA HIS 64 9.072 12.450 0.297
380 HB3 HIS 64 HB2 HIS 64 8.809 14.656 -0.357
381 HD1 HIS 64 HD1 HIS 64 6.408 15.168 2.663
382 HD2 HIS 64 HD2 HIS 64 6.638 15.414 -1.518
383 HE1 HIS 64 HE1 HIS 64 4.251 16.299 1.883
Start of MODEL 16
1 H1 VAL 1 H VAL 1 -15.673 0.928 3.434
2 HA VAL 1 HA VAL 1 -13.076 0.572 4.316
3 HB VAL 1 HB VAL 1 -12.885 -1.905 4.221
4 HG11 VAL 1 1HG1 VAL 1 -12.948 -0.735 6.381
5 HG12 VAL 1 2HG1 VAL 1 -14.717 -0.904 6.435
6 HG13 VAL 1 3HG1 VAL 1 -13.681 -2.345 6.483
7 HG21 VAL 1 3HG2 VAL 1 -14.849 -3.329 4.514
8 HG22 VAL 1 1HG2 VAL 1 -15.932 -1.927 4.413
9 HG23 VAL 1 2HG2 VAL 1 -14.983 -2.429 2.995
10 H ARG 2 H ARG 2 -11.949 -1.012 2.526
11 HA ARG 2 HA ARG 2 -12.931 -0.876 -0.150
12 HB3 ARG 2 HB2 ARG 2 -12.673 1.597 0.204
13 HG3 ARG 2 HG2 ARG 2 -9.878 0.782 1.116
14 HD3 ARG 2 HD2 ARG 2 -10.904 3.610 1.042
15 HE ARG 2 HE ARG 2 -8.839 2.193 2.382
16 HH11 ARG 2 2HH2 ARG 2 -9.613 5.419 1.271
17 HH12 ARG 2 1HH2 ARG 2 -8.297 6.106 2.077
18 HH21 ARG 2 1HH1 ARG 2 -7.504 3.398 3.782
19 HH22 ARG 2 2HH1 ARG 2 -6.752 4.842 3.182
20 H ASP 3 H ASP 3 -10.776 -1.091 -1.555
21 HA ASP 3 HA ASP 3 -8.550 -2.369 -0.023
22 HB3 ASP 3 HB2 ASP 3 -7.966 -3.504 -2.121
23 H ALA 4 H ALA 4 -6.435 -1.492 -0.751
24 HA ALA 4 HA ALA 4 -6.421 0.739 -2.615
25 HB1 ALA 4 HB3 ALA 4 -6.004 2.499 -0.921
26 HB2 ALA 4 HB1 ALA 4 -7.650 1.863 -0.809
27 HB3 ALA 4 HB2 ALA 4 -6.424 1.351 0.368
28 H TYR 5 H TYR 5 -4.371 1.981 -2.546
29 HA TYR 5 HA TYR 5 -2.150 0.069 -2.383
30 HB3 TYR 5 HB2 TYR 5 -0.963 1.826 -3.629
31 HD1 TYR 5 HD1 TYR 5 -1.286 -0.411 -4.901
32 HD2 TYR 5 HD2 TYR 5 -4.098 2.855 -5.087
33 HE1 TYR 5 HE1 TYR 5 -2.141 -1.248 -7.082
34 HE2 TYR 5 HE2 TYR 5 -5.001 1.960 -7.202
35 HH TYR 5 HH TYR 5 -4.805 0.322 -8.835
36 H ILE 6 H ILE 6 -1.656 0.000 -0.006
37 HA ILE 6 HA ILE 6 -1.979 2.333 1.532
38 HB ILE 6 HB ILE 6 -1.978 0.074 2.427
39 HG13 ILE 6 2HG1 ILE 6 -1.702 2.114 3.814
40 HG21 ILE 6 1HG2 ILE 6 -0.083 -0.947 1.281
41 HG22 ILE 6 2HG2 ILE 6 1.066 0.130 2.087
42 HG23 ILE 6 3HG2 ILE 6 0.191 -1.075 3.014
43 HD11 ILE 6 3HD1 ILE 6 -1.929 -0.227 4.745
44 HD12 ILE 6 1HD1 ILE 6 -0.171 -0.199 5.016
45 HD13 ILE 6 2HD1 ILE 6 -1.203 0.992 5.828
46 H ALA 7 H ALA 7 -0.639 3.932 2.303
47 HA ALA 7 HA ALA 7 2.109 4.096 1.118
48 HB1 ALA 7 HB3 ALA 7 1.754 6.508 0.969
49 HB2 ALA 7 HB1 ALA 7 0.569 5.630 -0.012
50 HB3 ALA 7 HB2 ALA 7 0.092 6.328 1.553
51 H GLN 8 H GLN 8 3.453 5.672 2.271
52 HA GLN 8 HA GLN 8 3.406 5.360 5.209
53 HB3 GLN 8 HB2 GLN 8 5.763 6.145 4.954
54 HG3 GLN 8 HG2 GLN 8 5.134 3.867 3.031
55 HE21 GLN 8 1HE2 GLN 8 7.113 3.884 1.748
56 HE22 GLN 8 2HE2 GLN 8 8.676 3.876 2.530
57 H ASN 9 H ASN 9 4.420 7.351 6.278
58 HA ASN 9 HA ASN 9 3.221 9.943 5.584
59 HB3 ASN 9 HB2 ASN 9 5.266 9.018 7.626
60 HD21 ASN 9 1HD2 ASN 9 6.648 10.848 6.716
61 HD22 ASN 9 2HD2 ASN 9 6.323 12.452 7.390
62 H TYR 10 H TYR 10 6.010 10.530 3.219
63 HA TYR 10 HA TYR 10 3.050 10.685 3.651
64 HB3 TYR 10 HB2 TYR 10 3.469 12.860 2.296
65 HD1 TYR 10 HD2 TYR 10 1.551 12.770 4.041
66 HD2 TYR 10 HD1 TYR 10 5.651 13.695 5.006
67 HE1 TYR 10 HE2 TYR 10 0.804 13.939 6.086
68 HE2 TYR 10 HE1 TYR 10 4.887 14.931 7.023
69 HH TYR 10 HH TYR 10 1.448 15.127 7.953
70 H ASN 11 H ASN 11 2.360 9.196 2.285
71 HA ASN 11 HA ASN 11 1.308 8.748 0.389
72 HB3 ASN 11 HB2 ASN 11 2.897 10.651 -1.295
73 HD21 ASN 11 1HD2 ASN 11 1.418 11.845 -2.815
74 HD22 ASN 11 2HD2 ASN 11 0.101 10.895 -3.494
75 H CYS 12 H CYS 12 4.346 7.951 0.969
76 HA CYS 12 HA CYS 12 5.142 7.008 -1.733
77 HB3 CYS 12 HB2 CYS 12 7.279 6.544 -0.677
78 H VAL 13 H VAL 13 5.231 4.813 -2.220
79 HA VAL 13 HA VAL 13 3.803 2.924 -0.513
80 HB VAL 13 HB VAL 13 4.661 1.259 -2.283
81 HG11 VAL 13 1HG1 VAL 13 2.424 1.932 -2.386
82 HG12 VAL 13 2HG1 VAL 13 2.832 3.591 -2.823
83 HG13 VAL 13 3HG1 VAL 13 3.055 2.287 -4.010
84 HG21 VAL 13 3HG2 VAL 13 5.372 3.754 -3.868
85 HG22 VAL 13 1HG2 VAL 13 6.585 2.759 -3.025
86 HG23 VAL 13 2HG2 VAL 13 5.585 2.059 -4.299
87 H TYR 14 H TYR 14 4.986 0.680 -0.265
88 HA TYR 14 HA TYR 14 7.362 1.194 1.447
89 HB3 TYR 14 HB2 TYR 14 6.752 -0.986 2.439
90 HD1 TYR 14 HD2 TYR 14 3.480 0.568 1.474
91 HD2 TYR 14 HD1 TYR 14 6.603 0.347 4.441
92 HE1 TYR 14 HE2 TYR 14 2.155 1.983 2.998
93 HE2 TYR 14 HE1 TYR 14 5.158 1.580 6.032
94 HH TYR 14 HH TYR 14 2.082 3.080 5.059
95 H HIS 15 H HIS 15 9.102 -0.357 1.365
96 HA HIS 15 HA HIS 15 9.870 -1.085 -1.338
97 HB3 HIS 15 HB2 HIS 15 11.939 -1.814 -0.285
98 HD1 HIS 15 HD1 HIS 15 12.583 0.218 2.377
99 HD2 HIS 15 HD2 HIS 15 10.979 1.071 -1.422
100 HE1 HIS 15 HE1 HIS 15 12.980 2.703 1.949
101 H CYS 16 H CYS 16 7.906 -2.442 -1.648
102 HA CYS 16 HA CYS 16 7.485 -4.771 -0.170
103 HB3 CYS 16 HB2 CYS 16 6.547 -4.256 -2.999
104 H ALA 17 H ALA 17 9.606 -5.648 0.066
105 HA ALA 17 HA ALA 17 11.043 -7.134 -1.794
106 HB1 ALA 17 HB3 ALA 17 10.318 -7.930 1.062
107 HB2 ALA 17 HB1 ALA 17 11.654 -8.599 0.100
108 HB3 ALA 17 HB2 ALA 17 11.674 -6.889 0.575
109 H ARG 18 H ARG 18 7.941 -8.044 -0.201
110 HA ARG 18 HA ARG 18 7.238 -9.653 -2.446
111 HB3 ARG 18 HB2 ARG 18 6.981 -11.327 0.005
112 HG3 ARG 18 HG2 ARG 18 6.491 -12.114 -2.343
113 HD3 ARG 18 HD2 ARG 18 9.543 -11.985 -2.513
114 HE ARG 18 HE ARG 18 7.827 -13.817 -3.817
115 HH11 ARG 18 2HH2 ARG 18 10.221 -11.376 -4.633
116 HH12 ARG 18 1HH2 ARG 18 10.769 -12.129 -6.099
117 HH21 ARG 18 1HH1 ARG 18 8.512 -14.883 -5.774
118 HH22 ARG 18 2HH1 ARG 18 9.757 -14.192 -6.762
119 H ASP 19 H ASP 19 5.027 -10.162 -2.529
120 HA ASP 19 HA ASP 19 3.087 -8.671 -1.456
121 HB3 ASP 19 HB2 ASP 19 1.616 -10.623 -1.838
122 H ALA 20 H ALA 20 4.205 -11.736 0.019
123 HA ALA 20 HA ALA 20 2.593 -11.742 2.295
124 HB1 ALA 20 HB3 ALA 20 5.461 -12.754 2.042
125 HB2 ALA 20 HB1 ALA 20 4.287 -13.231 3.288
126 HB3 ALA 20 HB2 ALA 20 3.989 -13.643 1.588
127 H TYR 21 H TYR 21 5.844 -10.200 1.996
128 HA TYR 21 HA TYR 21 6.033 -9.272 4.700
129 HB3 TYR 21 HB2 TYR 21 7.270 -8.542 2.059
130 HD1 TYR 21 HD2 TYR 21 8.055 -7.276 5.498
131 HD2 TYR 21 HD1 TYR 21 6.946 -6.277 1.462
132 HE1 TYR 21 HE2 TYR 21 8.265 -4.871 6.036
133 HE2 TYR 21 HE1 TYR 21 7.128 -3.858 2.011
134 HH TYR 21 HH TYR 21 8.038 -2.713 5.262
135 H CYS 22 H CYS 22 4.766 -7.665 1.755
136 HA CYS 22 HA CYS 22 3.927 -5.423 3.379
137 HB3 CYS 22 HB2 CYS 22 2.594 -5.637 0.758
138 H ASN 23 H ASN 23 2.376 -8.440 2.553
139 HA ASN 23 HA ASN 23 -0.299 -7.796 3.352
140 HB3 ASN 23 HB2 ASN 23 1.115 -10.118 2.461
141 HD21 ASN 23 1HD2 ASN 23 -1.200 -9.889 5.295
142 HD22 ASN 23 2HD2 ASN 23 -0.815 -11.522 5.815
143 H GLU 24 H GLU 24 2.600 -9.025 5.166
144 HA GLU 24 HA GLU 24 1.361 -9.142 7.702
145 HB3 GLU 24 HB2 GLU 24 4.256 -8.581 6.877
146 HG3 GLU 24 HG2 GLU 24 3.020 -9.077 9.586
147 H LEU 25 H LEU 25 3.198 -6.492 6.120
148 HA LEU 25 HA LEU 25 2.807 -4.505 8.020
149 HB3 LEU 25 HB2 LEU 25 2.754 -4.005 5.001
150 HG LEU 25 HG LEU 25 3.248 -2.311 7.434
151 HD11 LEU 25 1HD1 LEU 25 4.812 -0.922 6.284
152 HD12 LEU 25 2HD1 LEU 25 5.478 -2.554 6.300
153 HD13 LEU 25 3HD1 LEU 25 4.722 -1.928 4.809
154 HD21 LEU 25 3HD2 LEU 25 2.331 -1.666 4.580
155 HD22 LEU 25 1HD2 LEU 25 1.236 -1.933 5.945
156 HD23 LEU 25 2HD2 LEU 25 2.339 -0.551 5.959
157 H CYS 26 H CYS 26 0.548 -5.277 5.343
158 HA CYS 26 HA CYS 26 -1.445 -3.373 5.849
159 HB3 CYS 26 HB2 CYS 26 -2.988 -5.036 4.769
160 H THR 27 H THR 27 -1.205 -6.758 7.133
161 HA THR 27 HA THR 27 -3.498 -6.450 8.849
162 HB THR 27 HB THR 27 -2.710 -8.474 9.987
163 HG1 THR 27 HG1 THR 27 -0.358 -7.906 8.609
164 HG21 THR 27 3HG2 THR 27 -2.547 -8.622 6.949
165 HG22 THR 27 1HG2 THR 27 -2.834 -9.981 8.050
166 HG23 THR 27 2HG2 THR 27 -4.024 -8.672 7.930
167 H LYS 28 H LYS 28 -0.105 -5.594 9.307
168 HA LYS 28 HA LYS 28 -0.289 -5.178 12.129
169 HB3 LYS 28 HB2 LYS 28 1.931 -3.780 11.171
170 HG3 LYS 28 HG2 LYS 28 3.015 -6.201 11.117
171 HD3 LYS 28 HD2 LYS 28 3.467 -4.697 12.984
172 HE3 LYS 28 HE2 LYS 28 2.144 -5.270 15.147
173 HZ1 LYS 28 HZ3 LYS 28 0.732 -3.470 13.279
174 HZ2 LYS 28 HZ1 LYS 28 0.650 -3.485 14.900
175 HZ3 LYS 28 HZ2 LYS 28 2.058 -3.076 14.164
176 H ASN 29 H ASN 29 -1.103 -3.273 9.293
177 HA ASN 29 HA ASN 29 -1.196 -0.736 10.846
178 HB3 ASN 29 HB2 ASN 29 -2.278 0.041 8.628
179 HD21 ASN 29 1HD2 ASN 29 0.768 -1.909 8.511
180 HD22 ASN 29 2HD2 ASN 29 1.808 -0.491 8.371
181 H GLY 30 H GLY 30 -3.414 -2.896 9.062
182 HA2 GLY 30 HA2 GLY 30 -5.358 -3.540 10.683
183 HA3 GLY 30 HA3 GLY 30 -5.760 -1.818 10.554
184 H ALA 31 H ALA 31 -4.628 -4.305 8.205
185 HA ALA 31 HA ALA 31 -7.159 -3.982 6.654
186 HB1 ALA 31 HB3 ALA 31 -4.384 -3.469 5.782
187 HB2 ALA 31 HB1 ALA 31 -5.211 -4.685 4.792
188 HB3 ALA 31 HB2 ALA 31 -5.927 -3.085 4.996
189 H LYS 32 H LYS 32 -7.460 -5.955 5.165
190 HA LYS 32 HA LYS 32 -7.494 -8.197 6.953
191 HB3 LYS 32 HB2 LYS 32 -8.152 -7.969 3.986
192 HG3 LYS 32 HG2 LYS 32 -7.934 -10.368 4.598
193 HD3 LYS 32 HD2 LYS 32 -9.901 -9.528 6.779
194 HE3 LYS 32 HE2 LYS 32 -9.110 -12.352 5.901
195 HZ1 LYS 32 HZ3 LYS 32 -10.970 -11.447 8.004
196 HZ2 LYS 32 HZ1 LYS 32 -10.709 -13.009 7.557
197 HZ3 LYS 32 HZ2 LYS 32 -9.502 -12.146 8.266
198 H SER 33 H SER 33 -5.532 -7.307 4.153
199 HA SER 33 HA SER 33 -3.260 -8.879 4.665
200 HB3 SER 33 HB2 SER 33 -4.609 -10.853 4.154
201 HG SER 33 HG SER 33 -5.745 -10.943 2.160
202 H GLY 34 H GLY 34 -2.361 -9.078 1.895
203 HA2 GLY 34 HA2 GLY 34 -3.438 -7.048 0.274
204 HA3 GLY 34 HA3 GLY 34 -1.911 -6.476 1.010
205 H SER 35 H SER 35 -1.936 -6.711 -1.658
206 HA SER 35 HA SER 35 0.079 -8.835 -2.062
207 HB3 SER 35 HB2 SER 35 -0.772 -9.466 -4.213
208 HG SER 35 HG SER 35 -2.686 -10.462 -3.603
209 H CYS 36 H CYS 36 1.457 -8.219 -4.016
210 HA CYS 36 HA CYS 36 1.736 -5.236 -4.021
211 HB3 CYS 36 HB2 CYS 36 4.114 -5.717 -4.510
212 HA PRO 37 HA PRO 37 1.038 -6.012 -8.513
213 HB3 PRO 37 HB2 PRO 37 -0.958 -4.953 -8.561
214 HG3 PRO 37 HG2 PRO 37 -1.602 -3.445 -6.853
215 HD3 PRO 37 HD2 PRO 37 -0.859 -5.379 -5.708
216 H TYR 38 H TYR 38 3.278 -6.157 -8.392
217 HA TYR 38 HA TYR 38 4.989 -3.892 -9.079
218 HB3 TYR 38 HB2 TYR 38 6.506 -5.583 -9.854
219 HD1 TYR 38 HD1 TYR 38 5.827 -4.597 -7.022
220 HD2 TYR 38 HD2 TYR 38 5.976 -8.540 -8.727
221 HE1 TYR 38 HE1 TYR 38 6.810 -5.443 -4.935
222 HE2 TYR 38 HE2 TYR 38 6.764 -9.445 -6.531
223 HH TYR 38 HH TYR 38 7.721 -7.268 -3.859
224 H LEU 39 H LEU 39 5.668 -3.492 -11.278
225 HA LEU 39 HA LEU 39 5.070 -2.620 -13.262
226 HB3 LEU 39 HB2 LEU 39 6.191 -4.335 -14.226
227 HG LEU 39 HG LEU 39 4.230 -6.257 -13.011
228 HD11 LEU 39 1HD1 LEU 39 5.518 -6.742 -15.723
229 HD12 LEU 39 2HD1 LEU 39 4.690 -7.954 -14.720
230 HD13 LEU 39 3HD1 LEU 39 3.776 -6.597 -15.398
231 HD21 LEU 39 3HD2 LEU 39 6.227 -7.601 -12.780
232 HD22 LEU 39 1HD2 LEU 39 7.151 -6.505 -13.827
233 HD23 LEU 39 2HD2 LEU 39 6.602 -5.958 -12.233
234 H GLY 40 H GLY 40 3.135 -2.079 -11.611
235 HA2 GLY 40 HA2 GLY 40 0.521 -2.866 -12.873
236 HA3 GLY 40 HA3 GLY 40 0.839 -2.578 -11.162
237 H GLU 41 H GLU 41 -1.130 -1.295 -11.506
238 HA GLU 41 HA GLU 41 -1.498 0.915 -13.068
239 HB3 GLU 41 HB2 GLU 41 -2.420 0.509 -10.186
240 HG3 GLU 41 HG2 GLU 41 -3.089 2.736 -11.070
241 H HIS 42 H HIS 42 0.165 0.815 -9.915
242 HA HIS 42 HA HIS 42 1.156 3.624 -10.389
243 HB3 HIS 42 HB2 HIS 42 1.342 3.816 -7.953
244 HD1 HIS 42 HD1 HIS 42 -1.094 4.124 -10.494
245 HD2 HIS 42 HD2 HIS 42 -1.304 3.719 -6.306
246 HE1 HIS 42 HE1 HIS 42 -3.337 5.104 -9.770
247 H LYS 43 H LYS 43 2.161 1.338 -11.596
248 HA LYS 43 HA LYS 43 3.997 0.397 -12.193
249 HB3 LYS 43 HB2 LYS 43 5.546 2.320 -10.412
250 HG3 LYS 43 HG2 LYS 43 7.029 0.689 -11.417
251 HD3 LYS 43 HD2 LYS 43 5.807 -0.229 -13.291
252 HE3 LYS 43 HE2 LYS 43 6.056 2.542 -14.583
253 HZ1 LYS 43 HZ3 LYS 43 6.183 0.716 -16.165
254 HZ2 LYS 43 HZ1 LYS 43 4.762 0.095 -15.605
255 HZ3 LYS 43 HZ2 LYS 43 4.784 1.560 -16.342
256 H PHE 44 H PHE 44 4.542 1.023 -8.704
257 HA PHE 44 HA PHE 44 4.799 -1.863 -8.133
258 HB3 PHE 44 HB2 PHE 44 6.962 0.235 -7.684
259 HD1 PHE 44 HD1 PHE 44 6.987 0.049 -5.200
260 HD2 PHE 44 HD2 PHE 44 7.771 -3.331 -7.773
261 HE1 PHE 44 HE1 PHE 44 8.283 -1.025 -3.408
262 HE2 PHE 44 HE2 PHE 44 9.062 -4.401 -5.962
263 HZ PHE 44 HZ PHE 44 9.323 -3.270 -3.776
264 H ALA 45 H ALA 45 3.187 -1.967 -6.553
265 HA ALA 45 HA ALA 45 3.381 -0.053 -4.305
266 HB1 ALA 45 HB3 ALA 45 1.910 1.098 -5.937
267 HB2 ALA 45 HB1 ALA 45 0.875 -0.341 -6.025
268 HB3 ALA 45 HB2 ALA 45 0.990 0.589 -4.511
269 H CYS 46 H CYS 46 1.697 -0.597 -2.602
270 HA CYS 46 HA CYS 46 1.398 -3.567 -2.324
271 HB3 CYS 46 HB2 CYS 46 1.200 -3.107 0.065
272 H TYR 47 H TYR 47 -0.666 -3.942 -3.109
273 HA TYR 47 HA TYR 47 -2.856 -2.076 -2.480
274 HB3 TYR 47 HB2 TYR 47 -2.959 -4.677 -4.021
275 HD1 TYR 47 HD2 TYR 47 -4.217 -1.126 -4.257
276 HD2 TYR 47 HD1 TYR 47 -5.274 -5.299 -4.056
277 HE1 TYR 47 HE2 TYR 47 -6.545 -0.564 -4.889
278 HE2 TYR 47 HE1 TYR 47 -7.606 -4.729 -4.673
279 HH TYR 47 HH TYR 47 -9.097 -3.031 -5.171
280 H CYS 48 H CYS 48 -3.191 -2.224 -0.304
281 HA CYS 48 HA CYS 48 -3.416 -4.780 1.099
282 HB3 CYS 48 HB2 CYS 48 -4.387 -3.427 2.922
283 H LYS 49 H LYS 49 -5.275 -5.661 1.820
284 HA LYS 49 HA LYS 49 -7.761 -5.172 0.328
285 HB3 LYS 49 HB2 LYS 49 -8.327 -7.419 1.567
286 HG3 LYS 49 HG2 LYS 49 -6.631 -8.722 0.027
287 HD3 LYS 49 HD2 LYS 49 -8.853 -6.828 -0.736
288 HE3 LYS 49 HE2 LYS 49 -7.562 -8.779 -2.692
289 HZ1 LYS 49 HZ3 LYS 49 -9.652 -6.714 -2.975
290 HZ2 LYS 49 HZ1 LYS 49 -9.075 -7.627 -4.210
291 HZ3 LYS 49 HZ2 LYS 49 -9.944 -8.326 -2.990
292 H ASP 50 H ASP 50 -9.586 -4.427 1.434
293 HA ASP 50 HA ASP 50 -10.925 -3.727 3.134
294 HB3 ASP 50 HB2 ASP 50 -9.388 -5.475 5.068
295 H LEU 51 H LEU 51 -8.982 -1.897 2.674
296 HA LEU 51 HA LEU 51 -7.529 -1.321 5.200
297 HB3 LEU 51 HB2 LEU 51 -7.182 -0.054 2.470
298 HG LEU 51 HG LEU 51 -6.290 1.149 4.615
299 HD11 LEU 51 1HD1 LEU 51 -4.146 0.258 5.477
300 HD12 LEU 51 2HD1 LEU 51 -5.457 -0.859 5.816
301 HD13 LEU 51 3HD1 LEU 51 -4.334 -1.190 4.480
302 HD21 LEU 51 3HD2 LEU 51 -5.513 1.765 2.420
303 HD22 LEU 51 1HD2 LEU 51 -4.120 1.668 3.500
304 HD23 LEU 51 2HD2 LEU 51 -4.432 0.358 2.341
305 HA PRO 52 HA PRO 52 -11.029 1.451 5.755
306 HB3 PRO 52 HB2 PRO 52 -11.052 1.076 7.991
307 HG3 PRO 52 HG2 PRO 52 -9.052 0.497 9.147
308 HD3 PRO 52 HD2 PRO 52 -9.088 -0.920 7.233
309 H ASP 53 H ASP 53 -11.563 3.699 5.677
310 HA ASP 53 HA ASP 53 -10.196 4.492 3.531
311 HB3 ASP 53 HB2 ASP 53 -12.149 6.301 4.899
312 H ASN 54 H ASN 54 -10.025 5.944 6.700
313 HA ASN 54 HA ASN 54 -8.624 8.305 6.229
314 HB3 ASN 54 HB2 ASN 54 -8.428 6.413 8.608
315 HD21 ASN 54 1HD2 ASN 54 -6.628 6.991 9.825
316 HD22 ASN 54 2HD2 ASN 54 -6.155 8.664 10.074
317 H VAL 55 H VAL 55 -7.295 4.992 6.169
318 HA VAL 55 HA VAL 55 -4.616 5.762 6.802
319 HB VAL 55 HB VAL 55 -5.567 3.375 5.172
320 HG11 VAL 55 1HG1 VAL 55 -2.994 3.804 6.761
321 HG12 VAL 55 2HG1 VAL 55 -3.460 2.325 5.925
322 HG13 VAL 55 3HG1 VAL 55 -3.113 3.777 4.985
323 HG21 VAL 55 3HG2 VAL 55 -6.660 3.415 7.398
324 HG22 VAL 55 1HG2 VAL 55 -5.443 2.138 7.321
325 HG23 VAL 55 2HG2 VAL 55 -5.083 3.653 8.174
326 HA PRO 56 HA PRO 56 -3.835 7.913 2.992
327 HB3 PRO 56 HB2 PRO 56 -2.088 8.999 3.984
328 HG3 PRO 56 HG2 PRO 56 -0.680 7.888 5.577
329 HD3 PRO 56 HD2 PRO 56 -2.964 7.627 6.269
330 H ILE 57 H ILE 57 -3.866 7.294 0.940
331 HA ILE 57 HA ILE 57 -2.837 4.636 0.116
332 HB ILE 57 HB ILE 57 -4.431 4.653 -1.603
333 HG13 ILE 57 2HG1 ILE 57 -4.333 6.948 -2.375
334 HG21 ILE 57 1HG2 ILE 57 -6.501 4.625 -0.343
335 HG22 ILE 57 2HG2 ILE 57 -5.200 4.135 0.752
336 HG23 ILE 57 3HG2 ILE 57 -5.872 5.776 0.840
337 HD11 ILE 57 3HD1 ILE 57 -6.617 7.419 -2.848
338 HD12 ILE 57 1HD1 ILE 57 -6.421 5.656 -2.856
339 HD13 ILE 57 2HD1 ILE 57 -7.187 6.473 -1.468
340 H ARG 58 H ARG 58 -1.671 4.640 -1.980
341 HA ARG 58 HA ARG 58 0.097 6.851 -2.484
342 HB3 ARG 58 HB2 ARG 58 -0.712 4.477 -4.200
343 HG3 ARG 58 HG2 ARG 58 0.495 6.413 -5.433
344 HD3 ARG 58 HD2 ARG 58 2.998 5.174 -4.302
345 HE ARG 58 HE ARG 58 3.667 6.684 -5.901
346 HH11 ARG 58 2HH2 ARG 58 2.044 8.404 -3.297
347 HH12 ARG 58 1HH2 ARG 58 1.435 9.667 -4.362
348 HH21 ARG 58 1HH1 ARG 58 3.700 8.803 -6.969
349 HH22 ARG 58 2HH1 ARG 58 3.097 10.178 -6.081
350 H VAL 59 H VAL 59 -1.054 8.812 -2.941
351 HA VAL 59 HA VAL 59 -3.072 8.662 -5.138
352 HB VAL 59 HB VAL 59 -3.635 10.937 -4.765
353 HG11 VAL 59 1HG1 VAL 59 -3.732 9.328 -2.187
354 HG12 VAL 59 2HG1 VAL 59 -4.836 10.628 -2.671
355 HG13 VAL 59 3HG1 VAL 59 -4.816 9.110 -3.583
356 HG21 VAL 59 3HG2 VAL 59 -1.579 11.911 -3.839
357 HG22 VAL 59 1HG2 VAL 59 -2.970 12.195 -2.795
358 HG23 VAL 59 2HG2 VAL 59 -1.808 10.946 -2.343
359 HA PRO 60 HA PRO 60 0.304 9.261 -7.824
360 HB3 PRO 60 HB2 PRO 60 -1.097 8.282 -9.371
361 HG3 PRO 60 HG2 PRO 60 -3.388 8.980 -9.619
362 HD3 PRO 60 HD2 PRO 60 -3.016 8.248 -7.389
363 H GLY 61 H GLY 61 0.843 11.117 -6.368
364 HA2 GLY 61 HA2 GLY 61 1.619 13.393 -8.008
365 HA3 GLY 61 HA3 GLY 61 0.520 13.778 -6.658
366 H LYS 62 H LYS 62 2.216 14.904 -5.594
367 HA LYS 62 HA LYS 62 4.831 14.203 -5.121
368 HB3 LYS 62 HB2 LYS 62 4.641 15.594 -3.046
369 HG3 LYS 62 HG2 LYS 62 3.183 16.770 -5.457
370 HD3 LYS 62 HD2 LYS 62 4.649 18.091 -3.114
371 HE3 LYS 62 HE2 LYS 62 3.658 20.193 -4.047
372 HZ1 LYS 62 HZ3 LYS 62 5.904 19.641 -4.693
373 HZ2 LYS 62 HZ1 LYS 62 5.365 18.833 -6.025
374 HZ3 LYS 62 HZ2 LYS 62 5.126 20.451 -5.892
375 H CYS 63 H CYS 63 5.936 12.814 -3.861
376 HA CYS 63 HA CYS 63 4.716 11.584 -1.495
377 HB3 CYS 63 HB2 CYS 63 5.701 10.178 -3.907
378 H HIS 64 H HIS 64 6.219 11.689 0.230
379 HA HIS 64 HA HIS 64 8.985 12.483 -0.246
380 HB3 HIS 64 HB2 HIS 64 7.986 14.645 -0.625
381 HD1 HIS 64 HD1 HIS 64 7.168 15.368 2.955
382 HD2 HIS 64 HD2 HIS 64 5.200 14.467 -0.658
383 HE1 HIS 64 HE1 HIS 64 4.737 16.086 3.241
Start of MODEL 17
1 H1 VAL 1 H VAL 1 -14.873 0.109 5.187
2 HA VAL 1 HA VAL 1 -12.100 0.104 5.621
3 HB VAL 1 HB VAL 1 -11.734 -2.350 5.196
4 HG11 VAL 1 1HG1 VAL 1 -13.131 -1.697 7.820
5 HG12 VAL 1 2HG1 VAL 1 -12.059 -3.081 7.513
6 HG13 VAL 1 3HG1 VAL 1 -11.412 -1.437 7.443
7 HG21 VAL 1 3HG2 VAL 1 -13.992 -2.935 4.351
8 HG22 VAL 1 1HG2 VAL 1 -13.513 -3.955 5.714
9 HG23 VAL 1 2HG2 VAL 1 -14.673 -2.642 5.966
10 H ARG 2 H ARG 2 -10.956 -0.563 3.593
11 HA ARG 2 HA ARG 2 -12.578 -1.059 1.219
12 HB3 ARG 2 HB2 ARG 2 -12.762 1.382 1.293
13 HG3 ARG 2 HG2 ARG 2 -9.703 1.373 1.556
14 HD3 ARG 2 HD2 ARG 2 -11.654 3.446 0.673
15 HE ARG 2 HE ARG 2 -11.062 4.911 2.240
16 HH11 ARG 2 2HH2 ARG 2 -8.215 2.790 2.198
17 HH12 ARG 2 1HH2 ARG 2 -7.330 3.947 3.204
18 HH21 ARG 2 1HH1 ARG 2 -9.891 6.253 3.302
19 HH22 ARG 2 2HH1 ARG 2 -8.289 5.859 3.871
20 H ASP 3 H ASP 3 -11.114 -1.284 -0.662
21 HA ASP 3 HA ASP 3 -8.486 -2.425 0.048
22 HB3 ASP 3 HB2 ASP 3 -9.869 -3.755 -1.500
23 H ALA 4 H ALA 4 -6.587 -1.488 -0.983
24 HA ALA 4 HA ALA 4 -6.704 1.156 -2.169
25 HB1 ALA 4 HB3 ALA 4 -6.192 0.857 0.828
26 HB2 ALA 4 HB1 ALA 4 -5.738 2.290 -0.111
27 HB3 ALA 4 HB2 ALA 4 -7.451 1.849 0.059
28 H TYR 5 H TYR 5 -4.638 1.946 -2.653
29 HA TYR 5 HA TYR 5 -2.312 0.138 -2.341
30 HB3 TYR 5 HB2 TYR 5 -1.155 2.184 -3.333
31 HD1 TYR 5 HD2 TYR 5 -0.676 -0.256 -4.184
32 HD2 TYR 5 HD1 TYR 5 -3.695 2.359 -5.807
33 HE1 TYR 5 HE2 TYR 5 -0.479 -1.384 -6.371
34 HE2 TYR 5 HE1 TYR 5 -3.525 1.200 -7.984
35 HH TYR 5 HH TYR 5 -1.546 -1.707 -8.428
36 H ILE 6 H ILE 6 -1.414 0.176 -0.240
37 HA ILE 6 HA ILE 6 -2.046 2.482 1.442
38 HB ILE 6 HB ILE 6 -2.019 0.145 2.235
39 HG13 ILE 6 2HG1 ILE 6 -1.897 2.129 3.707
40 HG21 ILE 6 1HG2 ILE 6 0.046 -1.019 2.729
41 HG22 ILE 6 2HG2 ILE 6 0.073 -0.581 1.023
42 HG23 ILE 6 3HG2 ILE 6 1.026 0.354 2.180
43 HD11 ILE 6 3HD1 ILE 6 -1.864 -0.284 4.518
44 HD12 ILE 6 1HD1 ILE 6 -0.128 -0.050 4.810
45 HD13 ILE 6 2HD1 ILE 6 -1.310 0.969 5.659
46 H ALA 7 H ALA 7 -0.574 4.010 2.216
47 HA ALA 7 HA ALA 7 2.265 3.801 1.506
48 HB1 ALA 7 HB3 ALA 7 2.311 6.086 0.468
49 HB2 ALA 7 HB1 ALA 7 1.462 4.864 -0.494
50 HB3 ALA 7 HB2 ALA 7 0.534 6.073 0.437
51 H GLN 8 H GLN 8 3.527 5.650 2.493
52 HA GLN 8 HA GLN 8 2.342 6.351 5.142
53 HB3 GLN 8 HB2 GLN 8 4.154 4.610 4.997
54 HG3 GLN 8 HG2 GLN 8 6.229 6.712 4.737
55 HE21 GLN 8 1HE2 GLN 8 5.853 4.384 2.187
56 HE22 GLN 8 2HE2 GLN 8 7.016 3.219 2.797
57 H ASN 9 H ASN 9 4.314 8.060 5.949
58 HA ASN 9 HA ASN 9 3.838 10.614 4.827
59 HB3 ASN 9 HB2 ASN 9 4.588 10.432 7.038
60 HD21 ASN 9 1HD2 ASN 9 7.932 10.558 6.546
61 HD22 ASN 9 2HD2 ASN 9 8.302 8.956 7.154
62 H TYR 10 H TYR 10 6.161 10.650 2.019
63 HA TYR 10 HA TYR 10 3.323 11.051 2.901
64 HB3 TYR 10 HB2 TYR 10 4.930 13.089 1.357
65 HD1 TYR 10 HD2 TYR 10 2.712 13.532 0.234
66 HD2 TYR 10 HD1 TYR 10 3.196 13.751 4.515
67 HE1 TYR 10 HE2 TYR 10 0.537 14.693 0.422
68 HE2 TYR 10 HE1 TYR 10 1.016 14.919 4.696
69 HH TYR 10 HH TYR 10 -1.011 15.650 1.849
70 H ASN 11 H ASN 11 2.476 9.498 1.628
71 HA ASN 11 HA ASN 11 1.519 8.672 -0.233
72 HB3 ASN 11 HB2 ASN 11 2.977 10.472 -2.166
73 HD21 ASN 11 1HD2 ASN 11 1.805 10.782 -4.116
74 HD22 ASN 11 2HD2 ASN 11 0.344 9.861 -4.463
75 H CYS 12 H CYS 12 4.372 8.183 0.816
76 HA CYS 12 HA CYS 12 5.688 7.088 -1.633
77 HB3 CYS 12 HB2 CYS 12 7.686 6.996 -0.340
78 H VAL 13 H VAL 13 5.755 4.883 -1.888
79 HA VAL 13 HA VAL 13 4.218 3.258 -0.002
80 HB VAL 13 HB VAL 13 5.639 2.273 -2.480
81 HG11 VAL 13 1HG1 VAL 13 4.739 0.440 -1.317
82 HG12 VAL 13 2HG1 VAL 13 3.273 1.344 -0.841
83 HG13 VAL 13 3HG1 VAL 13 3.511 0.823 -2.511
84 HG21 VAL 13 3HG2 VAL 13 3.509 2.735 -3.735
85 HG22 VAL 13 1HG2 VAL 13 2.880 3.554 -2.291
86 HG23 VAL 13 2HG2 VAL 13 4.244 4.240 -3.210
87 H TYR 14 H TYR 14 5.228 1.073 0.446
88 HA TYR 14 HA TYR 14 7.828 1.480 1.786
89 HB3 TYR 14 HB2 TYR 14 7.338 -0.665 2.852
90 HD1 TYR 14 HD1 TYR 14 7.236 1.024 4.687
91 HD2 TYR 14 HD2 TYR 14 3.829 0.256 2.152
92 HE1 TYR 14 HE1 TYR 14 5.749 2.118 6.339
93 HE2 TYR 14 HE2 TYR 14 2.363 1.397 3.784
94 HH TYR 14 HH TYR 14 2.216 2.407 5.859
95 H HIS 15 H HIS 15 9.542 -0.176 1.424
96 HA HIS 15 HA HIS 15 10.169 -0.642 -1.282
97 HB3 HIS 15 HB2 HIS 15 11.931 -2.104 -0.430
98 HD1 HIS 15 HD1 HIS 15 12.661 -0.941 2.767
99 HD2 HIS 15 HD2 HIS 15 11.997 1.009 -0.906
100 HE1 HIS 15 HE1 HIS 15 13.770 1.352 2.941
101 H CYS 16 H CYS 16 8.443 -2.654 1.042
102 HA CYS 16 HA CYS 16 7.270 -4.558 0.887
103 HB3 CYS 16 HB2 CYS 16 7.188 -4.331 -2.118
104 H ALA 17 H ALA 17 7.520 -6.684 -1.216
105 HA ALA 17 HA ALA 17 10.168 -7.384 -1.754
106 HB1 ALA 17 HB3 ALA 17 10.487 -9.218 -0.062
107 HB2 ALA 17 HB1 ALA 17 10.601 -7.612 0.657
108 HB3 ALA 17 HB2 ALA 17 9.122 -8.570 0.865
109 H ARG 18 H ARG 18 7.127 -8.692 -0.469
110 HA ARG 18 HA ARG 18 6.508 -10.365 -2.806
111 HB3 ARG 18 HB2 ARG 18 5.785 -11.989 -0.649
112 HG3 ARG 18 HG2 ARG 18 6.809 -13.103 -2.455
113 HD3 ARG 18 HD2 ARG 18 9.215 -11.421 -1.696
114 HE ARG 18 HE ARG 18 9.516 -13.961 -2.833
115 HH11 ARG 18 2HH2 ARG 18 10.110 -10.535 -3.578
116 HH12 ARG 18 1HH2 ARG 18 11.542 -10.815 -4.522
117 HH21 ARG 18 1HH1 ARG 18 11.458 -14.366 -4.108
118 HH22 ARG 18 2HH1 ARG 18 12.327 -13.049 -4.827
119 H ASP 19 H ASP 19 4.249 -10.860 -2.888
120 HA ASP 19 HA ASP 19 2.364 -9.139 -1.898
121 HB3 ASP 19 HB2 ASP 19 0.787 -11.005 -2.343
122 H ALA 20 H ALA 20 3.509 -12.154 -0.348
123 HA ALA 20 HA ALA 20 1.987 -12.053 2.020
124 HB1 ALA 20 HB3 ALA 20 3.418 -13.959 1.377
125 HB2 ALA 20 HB1 ALA 20 4.875 -12.980 1.669
126 HB3 ALA 20 HB2 ALA 20 3.793 -13.392 3.016
127 H TYR 21 H TYR 21 5.069 -10.302 1.266
128 HA TYR 21 HA TYR 21 5.427 -9.256 3.917
129 HB3 TYR 21 HB2 TYR 21 6.285 -7.991 1.288
130 HD1 TYR 21 HD1 TYR 21 5.860 -5.757 2.510
131 HD2 TYR 21 HD2 TYR 21 8.777 -8.677 3.777
132 HE1 TYR 21 HE1 TYR 21 7.062 -4.010 3.761
133 HE2 TYR 21 HE2 TYR 21 10.011 -6.901 4.985
134 HH TYR 21 HH TYR 21 8.851 -3.525 5.138
135 H CYS 22 H CYS 22 3.784 -7.981 0.987
136 HA CYS 22 HA CYS 22 2.832 -5.570 2.252
137 HB3 CYS 22 HB2 CYS 22 1.804 -7.224 -0.089
138 H ASN 23 H ASN 23 1.370 -8.813 1.950
139 HA ASN 23 HA ASN 23 -1.051 -8.300 3.279
140 HB3 ASN 23 HB2 ASN 23 0.363 -10.584 2.304
141 HD21 ASN 23 1HD2 ASN 23 -1.616 -10.434 5.382
142 HD22 ASN 23 2HD2 ASN 23 -0.870 -11.896 6.008
143 H GLU 24 H GLU 24 2.146 -9.220 4.704
144 HA GLU 24 HA GLU 24 1.298 -9.223 7.385
145 HB3 GLU 24 HB2 GLU 24 4.018 -8.577 6.130
146 HG3 GLU 24 HG2 GLU 24 3.141 -9.050 8.979
147 H LEU 25 H LEU 25 2.780 -6.564 5.449
148 HA LEU 25 HA LEU 25 2.705 -4.597 7.439
149 HB3 LEU 25 HB2 LEU 25 2.281 -4.120 4.443
150 HG LEU 25 HG LEU 25 3.152 -2.467 6.793
151 HD11 LEU 25 1HD1 LEU 25 4.722 -1.144 5.489
152 HD12 LEU 25 2HD1 LEU 25 5.301 -2.807 5.635
153 HD13 LEU 25 3HD1 LEU 25 4.571 -2.260 4.108
154 HD21 LEU 25 3HD2 LEU 25 1.085 -2.017 5.399
155 HD22 LEU 25 1HD2 LEU 25 2.224 -0.666 5.470
156 HD23 LEU 25 2HD2 LEU 25 2.149 -1.690 4.019
157 H CYS 26 H CYS 26 0.185 -5.502 5.123
158 HA CYS 26 HA CYS 26 -1.759 -3.549 5.748
159 HB3 CYS 26 HB2 CYS 26 -3.349 -5.272 4.754
160 H THR 27 H THR 27 -1.416 -6.942 7.035
161 HA THR 27 HA THR 27 -3.477 -6.629 8.984
162 HB THR 27 HB THR 27 -2.466 -8.536 10.149
163 HG1 THR 27 HG1 THR 27 -0.332 -8.016 8.408
164 HG21 THR 27 3HG2 THR 27 -3.972 -8.970 8.291
165 HG22 THR 27 1HG2 THR 27 -2.653 -8.842 7.119
166 HG23 THR 27 2HG2 THR 27 -2.666 -10.166 8.298
167 H LYS 28 H LYS 28 -0.046 -5.772 9.181
168 HA LYS 28 HA LYS 28 0.005 -4.985 11.910
169 HB3 LYS 28 HB2 LYS 28 1.860 -3.440 10.479
170 HG3 LYS 28 HG2 LYS 28 2.349 -4.995 12.420
171 HD3 LYS 28 HD2 LYS 28 2.354 -7.097 10.181
172 HE3 LYS 28 HE2 LYS 28 2.787 -8.711 12.053
173 HZ1 LYS 28 HZ3 LYS 28 5.116 -8.211 12.325
174 HZ2 LYS 28 HZ1 LYS 28 4.690 -8.063 10.786
175 HZ3 LYS 28 HZ2 LYS 28 4.924 -6.710 11.685
176 H ASN 29 H ASN 29 -1.046 -3.316 8.941
177 HA ASN 29 HA ASN 29 -1.482 -0.773 10.398
178 HB3 ASN 29 HB2 ASN 29 -2.560 -0.151 8.146
179 HD21 ASN 29 1HD2 ASN 29 0.617 -1.858 7.980
180 HD22 ASN 29 2HD2 ASN 29 1.554 -0.365 7.899
181 H GLY 30 H GLY 30 -3.267 -3.654 9.653
182 HA2 GLY 30 HA2 GLY 30 -5.126 -4.191 11.059
183 HA3 GLY 30 HA3 GLY 30 -5.661 -2.510 11.048
184 H ALA 31 H ALA 31 -4.602 -4.511 8.275
185 HA ALA 31 HA ALA 31 -7.398 -4.678 7.232
186 HB1 ALA 31 HB3 ALA 31 -6.216 -3.094 5.849
187 HB2 ALA 31 HB1 ALA 31 -4.778 -4.095 5.801
188 HB3 ALA 31 HB2 ALA 31 -6.256 -4.644 4.969
189 H LYS 32 H LYS 32 -7.987 -6.695 6.597
190 HA LYS 32 HA LYS 32 -6.562 -8.791 7.775
191 HB3 LYS 32 HB2 LYS 32 -8.995 -8.753 7.419
192 HG3 LYS 32 HG2 LYS 32 -8.330 -9.849 4.661
193 HD3 LYS 32 HD2 LYS 32 -10.510 -10.518 6.066
194 HE3 LYS 32 HE2 LYS 32 -12.449 -9.203 5.102
195 HZ1 LYS 32 HZ3 LYS 32 -12.013 -8.416 7.283
196 HZ2 LYS 32 HZ1 LYS 32 -10.613 -7.642 6.811
197 HZ3 LYS 32 HZ2 LYS 32 -11.973 -7.041 6.318
198 H SER 33 H SER 33 -6.195 -7.628 4.409
199 HA SER 33 HA SER 33 -3.898 -9.355 4.149
200 HB3 SER 33 HB2 SER 33 -5.637 -11.017 3.577
201 HG SER 33 HG SER 33 -7.168 -9.379 2.846
202 H GLY 34 H GLY 34 -2.984 -9.130 1.837
203 HA2 GLY 34 HA2 GLY 34 -3.823 -6.931 0.248
204 HA3 GLY 34 HA3 GLY 34 -2.295 -6.589 1.108
205 H SER 35 H SER 35 -1.934 -6.634 -1.497
206 HA SER 35 HA SER 35 -0.198 -8.914 -1.852
207 HB3 SER 35 HB2 SER 35 -2.181 -9.899 -2.854
208 HG SER 35 HG SER 35 -2.374 -7.958 -4.829
209 H CYS 36 H CYS 36 1.284 -8.367 -3.824
210 HA CYS 36 HA CYS 36 1.691 -5.394 -3.631
211 HB3 CYS 36 HB2 CYS 36 3.979 -7.334 -3.387
212 HA PRO 37 HA PRO 37 1.926 -6.916 -8.014
213 HB3 PRO 37 HB2 PRO 37 -0.222 -6.332 -8.513
214 HG3 PRO 37 HG2 PRO 37 -1.363 -4.610 -7.279
215 HD3 PRO 37 HD2 PRO 37 -0.498 -6.240 -5.748
216 H TYR 38 H TYR 38 4.057 -6.592 -8.350
217 HA TYR 38 HA TYR 38 5.319 -4.043 -8.900
218 HB3 TYR 38 HB2 TYR 38 6.710 -5.307 -10.469
219 HD1 TYR 38 HD2 TYR 38 5.848 -7.785 -7.791
220 HD2 TYR 38 HD1 TYR 38 8.418 -4.537 -8.999
221 HE1 TYR 38 HE2 TYR 38 7.352 -8.248 -5.875
222 HE2 TYR 38 HE1 TYR 38 9.917 -5.013 -7.110
223 HH TYR 38 HH TYR 38 10.283 -6.304 -5.245
224 H LEU 39 H LEU 39 5.464 -3.092 -10.881
225 HA LEU 39 HA LEU 39 4.279 -1.760 -12.348
226 HB3 LEU 39 HB2 LEU 39 3.699 -2.866 -14.428
227 HG LEU 39 HG LEU 39 6.084 -4.328 -13.199
228 HD11 LEU 39 1HD1 LEU 39 5.248 -5.304 -15.304
229 HD12 LEU 39 2HD1 LEU 39 5.362 -3.716 -16.093
230 HD13 LEU 39 3HD1 LEU 39 6.831 -4.539 -15.525
231 HD21 LEU 39 3HD2 LEU 39 5.937 -1.640 -14.642
232 HD22 LEU 39 1HD2 LEU 39 6.455 -1.914 -12.963
233 HD23 LEU 39 2HD2 LEU 39 7.437 -2.524 -14.296
234 H GLY 40 H GLY 40 2.658 -2.599 -9.964
235 HA2 GLY 40 HA2 GLY 40 -0.087 -2.442 -10.781
236 HA3 GLY 40 HA3 GLY 40 0.629 -1.801 -9.284
237 H GLU 41 H GLU 41 -1.265 -0.175 -10.224
238 HA GLU 41 HA GLU 41 -0.811 1.505 -12.401
239 HB3 GLU 41 HB2 GLU 41 -2.135 2.181 -9.730
240 HG3 GLU 41 HG2 GLU 41 -3.588 3.479 -11.606
241 H HIS 42 H HIS 42 0.172 2.045 -9.029
242 HA HIS 42 HA HIS 42 1.687 4.412 -9.519
243 HB3 HIS 42 HB2 HIS 42 2.408 4.084 -7.182
244 HD1 HIS 42 HD1 HIS 42 -0.532 4.999 -8.771
245 HD2 HIS 42 HD2 HIS 42 0.197 2.927 -5.171
246 HE1 HIS 42 HE1 HIS 42 -2.520 5.451 -7.251
247 H LYS 43 H LYS 43 2.532 1.772 -11.049
248 HA LYS 43 HA LYS 43 4.398 0.693 -11.697
249 HB3 LYS 43 HB2 LYS 43 5.575 3.384 -10.935
250 HG3 LYS 43 HG2 LYS 43 6.799 1.806 -13.119
251 HD3 LYS 43 HD2 LYS 43 7.467 4.155 -12.215
252 HE3 LYS 43 HE2 LYS 43 9.242 4.140 -10.505
253 HZ1 LYS 43 HZ3 LYS 43 6.941 2.700 -9.355
254 HZ2 LYS 43 HZ1 LYS 43 8.010 3.619 -8.534
255 HZ3 LYS 43 HZ2 LYS 43 6.964 4.319 -9.597
256 H PHE 44 H PHE 44 3.715 -0.542 -9.744
257 HA PHE 44 HA PHE 44 4.417 -2.111 -8.306
258 HB3 PHE 44 HB2 PHE 44 6.940 -0.531 -7.786
259 HD1 PHE 44 HD1 PHE 44 5.030 -3.576 -6.712
260 HD2 PHE 44 HD2 PHE 44 8.809 -1.457 -6.658
261 HE1 PHE 44 HE1 PHE 44 5.893 -5.134 -5.047
262 HE2 PHE 44 HE2 PHE 44 9.547 -2.878 -4.774
263 HZ PHE 44 HZ PHE 44 8.156 -4.790 -4.053
264 H ALA 45 H ALA 45 3.106 -2.165 -6.515
265 HA ALA 45 HA ALA 45 3.824 -0.577 -4.246
266 HB1 ALA 45 HB3 ALA 45 1.313 0.216 -5.765
267 HB2 ALA 45 HB1 ALA 45 1.581 0.657 -4.061
268 HB3 ALA 45 HB2 ALA 45 2.664 1.253 -5.319
269 H CYS 46 H CYS 46 2.120 -0.834 -2.441
270 HA CYS 46 HA CYS 46 1.340 -3.698 -2.290
271 HB3 CYS 46 HB2 CYS 46 2.066 -1.604 -0.249
272 H TYR 47 H TYR 47 -0.727 -4.077 -2.746
273 HA TYR 47 HA TYR 47 -2.787 -2.025 -2.223
274 HB3 TYR 47 HB2 TYR 47 -3.165 -4.548 -3.851
275 HD1 TYR 47 HD2 TYR 47 -3.626 -0.884 -4.284
276 HD2 TYR 47 HD1 TYR 47 -5.656 -4.637 -3.835
277 HE1 TYR 47 HE2 TYR 47 -5.749 0.196 -4.972
278 HE2 TYR 47 HE1 TYR 47 -7.762 -3.581 -4.568
279 HH TYR 47 HH TYR 47 -8.842 -1.518 -4.920
280 H CYS 48 H CYS 48 -3.462 -2.232 -0.149
281 HA CYS 48 HA CYS 48 -3.910 -4.834 1.157
282 HB3 CYS 48 HB2 CYS 48 -4.891 -3.512 2.962
283 H LYS 49 H LYS 49 -6.093 -5.515 1.797
284 HA LYS 49 HA LYS 49 -8.123 -4.746 -0.278
285 HB3 LYS 49 HB2 LYS 49 -8.756 -7.255 0.862
286 HG3 LYS 49 HG2 LYS 49 -9.087 -6.543 -1.469
287 HD3 LYS 49 HD2 LYS 49 -6.712 -5.606 -1.800
288 HE3 LYS 49 HE2 LYS 49 -6.125 -8.512 -2.541
289 HZ1 LYS 49 HZ3 LYS 49 -3.925 -7.707 -2.895
290 HZ2 LYS 49 HZ1 LYS 49 -4.916 -6.697 -3.682
291 HZ3 LYS 49 HZ2 LYS 49 -4.262 -6.238 -2.239
292 H ASP 50 H ASP 50 -7.572 -3.891 2.796
293 HA ASP 50 HA ASP 50 -10.395 -3.850 3.659
294 HB3 ASP 50 HB2 ASP 50 -8.231 -5.632 4.868
295 H LEU 51 H LEU 51 -8.357 -1.867 3.254
296 HA LEU 51 HA LEU 51 -7.076 -1.190 5.761
297 HB3 LEU 51 HB2 LEU 51 -7.435 0.540 3.297
298 HG LEU 51 HG LEU 51 -6.236 1.509 5.303
299 HD11 LEU 51 1HD1 LEU 51 -3.882 0.723 5.694
300 HD12 LEU 51 2HD1 LEU 51 -5.048 -0.506 6.172
301 HD13 LEU 51 3HD1 LEU 51 -4.194 -0.665 4.632
302 HD21 LEU 51 3HD2 LEU 51 -5.809 2.291 2.983
303 HD22 LEU 51 1HD2 LEU 51 -4.339 2.370 3.958
304 HD23 LEU 51 2HD2 LEU 51 -4.554 1.049 2.795
305 HA PRO 52 HA PRO 52 -10.824 0.883 7.219
306 HB3 PRO 52 HB2 PRO 52 -10.131 0.418 9.362
307 HG3 PRO 52 HG2 PRO 52 -7.814 0.458 9.966
308 HD3 PRO 52 HD2 PRO 52 -7.967 -1.015 8.103
309 H ASP 53 H ASP 53 -11.698 2.893 6.705
310 HA ASP 53 HA ASP 53 -10.359 4.269 4.780
311 HB3 ASP 53 HB2 ASP 53 -12.705 5.328 6.375
312 H ASN 54 H ASN 54 -10.424 4.980 8.198
313 HA ASN 54 HA ASN 54 -9.374 7.510 8.517
314 HB3 ASN 54 HB2 ASN 54 -8.534 4.914 9.882
315 HD21 ASN 54 1HD2 ASN 54 -6.401 5.342 10.574
316 HD22 ASN 54 2HD2 ASN 54 -6.038 6.773 11.526
317 H VAL 55 H VAL 55 -7.571 4.609 7.383
318 HA VAL 55 HA VAL 55 -5.080 6.152 7.207
319 HB VAL 55 HB VAL 55 -5.676 3.301 6.414
320 HG11 VAL 55 1HG1 VAL 55 -3.016 4.759 6.773
321 HG12 VAL 55 2HG1 VAL 55 -3.219 3.043 6.381
322 HG13 VAL 55 3HG1 VAL 55 -3.706 4.279 5.211
323 HG21 VAL 55 3HG2 VAL 55 -5.904 3.622 8.856
324 HG22 VAL 55 1HG2 VAL 55 -4.431 2.720 8.481
325 HG23 VAL 55 2HG2 VAL 55 -4.331 4.442 8.901
326 HA PRO 56 HA PRO 56 -6.580 7.446 3.178
327 HB3 PRO 56 HB2 PRO 56 -5.420 9.415 3.584
328 HG3 PRO 56 HG2 PRO 56 -3.236 9.397 4.598
329 HD3 PRO 56 HD2 PRO 56 -4.742 8.290 6.082
330 H ILE 57 H ILE 57 -5.841 7.330 0.841
331 HA ILE 57 HA ILE 57 -4.422 4.758 0.260
332 HB ILE 57 HB ILE 57 -5.567 4.762 -1.822
333 HG13 ILE 57 2HG1 ILE 57 -5.449 7.129 -2.447
334 HG21 ILE 57 1HG2 ILE 57 -7.729 5.704 0.099
335 HG22 ILE 57 2HG2 ILE 57 -7.818 4.427 -1.134
336 HG23 ILE 57 3HG2 ILE 57 -6.856 4.183 0.330
337 HD11 ILE 57 3HD1 ILE 57 -7.577 7.454 -3.472
338 HD12 ILE 57 1HD1 ILE 57 -7.195 5.722 -3.537
339 HD13 ILE 57 2HD1 ILE 57 -8.377 6.341 -2.354
340 H ARG 58 H ARG 58 -2.944 4.807 -1.492
341 HA ARG 58 HA ARG 58 -1.235 7.130 -1.596
342 HB3 ARG 58 HB2 ARG 58 -1.189 4.686 -3.412
343 HG3 ARG 58 HG2 ARG 58 1.270 4.859 -2.984
344 HD3 ARG 58 HD2 ARG 58 0.119 7.339 -4.240
345 HE ARG 58 HE ARG 58 2.713 6.906 -3.452
346 HH11 ARG 58 2HH2 ARG 58 0.950 8.073 -6.277
347 HH12 ARG 58 1HH2 ARG 58 2.302 9.038 -6.838
348 HH21 ARG 58 1HH1 ARG 58 4.051 8.434 -3.835
349 HH22 ARG 58 2HH1 ARG 58 3.823 9.585 -5.122
350 H VAL 59 H VAL 59 -1.416 8.798 -3.198
351 HA VAL 59 HA VAL 59 -3.671 8.478 -5.140
352 HB VAL 59 HB VAL 59 -3.676 10.905 -5.303
353 HG11 VAL 59 1HG1 VAL 59 -5.111 9.728 -3.662
354 HG12 VAL 59 2HG1 VAL 59 -3.854 9.924 -2.422
355 HG13 VAL 59 3HG1 VAL 59 -4.653 11.348 -3.112
356 HG21 VAL 59 3HG2 VAL 59 -1.311 11.423 -4.750
357 HG22 VAL 59 1HG2 VAL 59 -2.460 12.330 -3.762
358 HG23 VAL 59 2HG2 VAL 59 -1.619 10.943 -3.061
359 HA PRO 60 HA PRO 60 -0.643 8.299 -8.397
360 HB3 PRO 60 HB2 PRO 60 -2.399 7.550 -9.690
361 HG3 PRO 60 HG2 PRO 60 -4.545 8.623 -9.663
362 HD3 PRO 60 HD2 PRO 60 -4.044 7.912 -7.458
363 H GLY 61 H GLY 61 0.309 10.144 -7.006
364 HA2 GLY 61 HA2 GLY 61 0.970 12.398 -8.826
365 HA3 GLY 61 HA3 GLY 61 0.415 12.751 -7.175
366 H LYS 62 H LYS 62 2.573 13.711 -6.848
367 HA LYS 62 HA LYS 62 4.956 12.123 -7.057
368 HB3 LYS 62 HB2 LYS 62 4.842 14.594 -5.350
369 HG3 LYS 62 HG2 LYS 62 6.507 13.911 -7.837
370 HD3 LYS 62 HD2 LYS 62 8.095 15.556 -6.821
371 HE3 LYS 62 HE2 LYS 62 6.887 17.670 -7.047
372 HZ1 LYS 62 HZ3 LYS 62 5.901 17.383 -9.185
373 HZ2 LYS 62 HZ1 LYS 62 7.276 16.489 -9.105
374 HZ3 LYS 62 HZ2 LYS 62 5.804 15.755 -9.002
375 H CYS 63 H CYS 63 6.208 12.882 -4.478
376 HA CYS 63 HA CYS 63 4.702 11.872 -2.322
377 HB3 CYS 63 HB2 CYS 63 6.046 9.901 -3.942
378 H HIS 64 H HIS 64 6.110 12.184 -0.298
379 HA HIS 64 HA HIS 64 8.644 13.681 -0.831
380 HB3 HIS 64 HB2 HIS 64 8.017 15.464 0.582
381 HD1 HIS 64 HD1 HIS 64 7.479 15.446 -2.468
382 HD2 HIS 64 HD2 HIS 64 4.435 15.656 0.412
383 HE1 HIS 64 HE1 HIS 64 5.434 16.456 -3.636
Start of MODEL 18
1 H1 VAL 1 H VAL 1 -15.757 -0.484 4.077
2 HA VAL 1 HA VAL 1 -13.218 0.334 4.845
3 HB VAL 1 HB VAL 1 -11.966 -1.800 4.583
4 HG11 VAL 1 1HG1 VAL 1 -12.450 -0.918 6.831
5 HG12 VAL 1 2HG1 VAL 1 -13.943 -1.878 6.890
6 HG13 VAL 1 3HG1 VAL 1 -12.365 -2.687 6.810
7 HG21 VAL 1 3HG2 VAL 1 -13.095 -3.965 4.802
8 HG22 VAL 1 1HG2 VAL 1 -14.681 -3.173 4.793
9 HG23 VAL 1 2HG2 VAL 1 -13.651 -3.129 3.346
10 H ARG 2 H ARG 2 -11.626 -0.411 2.939
11 HA ARG 2 HA ARG 2 -12.946 -0.897 0.375
12 HB3 ARG 2 HB2 ARG 2 -13.131 1.545 0.470
13 HG3 ARG 2 HG2 ARG 2 -10.319 1.362 1.534
14 HD3 ARG 2 HD2 ARG 2 -11.513 3.575 -0.111
15 HE ARG 2 HE ARG 2 -10.450 5.156 0.914
16 HH11 ARG 2 2HH2 ARG 2 -8.866 2.239 2.232
17 HH12 ARG 2 1HH2 ARG 2 -8.345 3.143 3.629
18 HH21 ARG 2 1HH1 ARG 2 -9.186 6.294 2.436
19 HH22 ARG 2 2HH1 ARG 2 -8.041 5.428 3.398
20 H ASP 3 H ASP 3 -10.834 -0.607 -1.264
21 HA ASP 3 HA ASP 3 -8.477 -1.875 0.074
22 HB3 ASP 3 HB2 ASP 3 -8.009 -3.149 -1.822
23 H ALA 4 H ALA 4 -6.433 -1.047 -0.799
24 HA ALA 4 HA ALA 4 -6.430 1.023 -2.785
25 HB1 ALA 4 HB3 ALA 4 -5.934 2.960 -1.327
26 HB2 ALA 4 HB1 ALA 4 -7.578 2.381 -1.063
27 HB3 ALA 4 HB2 ALA 4 -6.304 1.991 0.108
28 H TYR 5 H TYR 5 -4.361 2.224 -2.791
29 HA TYR 5 HA TYR 5 -1.997 0.584 -2.222
30 HB3 TYR 5 HB2 TYR 5 -0.853 2.655 -2.976
31 HD1 TYR 5 HD1 TYR 5 -4.010 2.849 -4.937
32 HD2 TYR 5 HD2 TYR 5 -0.067 1.147 -4.659
33 HE1 TYR 5 HE1 TYR 5 -4.317 1.788 -7.146
34 HE2 TYR 5 HE2 TYR 5 -0.309 0.212 -6.927
35 HH TYR 5 HH TYR 5 -3.510 0.248 -8.589
36 H ILE 6 H ILE 6 -1.459 0.423 0.024
37 HA ILE 6 HA ILE 6 -2.364 2.358 1.898
38 HB ILE 6 HB ILE 6 -1.737 0.063 2.451
39 HG13 ILE 6 2HG1 ILE 6 -1.802 1.997 4.100
40 HG21 ILE 6 1HG2 ILE 6 0.338 -0.113 1.023
41 HG22 ILE 6 2HG2 ILE 6 1.185 0.920 2.189
42 HG23 ILE 6 3HG2 ILE 6 0.581 -0.671 2.675
43 HD11 ILE 6 3HD1 ILE 6 -0.913 0.706 5.936
44 HD12 ILE 6 1HD1 ILE 6 -1.734 -0.377 4.785
45 HD13 ILE 6 2HD1 ILE 6 0.037 -0.296 4.822
46 H ALA 7 H ALA 7 -1.305 4.120 2.864
47 HA ALA 7 HA ALA 7 1.221 5.029 1.583
48 HB1 ALA 7 HB3 ALA 7 -0.614 6.190 0.500
49 HB2 ALA 7 HB1 ALA 7 -1.280 6.692 2.067
50 HB3 ALA 7 HB2 ALA 7 0.297 7.311 1.531
51 H GLN 8 H GLN 8 2.626 6.006 2.929
52 HA GLN 8 HA GLN 8 1.840 6.536 5.765
53 HB3 GLN 8 HB2 GLN 8 3.353 4.555 5.477
54 HG3 GLN 8 HG2 GLN 8 5.430 6.630 4.606
55 HE21 GLN 8 1HE2 GLN 8 6.482 4.122 3.060
56 HE22 GLN 8 2HE2 GLN 8 7.405 3.324 4.316
57 H ASN 9 H ASN 9 3.852 7.972 6.610
58 HA ASN 9 HA ASN 9 3.735 10.598 5.629
59 HB3 ASN 9 HB2 ASN 9 4.455 10.202 7.809
60 HD21 ASN 9 1HD2 ASN 9 7.792 9.906 7.299
61 HD22 ASN 9 2HD2 ASN 9 7.940 8.242 7.831
62 H TYR 10 H TYR 10 5.971 10.476 2.748
63 HA TYR 10 HA TYR 10 3.255 11.211 3.751
64 HB3 TYR 10 HB2 TYR 10 4.804 13.220 2.213
65 HD1 TYR 10 HD2 TYR 10 2.370 13.944 1.967
66 HD2 TYR 10 HD1 TYR 10 4.326 13.644 5.798
67 HE1 TYR 10 HE2 TYR 10 0.567 15.300 3.002
68 HE2 TYR 10 HE1 TYR 10 2.526 14.990 6.826
69 HH TYR 10 HH TYR 10 0.534 16.107 6.482
70 H ASN 11 H ASN 11 2.219 9.841 2.486
71 HA ASN 11 HA ASN 11 0.956 9.351 0.687
72 HB3 ASN 11 HB2 ASN 11 2.713 10.782 -1.297
73 HD21 ASN 11 1HD2 ASN 11 1.565 11.491 -3.166
74 HD22 ASN 11 2HD2 ASN 11 0.044 10.727 -3.596
75 H CYS 12 H CYS 12 3.642 8.176 1.641
76 HA CYS 12 HA CYS 12 4.807 7.185 -0.920
77 HB3 CYS 12 HB2 CYS 12 6.760 6.670 0.509
78 H VAL 13 H VAL 13 5.304 4.996 -1.211
79 HA VAL 13 HA VAL 13 3.576 3.085 0.236
80 HB VAL 13 HB VAL 13 4.246 1.505 -1.497
81 HG11 VAL 13 1HG1 VAL 13 2.404 3.077 -1.923
82 HG12 VAL 13 2HG1 VAL 13 3.550 4.184 -2.716
83 HG13 VAL 13 3HG1 VAL 13 3.245 2.578 -3.401
84 HG21 VAL 13 3HG2 VAL 13 5.694 2.121 -3.364
85 HG22 VAL 13 1HG2 VAL 13 6.032 3.705 -2.649
86 HG23 VAL 13 2HG2 VAL 13 6.618 2.226 -1.862
87 H TYR 14 H TYR 14 5.237 0.809 0.071
88 HA TYR 14 HA TYR 14 7.642 1.400 1.712
89 HB3 TYR 14 HB2 TYR 14 7.274 -0.911 2.643
90 HD1 TYR 14 HD1 TYR 14 3.865 0.574 2.771
91 HD2 TYR 14 HD2 TYR 14 7.763 0.401 4.620
92 HE1 TYR 14 HE1 TYR 14 2.965 1.694 4.788
93 HE2 TYR 14 HE2 TYR 14 6.869 1.585 6.600
94 HH TYR 14 HH TYR 14 5.105 3.178 7.060
95 H HIS 15 H HIS 15 9.436 0.111 1.082
96 HA HIS 15 HA HIS 15 9.442 -0.931 -1.655
97 HB3 HIS 15 HB2 HIS 15 11.784 -1.442 -1.166
98 HD1 HIS 15 HD1 HIS 15 13.448 0.862 0.299
99 HD2 HIS 15 HD2 HIS 15 9.976 1.360 -2.034
100 HE1 HIS 15 HE1 HIS 15 13.466 3.271 -0.550
101 H CYS 16 H CYS 16 7.567 -2.335 -1.071
102 HA CYS 16 HA CYS 16 7.858 -4.411 0.795
103 HB3 CYS 16 HB2 CYS 16 5.757 -3.472 0.103
104 H ALA 17 H ALA 17 9.875 -5.286 0.388
105 HA ALA 17 HA ALA 17 10.919 -6.565 -1.732
106 HB1 ALA 17 HB3 ALA 17 12.109 -8.045 -0.160
107 HB2 ALA 17 HB1 ALA 17 12.008 -6.387 0.466
108 HB3 ALA 17 HB2 ALA 17 10.934 -7.650 1.115
109 H ARG 18 H ARG 18 8.166 -7.854 0.087
110 HA ARG 18 HA ARG 18 7.763 -9.852 -2.025
111 HB3 ARG 18 HB2 ARG 18 7.039 -11.536 -0.264
112 HG3 ARG 18 HG2 ARG 18 9.268 -12.270 0.497
113 HD3 ARG 18 HD2 ARG 18 9.300 -11.363 -2.411
114 HE ARG 18 HE ARG 18 11.158 -12.906 -0.964
115 HH11 ARG 18 2HH2 ARG 18 9.256 -13.066 -3.915
116 HH12 ARG 18 1HH2 ARG 18 10.386 -14.033 -4.812
117 HH21 ARG 18 1HH1 ARG 18 12.712 -14.202 -2.105
118 HH22 ARG 18 2HH1 ARG 18 12.411 -14.696 -3.739
119 H ASP 19 H ASP 19 5.617 -10.528 -2.198
120 HA ASP 19 HA ASP 19 3.500 -8.648 -1.729
121 HB3 ASP 19 HB2 ASP 19 3.483 -10.259 -3.600
122 H ALA 20 H ALA 20 4.613 -11.699 -0.268
123 HA ALA 20 HA ALA 20 2.848 -11.778 1.917
124 HB1 ALA 20 HB3 ALA 20 5.799 -12.578 1.899
125 HB2 ALA 20 HB1 ALA 20 4.576 -13.128 3.065
126 HB3 ALA 20 HB2 ALA 20 4.441 -13.591 1.356
127 H TYR 21 H TYR 21 5.864 -9.849 1.650
128 HA TYR 21 HA TYR 21 5.809 -8.926 4.389
129 HB3 TYR 21 HB2 TYR 21 7.120 -7.733 1.922
130 HD1 TYR 21 HD1 TYR 21 6.566 -5.400 2.433
131 HD2 TYR 21 HD2 TYR 21 8.423 -7.931 5.382
132 HE1 TYR 21 HE1 TYR 21 7.161 -3.400 3.769
133 HE2 TYR 21 HE2 TYR 21 8.989 -5.939 6.732
134 HH TYR 21 HH TYR 21 8.894 -3.637 6.881
135 H CYS 22 H CYS 22 4.597 -7.620 1.265
136 HA CYS 22 HA CYS 22 3.396 -5.274 2.393
137 HB3 CYS 22 HB2 CYS 22 2.605 -6.968 -0.014
138 H ASN 23 H ASN 23 1.968 -8.556 1.921
139 HA ASN 23 HA ASN 23 -0.563 -7.965 2.995
140 HB3 ASN 23 HB2 ASN 23 0.988 -10.581 3.178
141 HD21 ASN 23 1HD2 ASN 23 -0.193 -10.941 5.280
142 HD22 ASN 23 2HD2 ASN 23 -1.881 -11.392 5.179
143 H GLU 24 H GLU 24 2.392 -9.171 4.689
144 HA GLU 24 HA GLU 24 1.439 -9.250 7.311
145 HB3 GLU 24 HB2 GLU 24 4.169 -8.573 6.137
146 HG3 GLU 24 HG2 GLU 24 3.346 -8.922 9.022
147 H LEU 25 H LEU 25 2.841 -6.477 5.481
148 HA LEU 25 HA LEU 25 2.765 -4.670 7.626
149 HB3 LEU 25 HB2 LEU 25 2.535 -3.934 4.665
150 HG LEU 25 HG LEU 25 3.399 -2.540 7.197
151 HD11 LEU 25 1HD1 LEU 25 5.514 -2.806 5.961
152 HD12 LEU 25 2HD1 LEU 25 4.754 -2.110 4.509
153 HD13 LEU 25 3HD1 LEU 25 4.963 -1.130 5.982
154 HD21 LEU 25 3HD2 LEU 25 1.318 -1.893 5.923
155 HD22 LEU 25 1HD2 LEU 25 2.501 -0.585 6.043
156 HD23 LEU 25 2HD2 LEU 25 2.339 -1.498 4.527
157 H CYS 26 H CYS 26 0.386 -5.274 5.040
158 HA CYS 26 HA CYS 26 -1.608 -3.442 5.716
159 HB3 CYS 26 HB2 CYS 26 -3.165 -4.990 4.622
160 H THR 27 H THR 27 -1.269 -6.860 6.933
161 HA THR 27 HA THR 27 -3.396 -6.574 8.844
162 HB THR 27 HB THR 27 -2.294 -8.613 9.891
163 HG1 THR 27 HG1 THR 27 -0.200 -7.950 8.630
164 HG21 THR 27 3HG2 THR 27 -2.968 -8.673 6.914
165 HG22 THR 27 1HG2 THR 27 -2.964 -10.071 8.007
166 HG23 THR 27 2HG2 THR 27 -4.136 -8.764 8.250
167 H LYS 28 H LYS 28 -0.005 -5.653 9.010
168 HA LYS 28 HA LYS 28 0.044 -5.339 11.870
169 HB3 LYS 28 HB2 LYS 28 1.842 -3.760 10.028
170 HG3 LYS 28 HG2 LYS 28 2.382 -5.520 12.470
171 HD3 LYS 28 HD2 LYS 28 4.536 -4.333 12.569
172 HE3 LYS 28 HE2 LYS 28 5.734 -5.095 10.598
173 HZ1 LYS 28 HZ3 LYS 28 4.882 -6.881 12.025
174 HZ2 LYS 28 HZ1 LYS 28 3.588 -7.061 11.011
175 HZ3 LYS 28 HZ2 LYS 28 5.106 -7.341 10.480
176 H ASN 29 H ASN 29 -1.063 -3.384 9.153
177 HA ASN 29 HA ASN 29 -1.052 -0.886 10.791
178 HB3 ASN 29 HB2 ASN 29 -1.821 0.094 8.551
179 HD21 ASN 29 1HD2 ASN 29 0.946 -2.209 8.538
180 HD22 ASN 29 2HD2 ASN 29 2.183 -0.957 8.616
181 H GLY 30 H GLY 30 -3.328 -2.808 8.802
182 HA2 GLY 30 HA2 GLY 30 -5.456 -3.108 10.361
183 HA3 GLY 30 HA3 GLY 30 -5.645 -1.386 9.989
184 H ALA 31 H ALA 31 -4.627 -4.255 8.019
185 HA ALA 31 HA ALA 31 -7.169 -4.116 6.524
186 HB1 ALA 31 HB3 ALA 31 -5.347 -4.560 4.501
187 HB2 ALA 31 HB1 ALA 31 -6.200 -3.040 4.797
188 HB3 ALA 31 HB2 ALA 31 -4.545 -3.270 5.420
189 H LYS 32 H LYS 32 -7.791 -6.151 5.802
190 HA LYS 32 HA LYS 32 -6.674 -8.175 7.444
191 HB3 LYS 32 HB2 LYS 32 -9.073 -7.981 6.707
192 HG3 LYS 32 HG2 LYS 32 -8.104 -9.748 4.395
193 HD3 LYS 32 HD2 LYS 32 -10.868 -8.886 5.343
194 HE3 LYS 32 HE2 LYS 32 -11.581 -10.909 3.926
195 HZ1 LYS 32 HZ3 LYS 32 -11.805 -9.594 1.955
196 HZ2 LYS 32 HZ1 LYS 32 -11.908 -8.553 3.248
197 HZ3 LYS 32 HZ2 LYS 32 -10.578 -8.584 2.418
198 H SER 33 H SER 33 -6.022 -7.452 4.053
199 HA SER 33 HA SER 33 -3.714 -9.221 4.154
200 HB3 SER 33 HB2 SER 33 -5.283 -10.915 3.549
201 HG SER 33 HG SER 33 -6.748 -10.572 1.785
202 H GLY 34 H GLY 34 -2.580 -9.158 1.799
203 HA2 GLY 34 HA2 GLY 34 -3.402 -7.069 0.012
204 HA3 GLY 34 HA3 GLY 34 -2.038 -6.528 1.012
205 H SER 35 H SER 35 -1.173 -6.482 -1.367
206 HA SER 35 HA SER 35 0.804 -8.545 -1.489
207 HB3 SER 35 HB2 SER 35 -0.908 -9.901 -2.523
208 HG SER 35 HG SER 35 -2.044 -9.117 -4.345
209 H CYS 36 H CYS 36 2.269 -8.119 -3.448
210 HA CYS 36 HA CYS 36 2.584 -5.201 -3.697
211 HB3 CYS 36 HB2 CYS 36 4.792 -5.863 -4.715
212 HA PRO 37 HA PRO 37 1.060 -6.074 -8.011
213 HB3 PRO 37 HB2 PRO 37 -0.789 -4.707 -7.748
214 HG3 PRO 37 HG2 PRO 37 -0.731 -2.807 -6.279
215 HD3 PRO 37 HD2 PRO 37 -0.244 -4.829 -5.078
216 H TYR 38 H TYR 38 2.415 -5.910 -9.660
217 HA TYR 38 HA TYR 38 4.876 -4.245 -9.488
218 HB3 TYR 38 HB2 TYR 38 5.742 -5.973 -11.024
219 HD1 TYR 38 HD1 TYR 38 6.334 -5.399 -8.250
220 HD2 TYR 38 HD2 TYR 38 4.207 -8.795 -9.842
221 HE1 TYR 38 HE1 TYR 38 6.802 -6.650 -6.187
222 HE2 TYR 38 HE2 TYR 38 4.681 -10.054 -7.773
223 HH TYR 38 HH TYR 38 5.568 -9.969 -5.647
224 H LEU 39 H LEU 39 2.208 -5.097 -11.552
225 HA LEU 39 HA LEU 39 2.798 -2.784 -13.373
226 HB3 LEU 39 HB2 LEU 39 1.346 -3.882 -14.998
227 HG LEU 39 HG LEU 39 3.339 -5.952 -13.953
228 HD11 LEU 39 1HD1 LEU 39 1.654 -6.874 -15.501
229 HD12 LEU 39 2HD1 LEU 39 2.039 -5.608 -16.687
230 HD13 LEU 39 3HD1 LEU 39 3.259 -6.823 -16.250
231 HD21 LEU 39 3HD2 LEU 39 3.670 -3.712 -16.003
232 HD22 LEU 39 1HD2 LEU 39 4.515 -3.867 -14.444
233 HD23 LEU 39 2HD2 LEU 39 4.833 -5.028 -15.735
234 H GLY 40 H GLY 40 1.901 -2.213 -10.813
235 HA2 GLY 40 HA2 GLY 40 -1.047 -2.078 -10.781
236 HA3 GLY 40 HA3 GLY 40 0.095 -1.464 -9.571
237 H GLU 41 H GLU 41 -1.730 0.241 -9.878
238 HA GLU 41 HA GLU 41 -1.318 2.256 -11.958
239 HB3 GLU 41 HB2 GLU 41 -2.867 2.512 -9.360
240 HG3 GLU 41 HG2 GLU 41 -3.458 3.609 -12.132
241 H HIS 42 H HIS 42 0.928 1.730 -10.980
242 HA HIS 42 HA HIS 42 2.251 3.890 -9.614
243 HB3 HIS 42 HB2 HIS 42 2.071 1.338 -7.976
244 HD1 HIS 42 HD1 HIS 42 4.637 2.492 -7.414
245 HD2 HIS 42 HD2 HIS 42 1.095 4.237 -6.016
246 HE1 HIS 42 HE1 HIS 42 5.335 4.132 -5.556
247 H LYS 43 H LYS 43 2.494 1.340 -11.816
248 HA LYS 43 HA LYS 43 3.676 -0.398 -12.194
249 HB3 LYS 43 HB2 LYS 43 6.066 1.244 -11.234
250 HG3 LYS 43 HG2 LYS 43 6.506 -1.213 -11.844
251 HD3 LYS 43 HD2 LYS 43 5.707 -0.134 -14.608
252 HE3 LYS 43 HE2 LYS 43 6.260 -2.437 -15.397
253 HZ1 LYS 43 HZ3 LYS 43 8.592 -1.156 -14.145
254 HZ2 LYS 43 HZ1 LYS 43 8.614 -2.237 -15.380
255 HZ3 LYS 43 HZ2 LYS 43 7.952 -0.751 -15.610
256 H PHE 44 H PHE 44 5.829 0.348 -9.484
257 HA PHE 44 HA PHE 44 5.158 -2.284 -8.268
258 HB3 PHE 44 HB2 PHE 44 7.505 -0.420 -7.785
259 HD1 PHE 44 HD1 PHE 44 7.048 -0.921 -5.255
260 HD2 PHE 44 HD2 PHE 44 8.184 -3.923 -8.151
261 HE1 PHE 44 HE1 PHE 44 7.709 -2.451 -3.431
262 HE2 PHE 44 HE2 PHE 44 8.980 -5.374 -6.319
263 HZ PHE 44 HZ PHE 44 8.724 -4.659 -3.962
264 H ALA 45 H ALA 45 3.967 -2.264 -6.349
265 HA ALA 45 HA ALA 45 4.477 -0.183 -4.382
266 HB1 ALA 45 HB3 ALA 45 2.731 0.935 -5.745
267 HB2 ALA 45 HB1 ALA 45 1.663 -0.465 -5.530
268 HB3 ALA 45 HB2 ALA 45 2.122 0.543 -4.139
269 H CYS 46 H CYS 46 2.717 -0.611 -2.518
270 HA CYS 46 HA CYS 46 2.156 -3.521 -2.176
271 HB3 CYS 46 HB2 CYS 46 2.748 -1.350 -0.134
272 H TYR 47 H TYR 47 -0.015 -3.903 -2.347
273 HA TYR 47 HA TYR 47 -1.915 -1.634 -1.960
274 HB3 TYR 47 HB2 TYR 47 -2.193 -3.956 -3.894
275 HD1 TYR 47 HD2 TYR 47 -4.632 -4.305 -3.090
276 HD2 TYR 47 HD1 TYR 47 -3.181 -0.528 -4.572
277 HE1 TYR 47 HE2 TYR 47 -6.931 -3.656 -3.730
278 HE2 TYR 47 HE1 TYR 47 -5.500 0.158 -5.096
279 HH TYR 47 HH TYR 47 -7.751 -0.424 -4.974
280 H CYS 48 H CYS 48 -3.406 -1.970 -0.459
281 HA CYS 48 HA CYS 48 -3.444 -4.592 0.958
282 HB3 CYS 48 HB2 CYS 48 -4.246 -3.231 2.879
283 H LYS 49 H LYS 49 -5.374 -5.303 1.710
284 HA LYS 49 HA LYS 49 -7.770 -4.542 0.165
285 HB3 LYS 49 HB2 LYS 49 -7.371 -7.187 1.582
286 HG3 LYS 49 HG2 LYS 49 -9.444 -6.558 0.212
287 HD3 LYS 49 HD2 LYS 49 -8.125 -5.611 -1.729
288 HE3 LYS 49 HE2 LYS 49 -7.774 -8.537 -2.482
289 HZ1 LYS 49 HZ3 LYS 49 -7.089 -6.046 -3.900
290 HZ2 LYS 49 HZ1 LYS 49 -6.778 -7.572 -4.437
291 HZ3 LYS 49 HZ2 LYS 49 -8.334 -7.038 -4.293
292 H ASP 50 H ASP 50 -9.653 -4.127 1.410
293 HA ASP 50 HA ASP 50 -10.932 -3.637 3.200
294 HB3 ASP 50 HB2 ASP 50 -10.776 -5.176 5.159
295 H LEU 51 H LEU 51 -8.856 -1.856 2.838
296 HA LEU 51 HA LEU 51 -7.756 -1.093 5.471
297 HB3 LEU 51 HB2 LEU 51 -7.306 1.106 4.160
298 HG LEU 51 HG LEU 51 -5.936 -1.401 3.152
299 HD11 LEU 51 1HD1 LEU 51 -5.404 1.581 2.757
300 HD12 LEU 51 2HD1 LEU 51 -4.161 0.355 2.489
301 HD13 LEU 51 3HD1 LEU 51 -5.641 0.325 1.517
302 HD21 LEU 51 3HD2 LEU 51 -4.110 -0.626 4.678
303 HD22 LEU 51 1HD2 LEU 51 -5.156 0.696 5.230
304 HD23 LEU 51 2HD2 LEU 51 -5.572 -0.974 5.600
305 HA PRO 52 HA PRO 52 -11.529 1.357 6.212
306 HB3 PRO 52 HB2 PRO 52 -11.045 1.165 8.486
307 HG3 PRO 52 HG2 PRO 52 -8.776 1.322 9.294
308 HD3 PRO 52 HD2 PRO 52 -8.835 -0.475 7.736
309 H ASP 53 H ASP 53 -12.070 3.616 6.042
310 HA ASP 53 HA ASP 53 -10.990 5.098 3.907
311 HB3 ASP 53 HB2 ASP 53 -13.301 5.269 4.714
312 H ASN 54 H ASN 54 -10.734 5.304 7.427
313 HA ASN 54 HA ASN 54 -9.214 7.494 7.928
314 HB3 ASN 54 HB2 ASN 54 -8.950 4.749 9.220
315 HD21 ASN 54 1HD2 ASN 54 -6.961 4.680 10.274
316 HD22 ASN 54 2HD2 ASN 54 -6.365 6.029 11.228
317 H VAL 55 H VAL 55 -7.834 4.389 6.712
318 HA VAL 55 HA VAL 55 -5.102 5.440 7.065
319 HB VAL 55 HB VAL 55 -6.122 2.875 5.817
320 HG11 VAL 55 1HG1 VAL 55 -3.662 2.234 5.839
321 HG12 VAL 55 2HG1 VAL 55 -4.050 3.484 4.649
322 HG13 VAL 55 3HG1 VAL 55 -3.267 3.915 6.187
323 HG21 VAL 55 3HG2 VAL 55 -5.089 1.843 7.790
324 HG22 VAL 55 1HG2 VAL 55 -4.490 3.418 8.346
325 HG23 VAL 55 2HG2 VAL 55 -6.226 3.083 8.340
326 HA PRO 56 HA PRO 56 -5.808 7.687 3.297
327 HB3 PRO 56 HB2 PRO 56 -4.366 9.293 4.101
328 HG3 PRO 56 HG2 PRO 56 -2.389 8.687 5.326
329 HD3 PRO 56 HD2 PRO 56 -4.252 7.652 6.401
330 H ILE 57 H ILE 57 -5.385 7.631 1.048
331 HA ILE 57 HA ILE 57 -4.276 5.061 0.069
332 HB ILE 57 HB ILE 57 -5.600 5.347 -1.860
333 HG13 ILE 57 2HG1 ILE 57 -5.979 8.206 -0.971
334 HG21 ILE 57 1HG2 ILE 57 -7.369 6.191 0.455
335 HG22 ILE 57 2HG2 ILE 57 -7.781 5.145 -0.917
336 HG23 ILE 57 3HG2 ILE 57 -6.654 4.572 0.329
337 HD11 ILE 57 3HD1 ILE 57 -6.093 8.572 -3.413
338 HD12 ILE 57 1HD1 ILE 57 -4.626 7.665 -3.025
339 HD13 ILE 57 2HD1 ILE 57 -6.031 6.825 -3.703
340 H ARG 58 H ARG 58 -2.598 5.046 -1.397
341 HA ARG 58 HA ARG 58 -0.790 7.265 -1.524
342 HB3 ARG 58 HB2 ARG 58 -0.854 4.947 -3.473
343 HG3 ARG 58 HG2 ARG 58 1.456 4.893 -3.366
344 HD3 ARG 58 HD2 ARG 58 0.863 7.844 -3.324
345 HE ARG 58 HE ARG 58 2.967 6.179 -4.648
346 HH11 ARG 58 2HH2 ARG 58 1.461 9.376 -4.385
347 HH12 ARG 58 1HH2 ARG 58 2.937 10.253 -4.674
348 HH21 ARG 58 1HH1 ARG 58 4.720 7.364 -5.706
349 HH22 ARG 58 2HH1 ARG 58 4.479 9.090 -5.964
350 H VAL 59 H VAL 59 -1.519 9.208 -2.577
351 HA VAL 59 HA VAL 59 -3.306 9.061 -4.854
352 HB VAL 59 HB VAL 59 -1.923 11.169 -3.194
353 HG11 VAL 59 1HG1 VAL 59 -2.779 12.918 -4.697
354 HG12 VAL 59 2HG1 VAL 59 -1.440 11.977 -5.370
355 HG13 VAL 59 3HG1 VAL 59 -3.111 11.670 -5.929
356 HG21 VAL 59 3HG2 VAL 59 -4.798 10.786 -4.099
357 HG22 VAL 59 1HG2 VAL 59 -4.126 10.264 -2.538
358 HG23 VAL 59 2HG2 VAL 59 -4.198 11.989 -2.939
359 HA PRO 60 HA PRO 60 0.233 7.942 -7.287
360 HB3 PRO 60 HB2 PRO 60 -1.268 6.761 -8.565
361 HG3 PRO 60 HG2 PRO 60 -3.393 7.681 -9.188
362 HD3 PRO 60 HD2 PRO 60 -3.224 7.722 -6.817
363 H GLY 61 H GLY 61 1.286 9.974 -6.566
364 HA2 GLY 61 HA2 GLY 61 2.423 11.269 -8.903
365 HA3 GLY 61 HA3 GLY 61 1.430 12.376 -7.934
366 H LYS 62 H LYS 62 2.758 13.584 -6.666
367 HA LYS 62 HA LYS 62 5.424 12.875 -5.945
368 HB3 LYS 62 HB2 LYS 62 5.152 14.735 -4.251
369 HG3 LYS 62 HG2 LYS 62 5.957 15.075 -6.628
370 HD3 LYS 62 HD2 LYS 62 3.782 15.072 -7.876
371 HE3 LYS 62 HE2 LYS 62 3.306 17.584 -6.175
372 HZ1 LYS 62 HZ3 LYS 62 1.812 16.730 -8.567
373 HZ2 LYS 62 HZ1 LYS 62 1.412 17.966 -7.560
374 HZ3 LYS 62 HZ2 LYS 62 2.782 18.057 -8.458
375 H CYS 63 H CYS 63 6.286 12.459 -3.829
376 HA CYS 63 HA CYS 63 4.626 11.700 -1.627
377 HB3 CYS 63 HB2 CYS 63 5.646 9.633 -3.435
378 H HIS 64 H HIS 64 6.082 11.958 0.312
379 HA HIS 64 HA HIS 64 8.881 12.687 -0.179
380 HB3 HIS 64 HB2 HIS 64 7.868 14.730 -0.942
381 HD1 HIS 64 HD1 HIS 64 6.877 15.975 2.458
382 HD2 HIS 64 HD2 HIS 64 5.101 14.528 -1.076
383 HE1 HIS 64 HE1 HIS 64 4.427 16.674 2.527
Start of MODEL 19
1 H1 VAL 1 H VAL 1 -13.645 1.685 4.990
2 HA VAL 1 HA VAL 1 -11.025 0.486 5.111
3 HB VAL 1 HB VAL 1 -11.921 -1.831 4.957
4 HG11 VAL 1 1HG1 VAL 1 -12.215 -2.143 7.377
5 HG12 VAL 1 2HG1 VAL 1 -10.890 -1.026 7.023
6 HG13 VAL 1 3HG1 VAL 1 -12.456 -0.395 7.586
7 HG21 VAL 1 3HG2 VAL 1 -14.128 -2.369 5.863
8 HG22 VAL 1 1HG2 VAL 1 -14.521 -0.647 6.017
9 HG23 VAL 1 2HG2 VAL 1 -14.285 -1.376 4.413
10 H ARG 2 H ARG 2 -10.273 0.076 3.055
11 HA ARG 2 HA ARG 2 -12.123 -0.504 0.877
12 HB3 ARG 2 HB2 ARG 2 -12.146 1.923 0.765
13 HG3 ARG 2 HG2 ARG 2 -9.823 2.973 0.237
14 HD3 ARG 2 HD2 ARG 2 -10.294 2.523 3.213
15 HE ARG 2 HE ARG 2 -10.110 5.191 2.365
16 HH11 ARG 2 2HH2 ARG 2 -8.061 2.532 3.473
17 HH12 ARG 2 1HH2 ARG 2 -6.754 3.652 3.852
18 HH21 ARG 2 1HH1 ARG 2 -8.650 6.397 3.262
19 HH22 ARG 2 2HH1 ARG 2 -7.093 5.800 3.790
20 H ASP 3 H ASP 3 -10.836 -1.282 -1.000
21 HA ASP 3 HA ASP 3 -8.207 -2.391 -0.163
22 HB3 ASP 3 HB2 ASP 3 -8.127 -3.432 -2.350
23 H ALA 4 H ALA 4 -6.378 -1.186 -0.665
24 HA ALA 4 HA ALA 4 -6.461 0.901 -2.727
25 HB1 ALA 4 HB3 ALA 4 -6.153 2.735 -1.127
26 HB2 ALA 4 HB1 ALA 4 -7.756 1.993 -0.961
27 HB3 ALA 4 HB2 ALA 4 -6.479 1.630 0.227
28 H TYR 5 H TYR 5 -4.423 1.981 -2.945
29 HA TYR 5 HA TYR 5 -2.112 0.334 -2.341
30 HB3 TYR 5 HB2 TYR 5 -0.884 2.281 -3.311
31 HD1 TYR 5 HD1 TYR 5 -0.512 0.087 -4.489
32 HD2 TYR 5 HD2 TYR 5 -3.913 2.593 -5.338
33 HE1 TYR 5 HE1 TYR 5 -0.849 -1.094 -6.633
34 HE2 TYR 5 HE2 TYR 5 -4.392 1.241 -7.363
35 HH TYR 5 HH TYR 5 -2.145 -1.181 -8.602
36 H ILE 6 H ILE 6 -1.445 0.212 -0.151
37 HA ILE 6 HA ILE 6 -2.069 2.395 1.627
38 HB ILE 6 HB ILE 6 -1.842 0.044 2.331
39 HG13 ILE 6 2HG1 ILE 6 -1.753 1.886 3.929
40 HG21 ILE 6 1HG2 ILE 6 0.208 -0.463 0.944
41 HG22 ILE 6 2HG2 ILE 6 1.172 0.434 2.127
42 HG23 ILE 6 3HG2 ILE 6 0.303 -1.036 2.608
43 HD11 ILE 6 3HD1 ILE 6 0.348 -0.139 4.693
44 HD12 ILE 6 1HD1 ILE 6 -0.814 0.675 5.752
45 HD13 ILE 6 2HD1 ILE 6 -1.370 -0.564 4.589
46 H ALA 7 H ALA 7 -0.723 3.992 2.477
47 HA ALA 7 HA ALA 7 2.036 4.222 1.475
48 HB1 ALA 7 HB3 ALA 7 -0.046 6.433 1.143
49 HB2 ALA 7 HB1 ALA 7 1.687 6.504 0.739
50 HB3 ALA 7 HB2 ALA 7 0.605 5.430 -0.173
51 H GLN 8 H GLN 8 3.316 5.496 2.856
52 HA GLN 8 HA GLN 8 2.169 5.882 5.579
53 HB3 GLN 8 HB2 GLN 8 4.141 4.429 5.194
54 HG3 GLN 8 HG2 GLN 8 5.954 6.782 5.000
55 HE21 GLN 8 1HE2 GLN 8 5.658 4.451 2.399
56 HE22 GLN 8 2HE2 GLN 8 7.028 3.463 2.871
57 H ASN 9 H ASN 9 3.628 7.758 6.666
58 HA ASN 9 HA ASN 9 2.876 10.314 5.665
59 HB3 ASN 9 HB2 ASN 9 4.625 11.148 7.229
60 HD21 ASN 9 1HD2 ASN 9 3.938 8.667 9.414
61 HD22 ASN 9 2HD2 ASN 9 2.387 9.274 9.960
62 H TYR 10 H TYR 10 5.511 10.812 3.167
63 HA TYR 10 HA TYR 10 2.566 10.869 3.732
64 HB3 TYR 10 HB2 TYR 10 4.178 13.104 2.484
65 HD1 TYR 10 HD1 TYR 10 2.390 13.531 0.848
66 HD2 TYR 10 HD2 TYR 10 1.514 13.221 5.060
67 HE1 TYR 10 HE1 TYR 10 0.075 14.313 0.430
68 HE2 TYR 10 HE2 TYR 10 -0.792 14.004 4.639
69 HH TYR 10 HH TYR 10 -2.327 14.670 3.050
70 H ASN 11 H ASN 11 1.921 9.388 2.284
71 HA ASN 11 HA ASN 11 1.152 8.713 0.287
72 HB3 ASN 11 HB2 ASN 11 2.664 10.748 -1.333
73 HD21 ASN 11 1HD2 ASN 11 1.662 11.104 -3.349
74 HD22 ASN 11 2HD2 ASN 11 0.274 10.160 -3.886
75 H CYS 12 H CYS 12 3.954 8.170 1.440
76 HA CYS 12 HA CYS 12 5.468 7.451 -1.023
77 HB3 CYS 12 HB2 CYS 12 7.368 7.223 0.392
78 H VAL 13 H VAL 13 5.645 5.352 -1.622
79 HA VAL 13 HA VAL 13 4.021 3.335 -0.271
80 HB VAL 13 HB VAL 13 4.771 1.832 -2.059
81 HG11 VAL 13 1HG1 VAL 13 3.674 2.973 -3.918
82 HG12 VAL 13 2HG1 VAL 13 2.824 3.288 -2.394
83 HG13 VAL 13 3HG1 VAL 13 3.870 4.540 -3.111
84 HG21 VAL 13 3HG2 VAL 13 7.071 2.662 -2.443
85 HG22 VAL 13 1HG2 VAL 13 6.128 2.615 -3.935
86 HG23 VAL 13 2HG2 VAL 13 6.421 4.165 -3.132
87 H TYR 14 H TYR 14 4.866 1.288 0.496
88 HA TYR 14 HA TYR 14 7.497 1.504 1.817
89 HB3 TYR 14 HB2 TYR 14 6.920 -0.694 2.751
90 HD1 TYR 14 HD1 TYR 14 7.157 1.000 4.608
91 HD2 TYR 14 HD2 TYR 14 3.470 0.461 2.445
92 HE1 TYR 14 HE1 TYR 14 5.911 2.003 6.490
93 HE2 TYR 14 HE2 TYR 14 2.221 1.467 4.339
94 HH TYR 14 HH TYR 14 3.827 2.508 7.350
95 H HIS 15 H HIS 15 9.232 0.104 1.276
96 HA HIS 15 HA HIS 15 9.421 -0.821 -1.472
97 HB3 HIS 15 HB2 HIS 15 11.619 -1.628 -0.772
98 HD1 HIS 15 HD1 HIS 15 10.749 1.121 -2.049
99 HD2 HIS 15 HD2 HIS 15 12.685 0.671 1.662
100 HE1 HIS 15 HE1 HIS 15 11.855 3.360 -1.522
101 H CYS 16 H CYS 16 7.477 -2.131 -1.460
102 HA CYS 16 HA CYS 16 7.011 -4.269 0.223
103 HB3 CYS 16 HB2 CYS 16 5.436 -3.270 -1.482
104 H ALA 17 H ALA 17 8.699 -5.606 0.765
105 HA ALA 17 HA ALA 17 10.601 -6.707 -0.957
106 HB1 ALA 17 HB3 ALA 17 11.013 -8.359 0.796
107 HB2 ALA 17 HB1 ALA 17 10.730 -6.763 1.519
108 HB3 ALA 17 HB2 ALA 17 9.451 -7.998 1.552
109 H ARG 18 H ARG 18 7.282 -7.757 -0.328
110 HA ARG 18 HA ARG 18 7.137 -9.154 -2.761
111 HB3 ARG 18 HB2 ARG 18 6.424 -11.053 -0.557
112 HG3 ARG 18 HG2 ARG 18 6.344 -11.395 -3.183
113 HD3 ARG 18 HD2 ARG 18 8.839 -10.807 -3.430
114 HE ARG 18 HE ARG 18 9.084 -13.649 -2.456
115 HH11 ARG 18 2HH2 ARG 18 10.463 -10.362 -2.294
116 HH12 ARG 18 1HH2 ARG 18 12.045 -10.915 -1.867
117 HH21 ARG 18 1HH1 ARG 18 11.122 -14.343 -1.708
118 HH22 ARG 18 2HH1 ARG 18 12.381 -13.197 -1.385
119 H ASP 19 H ASP 19 4.795 -10.374 -2.623
120 HA ASP 19 HA ASP 19 2.807 -8.406 -1.980
121 HB3 ASP 19 HB2 ASP 19 2.591 -9.926 -3.919
122 H ALA 20 H ALA 20 3.802 -11.610 -0.734
123 HA ALA 20 HA ALA 20 2.126 -11.733 1.525
124 HB1 ALA 20 HB3 ALA 20 3.805 -13.260 2.491
125 HB2 ALA 20 HB1 ALA 20 3.555 -13.592 0.765
126 HB3 ALA 20 HB2 ALA 20 5.009 -12.719 1.300
127 H TYR 21 H TYR 21 5.386 -10.209 1.357
128 HA TYR 21 HA TYR 21 5.519 -9.304 4.049
129 HB3 TYR 21 HB2 TYR 21 6.636 -8.212 1.464
130 HD1 TYR 21 HD1 TYR 21 6.328 -5.818 1.838
131 HD2 TYR 21 HD2 TYR 21 8.377 -8.287 4.717
132 HE1 TYR 21 HE1 TYR 21 7.410 -3.804 2.789
133 HE2 TYR 21 HE2 TYR 21 9.429 -6.263 5.694
134 HH TYR 21 HH TYR 21 8.905 -2.995 4.347
135 H CYS 22 H CYS 22 4.218 -7.668 1.118
136 HA CYS 22 HA CYS 22 3.182 -5.377 2.496
137 HB3 CYS 22 HB2 CYS 22 2.656 -6.826 -0.114
138 H ASN 23 H ASN 23 1.746 -8.583 1.923
139 HA ASN 23 HA ASN 23 -0.774 -8.050 3.084
140 HB3 ASN 23 HB2 ASN 23 0.501 -10.285 1.960
141 HD21 ASN 23 1HD2 ASN 23 -1.248 -10.341 5.195
142 HD22 ASN 23 2HD2 ASN 23 -0.539 -11.889 5.628
143 H GLU 24 H GLU 24 2.311 -9.116 4.621
144 HA GLU 24 HA GLU 24 1.262 -9.303 7.229
145 HB3 GLU 24 HB2 GLU 24 4.118 -8.659 6.305
146 HG3 GLU 24 HG2 GLU 24 2.866 -9.383 8.943
147 H LEU 25 H LEU 25 2.978 -6.548 5.659
148 HA LEU 25 HA LEU 25 2.727 -4.670 7.753
149 HB3 LEU 25 HB2 LEU 25 2.548 -4.084 4.731
150 HG LEU 25 HG LEU 25 3.385 -2.551 7.172
151 HD11 LEU 25 1HD1 LEU 25 4.934 -1.159 5.864
152 HD12 LEU 25 2HD1 LEU 25 5.520 -2.827 5.931
153 HD13 LEU 25 3HD1 LEU 25 4.734 -2.222 4.453
154 HD21 LEU 25 3HD2 LEU 25 1.303 -1.999 5.811
155 HD22 LEU 25 1HD2 LEU 25 2.461 -0.678 5.959
156 HD23 LEU 25 2HD2 LEU 25 2.368 -1.617 4.450
157 H CYS 26 H CYS 26 0.401 -5.492 5.199
158 HA CYS 26 HA CYS 26 -1.540 -3.509 5.856
159 HB3 CYS 26 HB2 CYS 26 -3.105 -5.207 4.736
160 H THR 27 H THR 27 -1.325 -6.961 6.929
161 HA THR 27 HA THR 27 -3.553 -6.697 8.711
162 HB THR 27 HB THR 27 -2.690 -8.783 9.763
163 HG1 THR 27 HG1 THR 27 -0.459 -8.152 8.211
164 HG21 THR 27 3HG2 THR 27 -3.032 -10.172 7.767
165 HG22 THR 27 1HG2 THR 27 -4.179 -8.817 7.794
166 HG23 THR 27 2HG2 THR 27 -2.774 -8.766 6.715
167 H LYS 28 H LYS 28 -0.109 -5.911 9.180
168 HA LYS 28 HA LYS 28 -0.099 -5.454 11.967
169 HB3 LYS 28 HB2 LYS 28 1.939 -4.017 11.054
170 HG3 LYS 28 HG2 LYS 28 2.901 -6.010 9.736
171 HD3 LYS 28 HD2 LYS 28 2.268 -6.768 12.621
172 HE3 LYS 28 HE2 LYS 28 4.472 -7.340 10.556
173 HZ1 LYS 28 HZ3 LYS 28 4.057 -8.867 13.008
174 HZ2 LYS 28 HZ1 LYS 28 5.046 -9.142 11.701
175 HZ3 LYS 28 HZ2 LYS 28 5.336 -7.841 12.691
176 H ASN 29 H ASN 29 -1.024 -3.481 9.104
177 HA ASN 29 HA ASN 29 -1.609 -1.093 10.723
178 HB3 ASN 29 HB2 ASN 29 -2.829 -0.437 8.533
179 HD21 ASN 29 1HD2 ASN 29 0.469 -1.850 8.166
180 HD22 ASN 29 2HD2 ASN 29 1.276 -0.285 8.163
181 H GLY 30 H GLY 30 -3.319 -3.954 9.645
182 HA2 GLY 30 HA2 GLY 30 -5.095 -4.775 11.044
183 HA3 GLY 30 HA3 GLY 30 -5.698 -3.135 11.280
184 H ALA 31 H ALA 31 -4.632 -4.167 8.083
185 HA ALA 31 HA ALA 31 -7.355 -3.938 7.023
186 HB1 ALA 31 HB3 ALA 31 -6.256 -3.383 5.107
187 HB2 ALA 31 HB1 ALA 31 -4.799 -3.292 6.081
188 HB3 ALA 31 HB2 ALA 31 -5.195 -4.791 5.211
189 H LYS 32 H LYS 32 -8.092 -5.730 5.414
190 HA LYS 32 HA LYS 32 -8.130 -8.222 6.838
191 HB3 LYS 32 HB2 LYS 32 -9.861 -7.356 5.107
192 HG3 LYS 32 HG2 LYS 32 -8.260 -9.250 3.323
193 HD3 LYS 32 HD2 LYS 32 -10.672 -9.086 2.699
194 HE3 LYS 32 HE2 LYS 32 -9.953 -6.207 2.876
195 HZ1 LYS 32 HZ3 LYS 32 -10.497 -5.933 0.667
196 HZ2 LYS 32 HZ1 LYS 32 -11.819 -6.963 0.766
197 HZ3 LYS 32 HZ2 LYS 32 -11.742 -5.526 1.572
198 H SER 33 H SER 33 -6.089 -7.048 4.159
199 HA SER 33 HA SER 33 -3.952 -8.834 4.582
200 HB3 SER 33 HB2 SER 33 -5.473 -10.603 3.751
201 HG SER 33 HG SER 33 -6.287 -10.413 1.631
202 H GLY 34 H GLY 34 -2.925 -8.889 1.866
203 HA2 GLY 34 HA2 GLY 34 -3.391 -6.434 0.523
204 HA3 GLY 34 HA3 GLY 34 -1.866 -6.379 1.444
205 H SER 35 H SER 35 -1.919 -6.282 -1.404
206 HA SER 35 HA SER 35 -0.086 -8.515 -1.837
207 HB3 SER 35 HB2 SER 35 -1.114 -9.273 -3.900
208 HG SER 35 HG SER 35 -2.140 -9.734 -1.620
209 H CYS 36 H CYS 36 1.476 -7.931 -3.498
210 HA CYS 36 HA CYS 36 1.463 -4.981 -4.009
211 HB3 CYS 36 HB2 CYS 36 3.882 -6.740 -3.794
212 HA PRO 37 HA PRO 37 1.390 -6.557 -8.364
213 HB3 PRO 37 HB2 PRO 37 -0.577 -5.531 -8.891
214 HG3 PRO 37 HG2 PRO 37 -1.456 -3.783 -7.506
215 HD3 PRO 37 HD2 PRO 37 -0.906 -5.683 -6.131
216 H TYR 38 H TYR 38 3.565 -6.623 -8.570
217 HA TYR 38 HA TYR 38 5.205 -4.208 -9.042
218 HB3 TYR 38 HB2 TYR 38 6.620 -6.039 -10.232
219 HD1 TYR 38 HD1 TYR 38 5.543 -7.047 -6.780
220 HD2 TYR 38 HD2 TYR 38 8.438 -4.956 -9.202
221 HE1 TYR 38 HE1 TYR 38 7.093 -6.943 -4.851
222 HE2 TYR 38 HE2 TYR 38 9.982 -4.869 -7.273
223 HH TYR 38 HH TYR 38 9.080 -5.933 -4.021
224 H LEU 39 H LEU 39 4.339 -6.935 -11.186
225 HA LEU 39 HA LEU 39 4.002 -5.115 -13.483
226 HB3 LEU 39 HB2 LEU 39 3.698 -7.201 -14.737
227 HG LEU 39 HG LEU 39 6.048 -7.487 -12.802
228 HD11 LEU 39 1HD1 LEU 39 5.505 -9.554 -14.037
229 HD12 LEU 39 2HD1 LEU 39 5.566 -8.661 -15.572
230 HD13 LEU 39 3HD1 LEU 39 7.035 -8.853 -14.592
231 HD21 LEU 39 3HD2 LEU 39 5.840 -6.079 -15.504
232 HD22 LEU 39 1HD2 LEU 39 6.203 -5.319 -13.936
233 HD23 LEU 39 2HD2 LEU 39 7.361 -6.437 -14.661
234 H GLY 40 H GLY 40 2.209 -4.001 -12.158
235 HA2 GLY 40 HA2 GLY 40 -0.307 -4.833 -13.308
236 HA3 GLY 40 HA3 GLY 40 -0.266 -5.109 -11.556
237 H GLU 41 H GLU 41 -2.098 -3.425 -12.239
238 HA GLU 41 HA GLU 41 -1.780 -0.841 -12.944
239 HB3 GLU 41 HB2 GLU 41 -3.770 -0.328 -11.646
240 HG3 GLU 41 HG2 GLU 41 -3.811 -2.125 -13.636
241 H HIS 42 H HIS 42 -1.071 1.060 -12.099
242 HA HIS 42 HA HIS 42 -0.083 2.575 -10.761
243 HB3 HIS 42 HB2 HIS 42 -0.183 0.756 -8.360
244 HD1 HIS 42 HD1 HIS 42 -2.106 3.965 -8.253
245 HD2 HIS 42 HD2 HIS 42 1.630 2.355 -7.300
246 HE1 HIS 42 HE1 HIS 42 -1.048 5.583 -6.586
247 H LYS 43 H LYS 43 1.059 -0.788 -10.345
248 HA LYS 43 HA LYS 43 2.954 -1.744 -10.713
249 HB3 LYS 43 HB2 LYS 43 3.449 0.807 -12.235
250 HG3 LYS 43 HG2 LYS 43 5.226 -0.462 -13.420
251 HD3 LYS 43 HD2 LYS 43 7.107 0.223 -12.262
252 HE3 LYS 43 HE2 LYS 43 5.530 2.163 -12.864
253 HZ1 LYS 43 HZ3 LYS 43 3.978 2.233 -11.042
254 HZ2 LYS 43 HZ1 LYS 43 5.110 2.000 -9.944
255 HZ3 LYS 43 HZ2 LYS 43 5.026 3.454 -10.737
256 H PHE 44 H PHE 44 3.973 -2.476 -9.066
257 HA PHE 44 HA PHE 44 5.353 -2.759 -7.345
258 HB3 PHE 44 HB2 PHE 44 6.832 -0.231 -8.118
259 HD1 PHE 44 HD1 PHE 44 6.656 -2.366 -5.396
260 HD2 PHE 44 HD2 PHE 44 9.444 -1.233 -8.507
261 HE1 PHE 44 HE1 PHE 44 8.533 -3.022 -3.963
262 HE2 PHE 44 HE2 PHE 44 11.320 -1.901 -7.038
263 HZ PHE 44 HZ PHE 44 10.867 -2.812 -4.769
264 H ALA 45 H ALA 45 3.110 -2.127 -6.468
265 HA ALA 45 HA ALA 45 3.748 -0.426 -4.156
266 HB1 ALA 45 HB3 ALA 45 2.901 1.263 -5.698
267 HB2 ALA 45 HB1 ALA 45 1.444 0.291 -6.009
268 HB3 ALA 45 HB2 ALA 45 1.729 0.999 -4.396
269 H CYS 46 H CYS 46 2.500 -0.872 -2.361
270 HA CYS 46 HA CYS 46 1.392 -3.553 -2.296
271 HB3 CYS 46 HB2 CYS 46 1.858 -1.409 -0.223
272 H TYR 47 H TYR 47 -0.572 -3.684 -3.354
273 HA TYR 47 HA TYR 47 -2.708 -1.751 -2.807
274 HB3 TYR 47 HB2 TYR 47 -2.952 -4.349 -4.338
275 HD1 TYR 47 HD1 TYR 47 -3.974 -0.714 -4.466
276 HD2 TYR 47 HD2 TYR 47 -5.328 -4.802 -4.502
277 HE1 TYR 47 HE1 TYR 47 -6.292 0.052 -4.853
278 HE2 TYR 47 HE2 TYR 47 -7.645 -4.015 -4.890
279 HH TYR 47 HH TYR 47 -8.599 -0.800 -4.279
280 H CYS 48 H CYS 48 -3.044 -1.833 -0.708
281 HA CYS 48 HA CYS 48 -3.209 -4.272 0.828
282 HB3 CYS 48 HB2 CYS 48 -4.114 -1.496 1.631
283 H LYS 49 H LYS 49 -5.107 -4.759 2.085
284 HA LYS 49 HA LYS 49 -7.639 -4.442 0.534
285 HB3 LYS 49 HB2 LYS 49 -8.074 -6.798 1.131
286 HG3 LYS 49 HG2 LYS 49 -6.243 -7.959 -0.156
287 HD3 LYS 49 HD2 LYS 49 -7.415 -5.426 -1.311
288 HE3 LYS 49 HE2 LYS 49 -6.602 -7.943 -2.731
289 HZ1 LYS 49 HZ3 LYS 49 -8.616 -5.896 -3.277
290 HZ2 LYS 49 HZ1 LYS 49 -7.681 -6.398 -4.564
291 HZ3 LYS 49 HZ2 LYS 49 -8.612 -7.453 -3.701
292 H ASP 50 H ASP 50 -9.373 -3.691 1.603
293 HA ASP 50 HA ASP 50 -10.403 -2.502 3.211
294 HB3 ASP 50 HB2 ASP 50 -10.662 -3.827 5.462
295 H LEU 51 H LEU 51 -8.046 -1.459 2.876
296 HA LEU 51 HA LEU 51 -6.538 -1.082 5.304
297 HB3 LEU 51 HB2 LEU 51 -6.843 0.590 2.776
298 HG LEU 51 HG LEU 51 -5.772 1.794 4.770
299 HD11 LEU 51 1HD1 LEU 51 -4.574 -0.178 5.770
300 HD12 LEU 51 2HD1 LEU 51 -3.609 -0.297 4.291
301 HD13 LEU 51 3HD1 LEU 51 -3.461 1.114 5.345
302 HD21 LEU 51 3HD2 LEU 51 -3.914 2.642 3.406
303 HD22 LEU 51 1HD2 LEU 51 -4.026 1.215 2.344
304 HD23 LEU 51 2HD2 LEU 51 -5.339 2.397 2.393
305 HA PRO 52 HA PRO 52 -10.098 1.264 6.972
306 HB3 PRO 52 HB2 PRO 52 -9.611 0.462 9.057
307 HG3 PRO 52 HG2 PRO 52 -7.351 0.030 9.729
308 HD3 PRO 52 HD2 PRO 52 -7.729 -1.140 7.687
309 H ASP 53 H ASP 53 -10.741 3.440 6.961
310 HA ASP 53 HA ASP 53 -9.342 4.690 5.064
311 HB3 ASP 53 HB2 ASP 53 -11.428 6.121 6.674
312 H ASN 54 H ASN 54 -9.121 5.400 8.422
313 HA ASN 54 HA ASN 54 -7.658 7.699 8.718
314 HB3 ASN 54 HB2 ASN 54 -7.158 4.955 9.950
315 HD21 ASN 54 1HD2 ASN 54 -4.945 4.991 10.491
316 HD22 ASN 54 2HD2 ASN 54 -4.278 6.301 11.453
317 H VAL 55 H VAL 55 -6.377 4.584 7.423
318 HA VAL 55 HA VAL 55 -3.718 5.798 7.109
319 HB VAL 55 HB VAL 55 -4.603 3.031 6.285
320 HG11 VAL 55 1HG1 VAL 55 -2.127 2.623 6.399
321 HG12 VAL 55 2HG1 VAL 55 -2.527 3.854 5.186
322 HG13 VAL 55 3HG1 VAL 55 -1.870 4.327 6.766
323 HG21 VAL 55 3HG2 VAL 55 -3.304 3.987 8.873
324 HG22 VAL 55 1HG2 VAL 55 -4.911 3.242 8.712
325 HG23 VAL 55 2HG2 VAL 55 -3.463 2.291 8.373
326 HA PRO 56 HA PRO 56 -5.389 7.401 3.348
327 HB3 PRO 56 HB2 PRO 56 -3.984 9.199 3.736
328 HG3 PRO 56 HG2 PRO 56 -1.708 8.872 4.463
329 HD3 PRO 56 HD2 PRO 56 -3.166 7.821 6.030
330 H ILE 57 H ILE 57 -5.313 7.244 1.046
331 HA ILE 57 HA ILE 57 -4.171 4.730 -0.010
332 HB ILE 57 HB ILE 57 -5.594 5.034 -1.865
333 HG13 ILE 57 2HG1 ILE 57 -5.320 7.413 -2.335
334 HG21 ILE 57 1HG2 ILE 57 -6.596 4.384 0.438
335 HG22 ILE 57 2HG2 ILE 57 -7.312 6.005 0.446
336 HG23 ILE 57 3HG2 ILE 57 -7.733 4.854 -0.834
337 HD11 ILE 57 3HD1 ILE 57 -7.536 8.030 -2.973
338 HD12 ILE 57 1HD1 ILE 57 -7.359 6.281 -3.217
339 HD13 ILE 57 2HD1 ILE 57 -8.267 6.907 -1.818
340 H ARG 58 H ARG 58 -2.680 4.793 -1.772
341 HA ARG 58 HA ARG 58 -0.923 7.045 -1.830
342 HB3 ARG 58 HB2 ARG 58 -0.869 4.892 -3.955
343 HG3 ARG 58 HG2 ARG 58 1.541 4.958 -3.456
344 HD3 ARG 58 HD2 ARG 58 0.320 7.639 -4.090
345 HE ARG 58 HE ARG 58 2.820 7.502 -3.147
346 HH11 ARG 58 2HH2 ARG 58 1.128 8.670 -5.988
347 HH12 ARG 58 1HH2 ARG 58 2.417 9.774 -6.441
348 HH21 ARG 58 1HH1 ARG 58 4.198 9.248 -3.518
349 HH22 ARG 58 2HH1 ARG 58 3.921 10.281 -4.917
350 H VAL 59 H VAL 59 -1.587 8.997 -2.829
351 HA VAL 59 HA VAL 59 -3.551 8.830 -5.044
352 HB VAL 59 HB VAL 59 -3.657 11.255 -4.930
353 HG11 VAL 59 1HG1 VAL 59 -4.769 11.416 -2.768
354 HG12 VAL 59 2HG1 VAL 59 -5.125 9.850 -3.518
355 HG13 VAL 59 3HG1 VAL 59 -3.947 9.954 -2.192
356 HG21 VAL 59 3HG2 VAL 59 -2.597 12.566 -3.217
357 HG22 VAL 59 1HG2 VAL 59 -1.762 11.156 -2.562
358 HG23 VAL 59 2HG2 VAL 59 -1.338 11.782 -4.178
359 HA PRO 60 HA PRO 60 -0.319 9.005 -8.048
360 HB3 PRO 60 HB2 PRO 60 -1.991 8.391 -9.521
361 HG3 PRO 60 HG2 PRO 60 -4.109 9.537 -9.584
362 HD3 PRO 60 HD2 PRO 60 -3.806 8.641 -7.404
363 H GLY 61 H GLY 61 0.488 10.793 -6.393
364 HA2 GLY 61 HA2 GLY 61 1.389 13.081 -8.058
365 HA3 GLY 61 HA3 GLY 61 0.542 13.416 -6.536
366 H LYS 62 H LYS 62 2.428 14.427 -5.731
367 HA LYS 62 HA LYS 62 5.021 13.179 -5.643
368 HB3 LYS 62 HB2 LYS 62 5.598 15.090 -4.197
369 HG3 LYS 62 HG2 LYS 62 3.783 15.907 -6.505
370 HD3 LYS 62 HD2 LYS 62 4.302 17.767 -4.970
371 HE3 LYS 62 HE2 LYS 62 6.580 17.139 -4.166
372 HZ1 LYS 62 HZ3 LYS 62 7.429 17.838 -6.907
373 HZ2 LYS 62 HZ1 LYS 62 8.426 17.571 -5.631
374 HZ3 LYS 62 HZ2 LYS 62 7.526 16.338 -6.233
375 H CYS 63 H CYS 63 6.039 13.369 -3.147
376 HA CYS 63 HA CYS 63 4.358 12.177 -1.164
377 HB3 CYS 63 HB2 CYS 63 6.004 10.508 -2.878
378 H HIS 64 H HIS 64 5.546 12.439 0.985
379 HA HIS 64 HA HIS 64 8.031 14.104 0.776
380 HB3 HIS 64 HB2 HIS 64 7.171 15.709 2.288
381 HD1 HIS 64 HD1 HIS 64 6.947 15.832 -0.829
382 HD2 HIS 64 HD2 HIS 64 3.638 15.786 1.748
383 HE1 HIS 64 HE1 HIS 64 4.989 16.830 -2.140
Start of MODEL 20
1 H1 VAL 1 H VAL 1 -15.147 0.130 4.661
2 HA VAL 1 HA VAL 1 -12.423 0.409 5.237
3 HB VAL 1 HB VAL 1 -11.785 -2.009 5.033
4 HG11 VAL 1 1HG1 VAL 1 -13.445 -1.344 7.496
5 HG12 VAL 1 2HG1 VAL 1 -12.189 -2.594 7.373
6 HG13 VAL 1 3HG1 VAL 1 -11.749 -0.887 7.216
7 HG21 VAL 1 3HG2 VAL 1 -13.431 -3.757 5.551
8 HG22 VAL 1 1HG2 VAL 1 -14.732 -2.560 5.616
9 HG23 VAL 1 2HG2 VAL 1 -13.900 -2.894 4.082
10 H ARG 2 H ARG 2 -11.123 -0.451 3.296
11 HA ARG 2 HA ARG 2 -12.576 -0.993 0.833
12 HB3 ARG 2 HB2 ARG 2 -13.041 1.415 0.968
13 HG3 ARG 2 HG2 ARG 2 -10.142 1.579 1.811
14 HD3 ARG 2 HD2 ARG 2 -11.726 3.691 0.296
15 HE ARG 2 HE ARG 2 -10.680 5.156 1.680
16 HH11 ARG 2 2HH2 ARG 2 -8.318 2.549 1.094
17 HH12 ARG 2 1HH2 ARG 2 -7.094 3.350 2.056
18 HH21 ARG 2 1HH1 ARG 2 -9.179 6.139 2.779
19 HH22 ARG 2 2HH1 ARG 2 -7.557 5.522 3.043
20 H ASP 3 H ASP 3 -10.726 -0.438 -1.016
21 HA ASP 3 HA ASP 3 -8.318 -1.919 -0.221
22 HB3 ASP 3 HB2 ASP 3 -7.529 -1.247 -2.529
23 H ALA 4 H ALA 4 -6.206 -0.950 -0.749
24 HA ALA 4 HA ALA 4 -6.132 1.185 -2.264
25 HB1 ALA 4 HB3 ALA 4 -5.592 2.251 0.536
26 HB2 ALA 4 HB1 ALA 4 -5.001 3.034 -0.933
27 HB3 ALA 4 HB2 ALA 4 -6.732 2.857 -0.699
28 H TYR 5 H TYR 5 -4.008 1.986 -2.783
29 HA TYR 5 HA TYR 5 -1.702 0.236 -2.264
30 HB3 TYR 5 HB2 TYR 5 -0.523 2.200 -3.275
31 HD1 TYR 5 HD2 TYR 5 -2.036 -0.529 -4.340
32 HD2 TYR 5 HD1 TYR 5 -1.554 3.556 -5.649
33 HE1 TYR 5 HE2 TYR 5 -1.962 -1.280 -6.687
34 HE2 TYR 5 HE1 TYR 5 -1.371 2.796 -7.960
35 HH TYR 5 HH TYR 5 -2.000 -0.214 -9.187
36 H ILE 6 H ILE 6 -1.117 0.204 -0.045
37 HA ILE 6 HA ILE 6 -2.065 2.303 1.640
38 HB ILE 6 HB ILE 6 -1.625 -0.062 2.292
39 HG13 ILE 6 2HG1 ILE 6 -2.066 1.797 3.878
40 HG21 ILE 6 1HG2 ILE 6 0.662 -0.222 1.256
41 HG22 ILE 6 2HG2 ILE 6 1.280 0.783 2.574
42 HG23 ILE 6 3HG2 ILE 6 0.576 -0.813 2.917
43 HD11 ILE 6 3HD1 ILE 6 -0.038 -0.121 5.044
44 HD12 ILE 6 1HD1 ILE 6 -1.426 0.657 5.839
45 HD13 ILE 6 2HD1 ILE 6 -1.693 -0.594 4.603
46 H ALA 7 H ALA 7 -0.948 4.016 2.680
47 HA ALA 7 HA ALA 7 1.709 4.724 1.556
48 HB1 ALA 7 HB3 ALA 7 -0.736 6.539 1.654
49 HB2 ALA 7 HB1 ALA 7 0.913 7.025 1.199
50 HB3 ALA 7 HB2 ALA 7 0.025 5.864 0.197
51 H GLN 8 H GLN 8 2.839 6.244 2.769
52 HA GLN 8 HA GLN 8 1.998 6.791 5.564
53 HB3 GLN 8 HB2 GLN 8 3.509 4.907 5.754
54 HG3 GLN 8 HG2 GLN 8 5.185 6.389 3.692
55 HE21 GLN 8 1HE2 GLN 8 6.994 4.616 2.959
56 HE22 GLN 8 2HE2 GLN 8 8.107 4.314 4.287
57 H ASN 9 H ASN 9 3.717 8.418 6.426
58 HA ASN 9 HA ASN 9 3.789 10.905 5.367
59 HB3 ASN 9 HB2 ASN 9 5.880 11.232 6.601
60 HD21 ASN 9 1HD2 ASN 9 4.929 12.311 8.332
61 HD22 ASN 9 2HD2 ASN 9 3.767 11.569 9.415
62 H TYR 10 H TYR 10 5.933 10.809 2.415
63 HA TYR 10 HA TYR 10 3.202 11.396 3.470
64 HB3 TYR 10 HB2 TYR 10 4.558 13.521 1.923
65 HD1 TYR 10 HD1 TYR 10 2.100 14.144 1.839
66 HD2 TYR 10 HD2 TYR 10 4.264 13.789 5.552
67 HE1 TYR 10 HE1 TYR 10 0.296 15.381 3.018
68 HE2 TYR 10 HE2 TYR 10 2.458 15.007 6.724
69 HH TYR 10 HH TYR 10 0.409 16.052 6.523
70 H ASN 11 H ASN 11 2.296 9.917 2.235
71 HA ASN 11 HA ASN 11 1.037 9.290 0.464
72 HB3 ASN 11 HB2 ASN 11 2.662 10.811 -1.563
73 HD21 ASN 11 1HD2 ASN 11 1.670 10.918 -3.549
74 HD22 ASN 11 2HD2 ASN 11 0.166 10.083 -3.909
75 H CYS 12 H CYS 12 3.880 8.438 1.409
76 HA CYS 12 HA CYS 12 5.024 7.397 -1.149
77 HB3 CYS 12 HB2 CYS 12 7.048 7.077 0.210
78 H VAL 13 H VAL 13 5.463 5.179 -1.383
79 HA VAL 13 HA VAL 13 3.859 3.339 0.221
80 HB VAL 13 HB VAL 13 4.878 1.595 -1.167
81 HG11 VAL 13 1HG1 VAL 13 4.008 3.958 -2.865
82 HG12 VAL 13 2HG1 VAL 13 3.917 2.238 -3.290
83 HG13 VAL 13 3HG1 VAL 13 2.906 2.875 -1.980
84 HG21 VAL 13 3HG2 VAL 13 6.498 3.805 -2.519
85 HG22 VAL 13 1HG2 VAL 13 7.163 2.547 -1.458
86 HG23 VAL 13 2HG2 VAL 13 6.411 2.101 -2.994
87 H TYR 14 H TYR 14 5.148 1.289 0.997
88 HA TYR 14 HA TYR 14 7.428 2.137 2.724
89 HB3 TYR 14 HB2 TYR 14 7.095 -0.057 3.788
90 HD1 TYR 14 HD2 TYR 14 6.910 1.755 5.509
91 HD2 TYR 14 HD1 TYR 14 3.566 0.542 3.079
92 HE1 TYR 14 HE2 TYR 14 5.344 2.568 7.246
93 HE2 TYR 14 HE1 TYR 14 2.012 1.301 4.840
94 HH TYR 14 HH TYR 14 1.845 1.960 7.128
95 H HIS 15 H HIS 15 7.495 -1.178 1.911
96 HA HIS 15 HA HIS 15 9.022 -0.901 -0.573
97 HB3 HIS 15 HB2 HIS 15 10.318 -1.774 2.038
98 HD1 HIS 15 HD1 HIS 15 10.648 -4.256 0.792
99 HD2 HIS 15 HD2 HIS 15 12.500 -0.901 -0.939
100 HE1 HIS 15 HE1 HIS 15 12.400 -5.151 -0.859
101 H CYS 16 H CYS 16 7.723 -2.372 -1.641
102 HA CYS 16 HA CYS 16 6.754 -4.810 -0.426
103 HB3 CYS 16 HB2 CYS 16 6.930 -3.803 -3.263
104 H ALA 17 H ALA 17 8.437 -5.957 0.528
105 HA ALA 17 HA ALA 17 10.634 -7.041 -1.084
106 HB1 ALA 17 HB3 ALA 17 9.352 -8.088 1.473
107 HB2 ALA 17 HB1 ALA 17 10.871 -8.646 0.749
108 HB3 ALA 17 HB2 ALA 17 10.745 -6.992 1.380
109 H ARG 18 H ARG 18 7.265 -7.968 -0.253
110 HA ARG 18 HA ARG 18 6.992 -9.573 -2.564
111 HB3 ARG 18 HB2 ARG 18 6.922 -11.026 0.124
112 HG3 ARG 18 HG2 ARG 18 5.575 -12.240 -1.592
113 HD3 ARG 18 HD2 ARG 18 6.965 -13.448 -3.356
114 HE ARG 18 HE ARG 18 5.344 -11.755 -4.077
115 HH11 ARG 18 2HH2 ARG 18 8.703 -10.610 -4.167
116 HH12 ARG 18 1HH2 ARG 18 8.455 -9.553 -5.501
117 HH21 ARG 18 1HH1 ARG 18 4.922 -10.354 -5.530
118 HH22 ARG 18 2HH1 ARG 18 6.134 -9.453 -6.441
119 H ASP 19 H ASP 19 4.752 -10.424 -2.729
120 HA ASP 19 HA ASP 19 2.633 -8.941 -1.845
121 HB3 ASP 19 HB2 ASP 19 1.310 -10.957 -2.372
122 H ALA 20 H ALA 20 3.935 -11.900 -0.289
123 HA ALA 20 HA ALA 20 2.230 -11.898 1.979
124 HB1 ALA 20 HB3 ALA 20 3.932 -13.365 2.991
125 HB2 ALA 20 HB1 ALA 20 3.618 -13.825 1.306
126 HB3 ALA 20 HB2 ALA 20 5.096 -12.927 1.721
127 H TYR 21 H TYR 21 5.470 -10.308 1.539
128 HA TYR 21 HA TYR 21 5.651 -9.302 4.212
129 HB3 TYR 21 HB2 TYR 21 6.718 -8.238 1.588
130 HD1 TYR 21 HD1 TYR 21 6.318 -5.859 1.865
131 HD2 TYR 21 HD2 TYR 21 8.218 -8.147 4.987
132 HE1 TYR 21 HE1 TYR 21 6.758 -3.784 3.117
133 HE2 TYR 21 HE2 TYR 21 8.745 -6.052 6.192
134 HH TYR 21 HH TYR 21 7.710 -2.849 4.992
135 H CYS 22 H CYS 22 4.208 -7.893 1.222
136 HA CYS 22 HA CYS 22 3.249 -5.542 2.545
137 HB3 CYS 22 HB2 CYS 22 1.550 -5.504 0.644
138 H ASN 23 H ASN 23 1.747 -8.754 2.110
139 HA ASN 23 HA ASN 23 -0.743 -8.167 3.291
140 HB3 ASN 23 HB2 ASN 23 0.581 -10.460 2.288
141 HD21 ASN 23 1HD2 ASN 23 -1.414 -10.422 5.360
142 HD22 ASN 23 2HD2 ASN 23 -0.669 -11.903 5.941
143 H GLU 24 H GLU 24 2.310 -9.274 4.856
144 HA GLU 24 HA GLU 24 1.436 -9.283 7.527
145 HB3 GLU 24 HB2 GLU 24 4.093 -8.885 6.069
146 HG3 GLU 24 HG2 GLU 24 4.910 -9.472 8.489
147 H LEU 25 H LEU 25 3.089 -6.662 5.733
148 HA LEU 25 HA LEU 25 2.850 -4.679 7.641
149 HB3 LEU 25 HB2 LEU 25 2.635 -4.187 4.626
150 HG LEU 25 HG LEU 25 3.270 -2.536 7.038
151 HD11 LEU 25 1HD1 LEU 25 4.843 -1.121 5.828
152 HD12 LEU 25 2HD1 LEU 25 5.490 -2.755 6.023
153 HD13 LEU 25 3HD1 LEU 25 4.836 -2.247 4.448
154 HD21 LEU 25 3HD2 LEU 25 2.451 -1.725 4.214
155 HD22 LEU 25 1HD2 LEU 25 1.265 -2.220 5.432
156 HD23 LEU 25 2HD2 LEU 25 2.275 -0.814 5.732
157 H CYS 26 H CYS 26 0.365 -5.622 5.250
158 HA CYS 26 HA CYS 26 -1.529 -3.574 5.790
159 HB3 CYS 26 HB2 CYS 26 -3.216 -5.171 4.904
160 H THR 27 H THR 27 -1.209 -6.914 7.155
161 HA THR 27 HA THR 27 -3.338 -6.563 9.038
162 HB THR 27 HB THR 27 -2.403 -8.525 10.202
163 HG1 THR 27 HG1 THR 27 -0.214 -8.027 8.539
164 HG21 THR 27 3HG2 THR 27 -2.630 -10.105 8.316
165 HG22 THR 27 1HG2 THR 27 -3.878 -8.847 8.285
166 HG23 THR 27 2HG2 THR 27 -2.516 -8.767 7.157
167 H LYS 28 H LYS 28 0.099 -5.810 9.310
168 HA LYS 28 HA LYS 28 0.177 -5.051 12.039
169 HB3 LYS 28 HB2 LYS 28 2.282 -3.861 10.880
170 HG3 LYS 28 HG2 LYS 28 2.950 -6.466 10.184
171 HD3 LYS 28 HD2 LYS 28 3.600 -6.866 12.601
172 HE3 LYS 28 HE2 LYS 28 5.181 -5.014 12.880
173 HZ1 LYS 28 HZ3 LYS 28 5.691 -6.594 11.103
174 HZ2 LYS 28 HZ1 LYS 28 4.929 -5.684 10.003
175 HZ3 LYS 28 HZ2 LYS 28 6.261 -5.098 10.732
176 H ASN 29 H ASN 29 -0.800 -3.323 9.067
177 HA ASN 29 HA ASN 29 -0.734 -0.694 10.454
178 HB3 ASN 29 HB2 ASN 29 -1.823 0.015 8.219
179 HD21 ASN 29 1HD2 ASN 29 1.131 -2.043 8.386
180 HD22 ASN 29 2HD2 ASN 29 2.252 -0.704 8.120
181 H GLY 30 H GLY 30 -3.030 -3.125 9.345
182 HA2 GLY 30 HA2 GLY 30 -4.976 -3.413 10.880
183 HA3 GLY 30 HA3 GLY 30 -5.297 -1.685 10.688
184 H ALA 31 H ALA 31 -4.436 -4.354 8.392
185 HA ALA 31 HA ALA 31 -7.165 -4.314 7.307
186 HB1 ALA 31 HB3 ALA 31 -4.688 -3.686 5.646
187 HB2 ALA 31 HB1 ALA 31 -6.216 -4.289 4.961
188 HB3 ALA 31 HB2 ALA 31 -6.161 -2.718 5.805
189 H LYS 32 H LYS 32 -7.767 -6.360 6.720
190 HA LYS 32 HA LYS 32 -6.264 -8.419 7.839
191 HB3 LYS 32 HB2 LYS 32 -8.633 -8.603 7.622
192 HG3 LYS 32 HG2 LYS 32 -8.161 -8.640 4.617
193 HD3 LYS 32 HD2 LYS 32 -10.661 -9.228 4.566
194 HE3 LYS 32 HE2 LYS 32 -10.386 -11.702 4.782
195 HZ1 LYS 32 HZ3 LYS 32 -9.593 -10.613 2.786
196 HZ2 LYS 32 HZ1 LYS 32 -8.086 -10.445 3.409
197 HZ3 LYS 32 HZ2 LYS 32 -8.691 -11.941 3.136
198 H SER 33 H SER 33 -5.993 -7.293 4.454
199 HA SER 33 HA SER 33 -3.765 -9.123 4.071
200 HB3 SER 33 HB2 SER 33 -5.428 -10.805 3.714
201 HG SER 33 HG SER 33 -6.765 -8.828 2.162
202 H GLY 34 H GLY 34 -2.861 -8.962 1.855
203 HA2 GLY 34 HA2 GLY 34 -3.866 -7.015 0.026
204 HA3 GLY 34 HA3 GLY 34 -2.377 -6.460 0.851
205 H SER 35 H SER 35 -1.810 -6.641 -1.595
206 HA SER 35 HA SER 35 -0.002 -8.911 -1.753
207 HB3 SER 35 HB2 SER 35 -0.695 -9.721 -3.927
208 HG SER 35 HG SER 35 -2.073 -10.107 -1.818
209 H CYS 36 H CYS 36 1.284 -8.514 -4.059
210 HA CYS 36 HA CYS 36 1.949 -5.593 -3.966
211 HB3 CYS 36 HB2 CYS 36 3.777 -7.963 -4.094
212 HA PRO 37 HA PRO 37 1.221 -6.332 -8.481
213 HB3 PRO 37 HB2 PRO 37 -0.696 -5.097 -8.549
214 HG3 PRO 37 HG2 PRO 37 -1.223 -3.532 -6.830
215 HD3 PRO 37 HD2 PRO 37 -0.710 -5.602 -5.755
216 H TYR 38 H TYR 38 3.421 -6.574 -8.711
217 HA TYR 38 HA TYR 38 5.401 -4.470 -8.756
218 HB3 TYR 38 HB2 TYR 38 6.235 -6.095 -10.717
219 HD1 TYR 38 HD1 TYR 38 5.334 -6.986 -7.170
220 HD2 TYR 38 HD2 TYR 38 8.427 -6.462 -10.120
221 HE1 TYR 38 HE1 TYR 38 7.048 -7.637 -5.501
222 HE2 TYR 38 HE2 TYR 38 10.112 -7.275 -8.496
223 HH TYR 38 HH TYR 38 10.430 -8.212 -6.369
224 H LEU 39 H LEU 39 2.875 -5.553 -10.978
225 HA LEU 39 HA LEU 39 3.459 -3.262 -12.791
226 HB3 LEU 39 HB2 LEU 39 2.540 -4.545 -14.602
227 HG LEU 39 HG LEU 39 5.082 -4.930 -13.590
228 HD11 LEU 39 1HD1 LEU 39 5.601 -7.317 -13.666
229 HD12 LEU 39 2HD1 LEU 39 4.385 -7.034 -12.412
230 HD13 LEU 39 3HD1 LEU 39 3.901 -7.718 -13.974
231 HD21 LEU 39 3HD2 LEU 39 5.603 -5.985 -15.759
232 HD22 LEU 39 1HD2 LEU 39 3.873 -6.274 -16.044
233 HD23 LEU 39 2HD2 LEU 39 4.501 -4.612 -15.960
234 H GLY 40 H GLY 40 1.749 -1.855 -12.908
235 HA2 GLY 40 HA2 GLY 40 -0.965 -2.214 -12.677
236 HA3 GLY 40 HA3 GLY 40 -0.360 -2.107 -11.002
237 H GLU 41 H GLU 41 -1.815 -0.037 -11.427
238 HA GLU 41 HA GLU 41 -0.989 2.128 -12.968
239 HB3 GLU 41 HB2 GLU 41 -2.416 3.445 -11.687
240 HG3 GLU 41 HG2 GLU 41 -3.511 1.115 -12.491
241 H HIS 42 H HIS 42 -0.122 1.330 -9.607
242 HA HIS 42 HA HIS 42 2.353 3.018 -9.798
243 HB3 HIS 42 HB2 HIS 42 1.016 1.912 -7.306
244 HD1 HIS 42 HD1 HIS 42 3.965 1.635 -6.858
245 HD2 HIS 42 HD2 HIS 42 1.890 5.283 -6.743
246 HE1 HIS 42 HE1 HIS 42 5.413 3.236 -5.483
247 H LYS 43 H LYS 43 2.388 0.777 -11.283
248 HA LYS 43 HA LYS 43 3.238 -1.613 -10.718
249 HB3 LYS 43 HB2 LYS 43 3.673 -0.812 -12.877
250 HG3 LYS 43 HG2 LYS 43 5.091 1.475 -11.524
251 HD3 LYS 43 HD2 LYS 43 6.111 2.117 -13.668
252 HE3 LYS 43 HE2 LYS 43 8.047 0.734 -13.732
253 HZ1 LYS 43 HZ3 LYS 43 6.951 0.375 -11.010
254 HZ2 LYS 43 HZ1 LYS 43 8.531 0.285 -11.433
255 HZ3 LYS 43 HZ2 LYS 43 7.733 1.721 -11.539
256 H PHE 44 H PHE 44 3.832 -2.182 -8.696
257 HA PHE 44 HA PHE 44 5.322 -2.858 -7.108
258 HB3 PHE 44 HB2 PHE 44 7.103 -0.478 -7.641
259 HD1 PHE 44 HD1 PHE 44 7.780 -4.110 -6.984
260 HD2 PHE 44 HD2 PHE 44 7.827 -0.100 -5.377
261 HE1 PHE 44 HE1 PHE 44 9.249 -4.858 -5.128
262 HE2 PHE 44 HE2 PHE 44 9.349 -0.850 -3.567
263 HZ PHE 44 HZ PHE 44 10.101 -3.221 -3.474
264 H ALA 45 H ALA 45 3.331 -2.420 -6.092
265 HA ALA 45 HA ALA 45 3.702 -0.324 -4.021
266 HB1 ALA 45 HB3 ALA 45 1.290 0.291 -4.144
267 HB2 ALA 45 HB1 ALA 45 2.155 0.720 -5.626
268 HB3 ALA 45 HB2 ALA 45 1.113 -0.715 -5.598
269 H CYS 46 H CYS 46 2.464 -0.823 -2.062
270 HA CYS 46 HA CYS 46 1.784 -3.713 -1.747
271 HB3 CYS 46 HB2 CYS 46 1.507 -3.007 0.677
272 H TYR 47 H TYR 47 -0.221 -4.088 -2.399
273 HA TYR 47 HA TYR 47 -2.275 -1.978 -2.196
274 HB3 TYR 47 HB2 TYR 47 -2.149 -4.552 -3.805
275 HD1 TYR 47 HD2 TYR 47 -4.293 -1.624 -2.941
276 HD2 TYR 47 HD1 TYR 47 -3.387 -4.589 -5.952
277 HE1 TYR 47 HE2 TYR 47 -6.176 -0.856 -4.270
278 HE2 TYR 47 HE1 TYR 47 -5.485 -3.996 -7.126
279 HH TYR 47 HH TYR 47 -7.943 -2.188 -5.420
280 H CYS 48 H CYS 48 -3.244 -2.145 -0.212
281 HA CYS 48 HA CYS 48 -3.840 -4.788 1.002
282 HB3 CYS 48 HB2 CYS 48 -4.541 -3.469 2.945
283 H LYS 49 H LYS 49 -6.003 -5.273 1.721
284 HA LYS 49 HA LYS 49 -8.145 -4.154 -0.058
285 HB3 LYS 49 HB2 LYS 49 -8.855 -6.553 -0.219
286 HG3 LYS 49 HG2 LYS 49 -7.019 -7.450 -1.570
287 HD3 LYS 49 HD2 LYS 49 -7.406 -4.462 -2.042
288 HE3 LYS 49 HE2 LYS 49 -6.811 -6.775 -3.896
289 HZ1 LYS 49 HZ3 LYS 49 -8.560 -5.492 -4.875
290 HZ2 LYS 49 HZ1 LYS 49 -7.877 -4.084 -4.473
291 HZ3 LYS 49 HZ2 LYS 49 -7.163 -5.015 -5.619
292 H ASP 50 H ASP 50 -7.656 -3.406 2.779
293 HA ASP 50 HA ASP 50 -10.351 -3.663 3.769
294 HB3 ASP 50 HB2 ASP 50 -8.156 -5.396 4.977
295 H LEU 51 H LEU 51 -8.646 -1.533 3.240
296 HA LEU 51 HA LEU 51 -7.401 -0.683 5.758
297 HB3 LEU 51 HB2 LEU 51 -6.939 1.406 4.277
298 HG LEU 51 HG LEU 51 -5.851 -1.305 3.449
299 HD11 LEU 51 1HD1 LEU 51 -3.917 0.141 2.556
300 HD12 LEU 51 2HD1 LEU 51 -5.446 0.257 1.675
301 HD13 LEU 51 3HD1 LEU 51 -4.961 1.543 2.803
302 HD21 LEU 51 3HD2 LEU 51 -5.291 -0.514 5.892
303 HD22 LEU 51 1HD2 LEU 51 -3.978 -0.988 4.822
304 HD23 LEU 51 2HD2 LEU 51 -4.305 0.722 5.093
305 HA PRO 52 HA PRO 52 -11.221 1.601 6.753
306 HB3 PRO 52 HB2 PRO 52 -10.784 1.034 8.966
307 HG3 PRO 52 HG2 PRO 52 -8.549 0.994 9.835
308 HD3 PRO 52 HD2 PRO 52 -8.531 -0.487 7.985
309 H ASP 53 H ASP 53 -11.798 3.684 6.129
310 HA ASP 53 HA ASP 53 -10.175 4.637 4.232
311 HB3 ASP 53 HB2 ASP 53 -12.400 6.239 5.531
312 H ASN 54 H ASN 54 -10.143 5.763 7.510
313 HA ASN 54 HA ASN 54 -8.954 8.297 7.287
314 HB3 ASN 54 HB2 ASN 54 -9.731 7.268 9.432
315 HD21 ASN 54 1HD2 ASN 54 -6.393 6.633 10.148
316 HD22 ASN 54 2HD2 ASN 54 -6.668 4.927 10.469
317 H VAL 55 H VAL 55 -7.414 5.102 6.752
318 HA VAL 55 HA VAL 55 -4.756 6.282 6.904
319 HB VAL 55 HB VAL 55 -5.307 3.944 7.536
320 HG11 VAL 55 1HG1 VAL 55 -4.999 3.187 4.628
321 HG12 VAL 55 2HG1 VAL 55 -5.613 2.247 6.014
322 HG13 VAL 55 3HG1 VAL 55 -6.601 3.519 5.289
323 HG21 VAL 55 3HG2 VAL 55 -3.049 4.313 5.522
324 HG22 VAL 55 1HG2 VAL 55 -2.986 4.689 7.261
325 HG23 VAL 55 2HG2 VAL 55 -3.184 3.014 6.723
326 HA PRO 56 HA PRO 56 -5.233 8.035 2.904
327 HB3 PRO 56 HB2 PRO 56 -3.664 9.599 3.533
328 HG3 PRO 56 HG2 PRO 56 -1.723 8.969 4.808
329 HD3 PRO 56 HD2 PRO 56 -3.671 8.223 5.977
330 H ILE 57 H ILE 57 -4.939 7.676 0.701
331 HA ILE 57 HA ILE 57 -3.879 5.018 -0.103
332 HB ILE 57 HB ILE 57 -5.195 5.208 -2.016
333 HG13 ILE 57 2HG1 ILE 57 -4.740 7.467 -2.756
334 HG21 ILE 57 1HG2 ILE 57 -6.984 6.552 0.045
335 HG22 ILE 57 2HG2 ILE 57 -7.390 5.266 -1.110
336 HG23 ILE 57 3HG2 ILE 57 -6.350 4.918 0.283
337 HD11 ILE 57 3HD1 ILE 57 -7.738 7.235 -2.332
338 HD12 ILE 57 1HD1 ILE 57 -6.884 8.154 -3.577
339 HD13 ILE 57 2HD1 ILE 57 -6.817 6.380 -3.595
340 H ARG 58 H ARG 58 -2.175 4.896 -1.579
341 HA ARG 58 HA ARG 58 -0.366 7.125 -1.815
342 HB3 ARG 58 HB2 ARG 58 -0.398 4.635 -3.557
343 HG3 ARG 58 HG2 ARG 58 1.916 4.729 -3.561
344 HD3 ARG 58 HD2 ARG 58 1.252 7.689 -3.563
345 HE ARG 58 HE ARG 58 3.451 6.065 -4.708
346 HH11 ARG 58 2HH2 ARG 58 1.675 9.092 -5.059
347 HH12 ARG 58 1HH2 ARG 58 3.042 9.964 -5.721
348 HH21 ARG 58 1HH1 ARG 58 5.177 7.148 -5.699
349 HH22 ARG 58 2HH1 ARG 58 5.008 8.815 -6.189
350 H VAL 59 H VAL 59 -1.547 8.922 -2.835
351 HA VAL 59 HA VAL 59 -3.078 8.352 -5.231
352 HB VAL 59 HB VAL 59 -3.330 10.713 -5.597
353 HG11 VAL 59 1HG1 VAL 59 -3.780 9.908 -2.696
354 HG12 VAL 59 2HG1 VAL 59 -4.618 11.202 -3.572
355 HG13 VAL 59 3HG1 VAL 59 -4.834 9.520 -4.077
356 HG21 VAL 59 3HG2 VAL 59 -1.136 11.584 -4.785
357 HG22 VAL 59 1HG2 VAL 59 -2.544 12.421 -4.123
358 HG23 VAL 59 2HG2 VAL 59 -1.684 11.257 -3.113
359 HA PRO 60 HA PRO 60 0.383 8.043 -7.948
360 HB3 PRO 60 HB2 PRO 60 -1.097 6.830 -9.250
361 HG3 PRO 60 HG2 PRO 60 -3.321 7.625 -9.711
362 HD3 PRO 60 HD2 PRO 60 -3.064 7.422 -7.362
363 H GLY 61 H GLY 61 1.029 10.177 -6.936
364 HA2 GLY 61 HA2 GLY 61 1.879 11.945 -9.109
365 HA3 GLY 61 HA3 GLY 61 0.813 12.717 -7.913
366 H LYS 62 H LYS 62 2.279 13.987 -6.774
367 HA LYS 62 HA LYS 62 4.929 13.353 -6.208
368 HB3 LYS 62 HB2 LYS 62 3.746 15.606 -6.017
369 HG3 LYS 62 HG2 LYS 62 3.120 16.337 -3.776
370 HD3 LYS 62 HD2 LYS 62 1.385 13.935 -4.510
371 HE3 LYS 62 HE2 LYS 62 0.798 16.454 -2.881
372 HZ1 LYS 62 HZ3 LYS 62 -1.256 15.348 -2.411
373 HZ2 LYS 62 HZ1 LYS 62 -1.129 15.579 -4.031
374 HZ3 LYS 62 HZ2 LYS 62 -0.879 14.081 -3.386
375 H CYS 63 H CYS 63 6.009 12.814 -4.167
376 HA CYS 63 HA CYS 63 4.481 11.904 -1.924
377 HB3 CYS 63 HB2 CYS 63 5.608 9.924 -3.749
378 H HIS 64 H HIS 64 5.933 12.270 -0.023
379 HA HIS 64 HA HIS 64 8.657 13.231 -0.532
380 HB3 HIS 64 HB2 HIS 64 7.506 15.190 -1.281
381 HD1 HIS 64 HD1 HIS 64 6.335 16.497 1.995
382 HD2 HIS 64 HD2 HIS 64 4.768 14.599 -1.413
383 HE1 HIS 64 HE1 HIS 64 3.826 16.948 1.995
Contact the webmaster for help, if required. Saturday, May 18, 2024 4:35:22 PM GMT (wattos1)