Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
9180 | 1nh5 RC | 5029 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 -0.814 0.647
3 1HB LYS 1 HB2 LYS 1 3.044 -0.027 -1.457
4 2HB LYS 1 HB3 LYS 1 1.921 -1.363 -1.605
5 1HG LYS 1 HG2 LYS 1 0.341 -0.102 -2.781
6 2HG LYS 1 HG3 LYS 1 0.824 1.408 -2.033
7 1HD LYS 1 HD2 LYS 1 1.553 1.465 -4.351
8 2HD LYS 1 HD3 LYS 1 2.982 1.329 -3.346
9 1HE LYS 1 HE2 LYS 1 1.818 -1.293 -4.128
10 2HE LYS 1 HE3 LYS 1 2.372 -0.335 -5.487
11 1HZ LYS 1 HZ1 LYS 1 3.976 -1.232 -3.167
12 2HZ LYS 1 HZ2 LYS 1 4.249 -1.537 -4.743
13 H ASP 2 HN ASP 2 3.770 0.465 1.064
14 HA ASP 2 HA ASP 2 3.261 3.304 1.242
15 1HB ASP 2 HB2 ASP 2 4.414 1.779 3.608
16 2HB ASP 2 HB3 ASP 2 3.857 3.440 3.575
17 HD2 ASP 2 HD2 ASP 2 0.458 2.440 3.827
18 H GLY 3 HN GLY 3 5.274 4.535 1.200
19 1HA GLY 3 HA1 GLY 3 7.821 3.812 1.618
20 2HA GLY 3 HA2 GLY 3 7.490 3.034 0.083
21 H TYR 4 HN TYR 4 9.119 4.488 -0.875
22 HA TYR 4 HA TYR 4 8.268 7.275 -1.074
23 1HB TYR 4 HB2 TYR 4 10.700 5.871 -2.305
24 2HB TYR 4 HB3 TYR 4 10.571 7.560 -1.856
25 HD1 TYR 4 HD1 TYR 4 10.183 8.006 0.738
26 HD2 TYR 4 HD2 TYR 4 11.847 4.418 -0.893
27 HE1 TYR 4 HE1 TYR 4 11.277 7.488 2.974
28 HE2 TYR 4 HE2 TYR 4 12.935 3.912 1.349
29 HH TYR 4 HH TYR 4 13.259 4.562 3.377
30 HA PRO 5 HA PRO 5 6.790 6.391 -5.141
31 1HB PRO 5 HB2 PRO 5 5.530 8.789 -5.506
32 2HB PRO 5 HB3 PRO 5 4.744 7.391 -4.799
33 1HG PRO 5 HG2 PRO 5 5.737 9.833 -3.461
34 2HG PRO 5 HG3 PRO 5 4.595 8.644 -2.868
35 1HD PRO 5 HD2 PRO 5 7.349 8.905 -2.110
36 2HD PRO 5 HD3 PRO 5 6.238 7.647 -1.607
37 H VAL 6 HN VAL 6 7.905 6.486 -6.993
38 HA VAL 6 HA VAL 6 9.250 9.032 -7.473
39 HB VAL 6 HB VAL 6 11.281 7.861 -8.173
40 1HG1 VAL 6 HG11 VAL 6 10.950 8.751 -5.828
41 2HG1 VAL 6 HG12 VAL 6 10.590 7.082 -5.326
42 3HG1 VAL 6 HG13 VAL 6 12.189 7.483 -5.997
43 1HG2 VAL 6 HG21 VAL 6 10.408 5.694 -8.778
44 2HG2 VAL 6 HG22 VAL 6 11.614 5.479 -7.487
45 3HG2 VAL 6 HG23 VAL 6 9.878 5.389 -7.107
46 H ASP 7 HN ASP 7 8.928 9.742 -9.536
47 HA ASP 7 HA ASP 7 8.870 7.987 -11.692
48 1HB ASP 7 HB2 ASP 7 6.353 8.907 -12.234
49 2HB ASP 7 HB3 ASP 7 6.681 7.332 -11.538
50 HD2 ASP 7 HD2 ASP 7 5.426 10.151 -8.962
51 H SER 8 HN SER 8 6.949 10.956 -10.772
52 HA SER 8 HA SER 8 7.772 12.208 -13.186
53 1HB SER 8 HB2 SER 8 6.391 14.153 -12.198
54 2HB SER 8 HB3 SER 8 5.535 12.666 -12.552
55 HG SER 8 HG SER 8 5.066 13.625 -10.411
56 H LYS 9 HN LYS 9 8.521 12.408 -9.689
57 HA LYS 9 HA LYS 9 10.127 14.758 -9.989
58 1HB LYS 9 HB2 LYS 9 10.646 14.425 -7.640
59 2HB LYS 9 HB3 LYS 9 8.922 14.273 -7.910
60 1HG LYS 9 HG2 LYS 9 9.866 11.650 -8.272
61 2HG LYS 9 HG3 LYS 9 10.850 12.255 -6.954
62 1HD LYS 9 HD2 LYS 9 9.010 11.488 -5.752
63 2HD LYS 9 HD3 LYS 9 8.521 13.150 -6.014
64 1HE LYS 9 HE2 LYS 9 7.729 10.835 -7.845
65 2HE LYS 9 HE3 LYS 9 6.720 11.444 -6.548
66 1HZ LYS 9 HZ1 LYS 9 6.336 12.420 -8.855
67 2HZ LYS 9 HZ2 LYS 9 6.478 13.507 -7.651
68 H GLY 10 HN GLY 10 10.495 11.335 -10.527
69 1HA GLY 10 HA1 GLY 10 12.242 10.393 -11.680
70 2HA GLY 10 HA2 GLY 10 13.231 11.808 -11.383
71 H CYS 11 HN CYS 11 14.117 12.139 -9.141
72 HA CYS 11 HA CYS 11 14.505 9.532 -7.859
73 1HB CYS 11 HB2 CYS 11 16.464 11.657 -8.617
74 2HB CYS 11 HB3 CYS 11 16.752 10.746 -7.149
75 H LYS 12 HN LYS 12 12.486 10.334 -6.601
76 HA LYS 12 HA LYS 12 11.941 10.520 -4.468
77 1HB LYS 12 HB2 LYS 12 14.620 9.906 -4.358
78 2HB LYS 12 HB3 LYS 12 14.554 11.377 -3.408
79 1HG LYS 12 HG2 LYS 12 13.879 10.040 -1.689
80 2HG LYS 12 HG3 LYS 12 12.316 10.027 -2.479
81 1HD LYS 12 HD2 LYS 12 12.756 7.728 -2.234
82 2HD LYS 12 HD3 LYS 12 13.276 8.023 -3.881
83 1HE LYS 12 HE2 LYS 12 15.071 6.785 -2.927
84 2HE LYS 12 HE3 LYS 12 15.643 8.441 -2.902
85 1HZ LYS 12 HZ1 LYS 12 15.083 8.604 -0.584
86 2HZ LYS 12 HZ2 LYS 12 14.307 7.172 -0.574
87 H LEU 13 HN LEU 13 12.006 12.277 -2.525
88 HA LEU 13 HA LEU 13 13.001 14.832 -3.514
89 1HB LEU 13 HB2 LEU 13 11.046 15.997 -2.566
90 2HB LEU 13 HB3 LEU 13 10.689 15.025 -3.980
91 HG LEU 13 HG LEU 13 10.269 13.561 -1.478
92 1HD1 LEU 13 HD11 LEU 13 8.729 16.122 -1.954
93 2HD1 LEU 13 HD12 LEU 13 8.163 14.801 -0.903
94 3HD1 LEU 13 HD13 LEU 13 9.674 15.660 -0.518
95 1HD2 LEU 13 HD21 LEU 13 8.478 14.188 -3.841
96 2HD2 LEU 13 HD22 LEU 13 9.514 12.754 -3.652
97 3HD2 LEU 13 HD23 LEU 13 8.136 13.008 -2.554
98 H SER 14 HN SER 14 14.173 15.945 -1.987
99 HA SER 14 HA SER 14 14.749 14.459 0.367
100 1HB SER 14 HB2 SER 14 16.357 16.413 0.778
101 2HB SER 14 HB3 SER 14 16.624 15.489 -0.687
102 HG SER 14 HG SER 14 16.684 17.841 -0.999
103 H CYS 15 HN CYS 15 12.568 14.597 1.374
104 HA CYS 15 HA CYS 15 11.377 17.007 2.047
105 1HB CYS 15 HB2 CYS 15 10.167 15.703 3.759
106 2HB CYS 15 HB3 CYS 15 10.128 14.985 2.161
107 H VAL 16 HN VAL 16 11.543 18.337 3.932
108 HA VAL 16 HA VAL 16 14.056 17.962 5.376
109 HB VAL 16 HB VAL 16 12.243 20.370 5.124
110 1HG1 VAL 16 HG11 VAL 16 14.299 21.583 5.971
111 2HG1 VAL 16 HG12 VAL 16 13.467 20.556 7.162
112 3HG1 VAL 16 HG13 VAL 16 14.969 19.989 6.393
113 1HG2 VAL 16 HG21 VAL 16 14.818 19.660 3.682
114 2HG2 VAL 16 HG22 VAL 16 13.199 19.845 2.966
115 3HG2 VAL 16 HG23 VAL 16 14.041 21.261 3.641
116 H ALA 17 HN ALA 17 10.684 17.410 5.654
117 HA ALA 17 HA ALA 17 10.756 17.072 8.473
118 1HB ALA 17 HB1 ALA 17 9.275 19.491 7.360
119 2HB ALA 17 HB2 ALA 17 9.202 18.904 9.039
120 3HB ALA 17 HB3 ALA 17 10.729 19.541 8.384
121 H ASN 18 HN ASN 18 8.494 16.475 9.283
122 HA ASN 18 HA ASN 18 7.659 14.482 7.542
123 1HB ASN 18 HB2 ASN 18 6.465 15.619 10.118
124 2HB ASN 18 HB3 ASN 18 5.754 14.242 9.299
125 1HD2 ASN 18 HD21 ASN 18 8.657 13.655 11.912
126 2HD2 ASN 18 HD22 ASN 18 7.537 14.973 11.815
127 H ASN 19 HN ASN 19 6.345 17.702 8.511
128 HA ASN 19 HA ASN 19 3.871 17.432 7.302
129 1HB ASN 19 HB2 ASN 19 3.902 19.987 7.328
130 2HB ASN 19 HB3 ASN 19 4.268 19.248 8.875
131 1HD2 ASN 19 HD21 ASN 19 6.911 21.658 6.963
132 2HD2 ASN 19 HD22 ASN 19 5.328 21.282 6.369
133 H TYR 20 HN TYR 20 7.132 18.318 6.127
134 HA TYR 20 HA TYR 20 6.295 19.610 3.758
135 1HB TYR 20 HB2 TYR 20 8.548 19.614 5.128
136 2HB TYR 20 HB3 TYR 20 8.888 18.071 4.369
137 HD1 TYR 20 HD1 TYR 20 9.198 17.950 1.875
138 HD2 TYR 20 HD2 TYR 20 8.865 21.676 3.952
139 HE1 TYR 20 HE1 TYR 20 10.203 19.162 -0.122
140 HE2 TYR 20 HE2 TYR 20 9.870 22.875 1.948
141 HH TYR 20 HH TYR 20 10.684 22.685 -0.038
142 H CYS 21 HN CYS 21 6.949 16.215 4.655
143 HA CYS 21 HA CYS 21 6.767 15.306 1.960
144 1HB CYS 21 HB2 CYS 21 8.004 13.955 3.452
145 2HB CYS 21 HB3 CYS 21 6.719 13.936 4.643
146 H ASP 22 HN ASP 22 4.575 15.515 4.868
147 HA ASP 22 HA ASP 22 2.832 13.642 3.871
148 1HB ASP 22 HB2 ASP 22 3.004 14.385 6.262
149 2HB ASP 22 HB3 ASP 22 2.276 15.920 5.830
150 HD2 ASP 22 HD2 ASP 22 -0.860 14.668 6.379
151 H ASN 23 HN ASN 23 2.885 17.252 3.732
152 HA ASN 23 HA ASN 23 0.298 17.606 2.864
153 1HB ASN 23 HB2 ASN 23 0.945 19.861 2.437
154 2HB ASN 23 HB3 ASN 23 2.084 19.347 3.666
155 1HD2 ASN 23 HD21 ASN 23 4.932 19.187 1.567
156 2HD2 ASN 23 HD22 ASN 23 4.213 18.786 3.090
157 H GLN 24 HN GLN 24 3.299 16.638 1.224
158 HA GLN 24 HA GLN 24 2.240 17.280 -1.367
159 1HB GLN 24 HB2 GLN 24 4.691 17.579 -0.639
160 2HB GLN 24 HB3 GLN 24 4.843 15.836 -0.732
161 1HG GLN 24 HG2 GLN 24 4.092 15.912 -3.129
162 2HG GLN 24 HG3 GLN 24 3.984 17.658 -3.030
163 1HE2 GLN 24 HE21 GLN 24 7.505 18.252 -2.853
164 2HE2 GLN 24 HE22 GLN 24 5.964 18.806 -2.287
165 H CYS 25 HN CYS 25 2.596 14.525 0.815
166 HA CYS 25 HA CYS 25 2.405 12.539 -1.190
167 1HB CYS 25 HB2 CYS 25 2.004 12.460 1.803
168 2HB CYS 25 HB3 CYS 25 1.887 11.044 0.777
169 H LYS 26 HN LYS 26 0.076 14.147 1.116
170 HA LYS 26 HA LYS 26 -1.792 12.042 0.663
171 1HB LYS 26 HB2 LYS 26 -2.694 12.720 2.604
172 2HB LYS 26 HB3 LYS 26 -1.226 13.663 2.768
173 1HG LYS 26 HG2 LYS 26 -3.695 14.756 1.355
174 2HG LYS 26 HG3 LYS 26 -3.469 14.918 3.085
175 1HD LYS 26 HD2 LYS 26 -1.439 16.216 2.793
176 2HD LYS 26 HD3 LYS 26 -1.360 15.836 1.085
177 1HE LYS 26 HE2 LYS 26 -3.481 17.099 0.696
178 2HE LYS 26 HE3 LYS 26 -3.584 17.464 2.407
179 1HZ LYS 26 HZ1 LYS 26 -1.590 18.762 2.262
180 2HZ LYS 26 HZ2 LYS 26 -1.254 18.259 0.750
181 H MET 27 HN MET 27 -1.006 14.970 -0.958
182 HA MET 27 HA MET 27 -3.619 15.871 -1.433
183 1HB MET 27 HB2 MET 27 -2.520 17.514 -2.846
184 2HB MET 27 HB3 MET 27 -1.405 17.196 -1.532
185 1HG MET 27 HG2 MET 27 -0.324 15.413 -3.082
186 2HG MET 27 HG3 MET 27 -1.273 16.112 -4.378
187 1HE MET 27 HE1 MET 27 0.854 16.766 -5.774
188 2HE MET 27 HE2 MET 27 2.274 17.575 -5.069
189 3HE MET 27 HE3 MET 27 1.814 15.947 -4.519
190 H LYS 28 HN LYS 28 -1.722 13.301 -2.797
191 HA LYS 28 HA LYS 28 -3.557 12.862 -4.936
192 1HB LYS 28 HB2 LYS 28 -2.310 14.715 -5.919
193 2HB LYS 28 HB3 LYS 28 -0.789 13.906 -5.600
194 1HG LYS 28 HG2 LYS 28 -2.737 12.227 -7.086
195 2HG LYS 28 HG3 LYS 28 -2.263 13.678 -7.946
196 1HD LYS 28 HD2 LYS 28 0.169 13.068 -7.505
197 2HD LYS 28 HD3 LYS 28 -0.382 11.556 -6.814
198 1HE LYS 28 HE2 LYS 28 0.148 11.052 -9.098
199 2HE LYS 28 HE3 LYS 28 -1.602 11.106 -9.031
200 1HZ LYS 28 HZ1 LYS 28 0.138 13.333 -9.950
201 2HZ LYS 28 HZ2 LYS 28 -0.787 12.396 -10.909
202 H LYS 29 HN LYS 29 -0.212 12.266 -3.642
203 HA LYS 29 HA LYS 29 0.079 9.941 -5.187
204 1HB LYS 29 HB2 LYS 29 1.623 10.945 -2.778
205 2HB LYS 29 HB3 LYS 29 2.123 9.610 -3.796
206 1HG LYS 29 HG2 LYS 29 1.468 12.304 -5.034
207 2HG LYS 29 HG3 LYS 29 3.036 12.033 -4.301
208 1HD LYS 29 HD2 LYS 29 3.392 10.051 -5.784
209 2HD LYS 29 HD3 LYS 29 1.818 10.307 -6.510
210 1HE LYS 29 HE2 LYS 29 2.579 12.620 -7.227
211 2HE LYS 29 HE3 LYS 29 4.174 12.251 -6.601
212 1HZ LYS 29 HZ1 LYS 29 2.836 10.594 -8.670
213 2HZ LYS 29 HZ2 LYS 29 3.893 11.781 -9.024
214 H ALA 30 HN ALA 30 -1.114 10.547 -1.843
215 HA ALA 30 HA ALA 30 -1.487 7.701 -1.456
216 1HB ALA 30 HB1 ALA 30 0.980 8.382 -0.986
217 2HB ALA 30 HB2 ALA 30 0.323 9.199 0.452
218 3HB ALA 30 HB3 ALA 30 0.113 7.443 0.253
219 H SER 31 HN SER 31 -2.053 7.533 1.160
220 HA SER 31 HA SER 31 -4.213 9.389 1.469
221 1HB SER 31 HB2 SER 31 -4.987 7.945 3.205
222 2HB SER 31 HB3 SER 31 -4.338 6.882 1.972
223 HG SER 31 HG SER 31 -2.314 6.824 3.239
224 H GLY 32 HN GLY 32 -0.965 8.733 2.778
225 1HA GLY 32 HA1 GLY 32 -0.918 11.409 3.865
226 2HA GLY 32 HA2 GLY 32 -0.806 10.145 5.074
227 H GLY 33 HN GLY 33 1.402 11.198 5.411
228 1HA GLY 33 HA1 GLY 33 3.291 9.320 4.499
229 2HA GLY 33 HA2 GLY 33 3.513 10.818 3.616
230 H HIS 34 HN HIS 34 5.481 9.772 5.441
231 HA HIS 34 HA HIS 34 5.688 12.322 6.799
232 1HB HIS 34 HB2 HIS 34 6.055 11.556 8.897
233 2HB HIS 34 HB3 HIS 34 4.973 10.289 8.355
234 HD1 HIS 34 HD1 HIS 34 8.445 10.900 9.516
235 HD2 HIS 34 HD2 HIS 34 6.298 7.794 7.689
236 HE1 HIS 34 HE1 HIS 34 9.874 8.800 9.766
237 H CYS 35 HN CYS 35 8.194 12.317 7.748
238 HA CYS 35 HA CYS 35 9.606 11.918 5.226
239 1HB CYS 35 HB2 CYS 35 9.351 14.232 6.006
240 2HB CYS 35 HB3 CYS 35 10.172 13.831 7.501
241 H TYR 36 HN TYR 36 10.770 10.013 5.281
242 HA TYR 36 HA TYR 36 12.034 9.300 7.836
243 1HB TYR 36 HB2 TYR 36 10.303 7.786 6.625
244 2HB TYR 36 HB3 TYR 36 11.426 7.682 5.284
245 HD1 TYR 36 HD1 TYR 36 13.588 6.471 5.549
246 HD2 TYR 36 HD2 TYR 36 10.631 6.501 8.641
247 HE1 TYR 36 HE1 TYR 36 14.719 4.483 6.660
248 HE2 TYR 36 HE2 TYR 36 11.771 4.513 9.741
249 HH TYR 36 HH TYR 36 13.382 3.085 9.645
250 H ALA 37 HN ALA 37 14.206 9.529 7.989
251 HA ALA 37 HA ALA 37 16.297 9.992 7.351
252 1HB ALA 37 HB1 ALA 37 17.316 8.170 6.067
253 2HB ALA 37 HB2 ALA 37 16.118 7.515 7.210
254 3HB ALA 37 HB3 ALA 37 15.715 7.659 5.482
255 H MET 38 HN MET 38 14.719 11.898 6.227
256 HA MET 38 HA MET 38 14.655 13.394 4.648
257 1HB MET 38 HB2 MET 38 17.241 13.059 5.128
258 2HB MET 38 HB3 MET 38 17.284 12.295 3.552
259 1HG MET 38 HG2 MET 38 16.283 14.374 2.538
260 2HG MET 38 HG3 MET 38 16.302 15.136 4.116
261 1HE MET 38 HE1 MET 38 18.141 14.224 0.981
262 2HE MET 38 HE2 MET 38 19.871 14.221 1.401
263 3HE MET 38 HE3 MET 38 18.818 12.897 1.955
264 H SER 39 HN SER 39 13.274 10.964 4.009
265 HA SER 39 HA SER 39 13.077 11.631 1.228
266 1HB SER 39 HB2 SER 39 13.660 8.827 2.221
267 2HB SER 39 HB3 SER 39 12.738 9.064 0.750
268 HG SER 39 HG SER 39 15.296 10.339 1.175
269 H CYS 40 HN CYS 40 10.891 11.508 0.493
270 HA CYS 40 HA CYS 40 9.120 11.764 2.688
271 1HB CYS 40 HB2 CYS 40 8.940 13.296 0.864
272 2HB CYS 40 HB3 CYS 40 8.745 12.000 -0.298
273 H TYR 41 HN TYR 41 8.788 9.725 3.682
274 HA TYR 41 HA TYR 41 8.067 7.448 2.092
275 1HB TYR 41 HB2 TYR 41 9.303 7.565 4.375
276 2HB TYR 41 HB3 TYR 41 7.793 8.089 5.094
277 HD1 TYR 41 HD1 TYR 41 6.023 6.523 5.573
278 HD2 TYR 41 HD2 TYR 41 9.532 5.246 3.486
279 HE1 TYR 41 HE1 TYR 41 5.358 4.095 5.928
280 HE2 TYR 41 HE2 TYR 41 8.856 2.822 3.848
281 HH TYR 41 HH TYR 41 5.969 2.020 5.745
282 H CYS 42 HN CYS 42 6.157 7.787 0.941
283 HA CYS 42 HA CYS 42 3.969 9.073 2.304
284 1HB CYS 42 HB2 CYS 42 4.205 8.015 -0.520
285 2HB CYS 42 HB3 CYS 42 2.829 8.891 0.117
286 H GLU 43 HN GLU 43 1.736 7.963 2.266
287 HA GLU 43 HA GLU 43 2.228 5.180 2.965
288 1HB GLU 43 HB2 GLU 43 1.168 7.391 4.761
289 2HB GLU 43 HB3 GLU 43 0.842 5.704 5.100
290 1HG GLU 43 HG2 GLU 43 3.263 5.210 5.191
291 2HG GLU 43 HG3 GLU 43 3.646 6.855 4.724
292 HE2 GLU 43 HE2 GLU 43 2.451 6.127 8.484
293 H GLY 44 HN GLY 44 0.666 3.866 2.126
294 1HA GLY 44 HA1 GLY 44 -1.429 3.142 1.619
295 2HA GLY 44 HA2 GLY 44 -2.102 4.663 2.169
296 H LEU 45 HN LEU 45 0.005 3.361 -0.497
297 HA LEU 45 HA LEU 45 -1.231 5.305 -2.292
298 1HB LEU 45 HB2 LEU 45 1.190 3.522 -2.542
299 2HB LEU 45 HB3 LEU 45 0.541 4.458 -3.873
300 HG LEU 45 HG LEU 45 0.801 6.447 -2.094
301 1HD1 LEU 45 HD11 LEU 45 2.975 6.132 -0.883
302 2HD1 LEU 45 HD12 LEU 45 1.617 5.168 -0.253
303 3HD1 LEU 45 HD13 LEU 45 2.865 4.396 -1.261
304 1HD2 LEU 45 HD21 LEU 45 1.739 6.537 -4.290
305 2HD2 LEU 45 HD22 LEU 45 3.035 6.906 -3.127
306 3HD2 LEU 45 HD23 LEU 45 2.953 5.299 -3.887
307 HA PRO 46 HA PRO 46 -3.255 1.980 -4.455
308 1HB PRO 46 HB2 PRO 46 -3.446 3.077 -6.951
309 2HB PRO 46 HB3 PRO 46 -4.627 3.358 -5.687
310 1HG PRO 46 HG2 PRO 46 -2.526 5.176 -6.698
311 2HG PRO 46 HG3 PRO 46 -3.957 5.564 -5.765
312 1HD PRO 46 HD2 PRO 46 -1.264 5.406 -4.791
313 2HD PRO 46 HD3 PRO 46 -2.709 5.680 -3.838
314 H GLU 47 HN GLU 47 -2.878 0.340 -6.158
315 HA GLU 47 HA GLU 47 -0.249 -0.351 -5.499
316 1HB GLU 47 HB2 GLU 47 -0.761 -2.489 -6.499
317 2HB GLU 47 HB3 GLU 47 -2.210 -1.934 -5.683
318 1HG GLU 47 HG2 GLU 47 -2.972 -0.962 -7.943
319 2HG GLU 47 HG3 GLU 47 -1.627 -1.815 -8.675
320 HE2 GLU 47 HE2 GLU 47 -4.809 -3.890 -7.420
321 H ASN 48 HN ASN 48 -1.674 1.314 -8.204
322 HA ASN 48 HA ASN 48 0.049 0.403 -10.195
323 1HB ASN 48 HB2 ASN 48 -0.767 2.383 -11.470
324 2HB ASN 48 HB3 ASN 48 -2.100 1.578 -10.667
325 1HD2 ASN 48 HD21 ASN 48 -1.911 5.404 -10.202
326 2HD2 ASN 48 HD22 ASN 48 -1.610 4.385 -11.570
327 H ALA 49 HN ALA 49 0.217 2.880 -7.642
328 HA ALA 49 HA ALA 49 2.563 4.120 -8.819
329 1HB ALA 49 HB1 ALA 49 1.004 4.655 -6.257
330 2HB ALA 49 HB2 ALA 49 2.349 5.646 -6.869
331 3HB ALA 49 HB3 ALA 49 0.835 5.531 -7.797
332 H LYS 50 HN LYS 50 4.070 2.361 -8.772
333 HA LYS 50 HA LYS 50 4.509 0.827 -6.465
334 1HB LYS 50 HB2 LYS 50 6.337 -0.097 -7.642
335 2HB LYS 50 HB3 LYS 50 5.114 0.249 -8.848
336 1HG LYS 50 HG2 LYS 50 6.820 1.301 -9.955
337 2HG LYS 50 HG3 LYS 50 6.481 2.630 -8.864
338 1HD LYS 50 HD2 LYS 50 8.157 1.540 -7.226
339 2HD LYS 50 HD3 LYS 50 8.615 0.477 -8.541
340 1HE LYS 50 HE2 LYS 50 9.251 2.420 -9.941
341 2HE LYS 50 HE3 LYS 50 8.694 3.528 -8.703
342 1HZ LYS 50 HZ1 LYS 50 11.114 3.146 -8.599
343 2HZ LYS 50 HZ2 LYS 50 10.402 2.672 -7.213
344 H VAL 51 HN VAL 51 6.313 0.881 -4.964
345 HA VAL 51 HA VAL 51 7.601 3.499 -4.769
346 HB VAL 51 HB VAL 51 7.098 3.597 -2.389
347 1HG1 VAL 51 HG11 VAL 51 4.502 3.233 -3.911
348 2HG1 VAL 51 HG12 VAL 51 4.836 4.333 -2.552
349 3HG1 VAL 51 HG13 VAL 51 5.583 4.628 -4.140
350 1HG2 VAL 51 HG21 VAL 51 6.880 1.254 -1.844
351 2HG2 VAL 51 HG22 VAL 51 5.362 2.083 -1.422
352 3HG2 VAL 51 HG23 VAL 51 5.456 1.095 -2.900
353 H SER 52 HN SER 52 9.571 3.429 -3.359
354 HA SER 52 HA SER 52 10.520 0.706 -3.002
355 1HB SER 52 HB2 SER 52 12.193 1.977 -4.095
356 2HB SER 52 HB3 SER 52 11.881 3.406 -3.131
357 HG SER 52 HG SER 52 13.755 1.559 -2.699
358 H ASP 53 HN ASP 53 11.196 -0.032 -0.852
359 HA ASP 53 HA ASP 53 11.118 2.075 1.155
360 1HB ASP 53 HB2 ASP 53 10.586 0.275 2.850
361 2HB ASP 53 HB3 ASP 53 9.291 0.585 1.710
362 HD2 ASP 53 HD2 ASP 53 9.204 -0.771 -0.018
363 H SER 54 HN SER 54 13.358 1.287 -0.566
364 HA SER 54 HA SER 54 14.744 -0.724 1.027
365 1HB SER 54 HB2 SER 54 15.942 -1.216 -1.197
366 2HB SER 54 HB3 SER 54 14.261 -1.699 -1.085
367 HG SER 54 HG SER 54 14.688 -0.604 -3.090
368 H ALA 55 HN ALA 55 14.886 2.131 1.634
369 HA ALA 55 HA ALA 55 16.508 3.406 2.436
370 1HB ALA 55 HB1 ALA 55 18.236 0.950 1.922
371 2HB ALA 55 HB2 ALA 55 18.610 2.285 3.039
372 3HB ALA 55 HB3 ALA 55 17.224 1.217 3.361
373 H THR 56 HN THR 56 15.893 4.113 -0.113
374 HA THR 56 HA THR 56 16.692 5.463 -1.688
375 HB THR 56 HB THR 56 19.250 5.541 -0.012
376 HG1 THR 56 HG1 THR 56 16.643 6.884 0.169
377 1HG2 THR 56 HG21 THR 56 19.152 7.973 -0.666
378 2HG2 THR 56 HG22 THR 56 19.339 6.911 -2.082
379 3HG2 THR 56 HG23 THR 56 17.749 7.613 -1.700
380 H ASN 57 HN ASN 57 16.709 2.849 -2.463
381 HA ASN 57 HA ASN 57 19.148 2.327 -3.770
382 1HB ASN 57 HB2 ASN 57 17.770 0.773 -5.159
383 2HB ASN 57 HB3 ASN 57 17.409 0.577 -3.456
384 1HD2 ASN 57 HD21 ASN 57 14.461 1.239 -6.003
385 2HD2 ASN 57 HD22 ASN 57 16.030 0.583 -6.330
386 H ILE 58 HN ILE 58 16.276 4.365 -4.310
387 HA ILE 58 HA ILE 58 17.070 5.059 -6.991
388 HB ILE 58 HB ILE 58 14.980 6.196 -5.131
389 1HG1 ILE 58 HG12 ILE 58 13.973 4.820 -7.459
390 2HG1 ILE 58 HG13 ILE 58 15.051 3.761 -6.573
391 1HG2 ILE 58 HG21 ILE 58 15.586 6.776 -8.039
392 2HG2 ILE 58 HG22 ILE 58 14.055 7.200 -7.236
393 3HG2 ILE 58 HG23 ILE 58 15.584 7.915 -6.671
394 1HD1 ILE 58 HD11 ILE 58 12.711 3.588 -5.744
395 2HD1 ILE 58 HD12 ILE 58 13.806 4.190 -4.476
396 3HD1 ILE 58 HD13 ILE 58 12.735 5.321 -5.338
397 H CYS 59 HN CYS 59 17.580 7.410 -7.550
398 HA CYS 59 HA CYS 59 19.969 7.712 -5.980
399 1HB CYS 59 HB2 CYS 59 20.865 8.891 -7.824
400 2HB CYS 59 HB3 CYS 59 20.002 7.502 -8.456
401 H GLY 60 HN GLY 60 18.157 8.551 -4.256
402 1HA GLY 60 HA1 GLY 60 16.972 11.075 -4.677
403 2HA GLY 60 HA2 GLY 60 17.173 10.243 -3.148
Start of MODEL 2
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 0.525 -0.898
3 1HB LYS 1 HB2 LYS 1 1.551 1.780 1.216
4 2HB LYS 1 HB3 LYS 1 1.686 0.288 2.125
5 1HG LYS 1 HG2 LYS 1 3.956 -0.100 1.276
6 2HG LYS 1 HG3 LYS 1 3.824 1.253 0.170
7 1HD LYS 1 HD2 LYS 1 3.557 2.804 2.141
8 2HD LYS 1 HD3 LYS 1 3.766 1.439 3.220
9 1HE LYS 1 HE2 LYS 1 5.909 2.627 2.953
10 2HE LYS 1 HE3 LYS 1 6.035 1.018 2.272
11 1HZ LYS 1 HZ1 LYS 1 5.544 3.497 0.708
12 2HZ LYS 1 HZ2 LYS 1 6.941 2.660 0.742
13 H ASP 2 HN ASP 2 3.443 -0.914 -1.395
14 HA ASP 2 HA ASP 2 3.091 -3.603 -0.390
15 1HB ASP 2 HB2 ASP 2 3.172 -2.905 -3.363
16 2HB ASP 2 HB3 ASP 2 3.103 -4.525 -2.699
17 HD2 ASP 2 HD2 ASP 2 -0.252 -2.318 -2.651
18 H GLY 3 HN GLY 3 5.079 -4.878 -0.628
19 1HA GLY 3 HA1 GLY 3 7.152 -4.624 -2.274
20 2HA GLY 3 HA2 GLY 3 7.471 -3.308 -1.162
21 H TYR 4 HN TYR 4 9.473 -4.718 -0.759
22 HA TYR 4 HA TYR 4 8.905 -6.878 1.118
23 1HB TYR 4 HB2 TYR 4 11.630 -5.742 0.349
24 2HB TYR 4 HB3 TYR 4 11.220 -7.412 0.685
25 HD1 TYR 4 HD1 TYR 4 9.719 -8.638 -1.046
26 HD2 TYR 4 HD2 TYR 4 11.780 -4.980 -1.869
27 HE1 TYR 4 HE1 TYR 4 9.537 -9.088 -3.541
28 HE2 TYR 4 HE2 TYR 4 11.590 -5.443 -4.362
29 HH TYR 4 HH TYR 4 10.878 -6.780 -5.892
30 HA PRO 5 HA PRO 5 9.373 -3.908 4.286
31 1HB PRO 5 HB2 PRO 5 8.613 -5.499 6.373
32 2HB PRO 5 HB3 PRO 5 7.472 -4.631 5.365
33 1HG PRO 5 HG2 PRO 5 8.118 -7.516 5.373
34 2HG PRO 5 HG3 PRO 5 6.717 -6.707 4.699
35 1HD PRO 5 HD2 PRO 5 8.973 -7.726 3.250
36 2HD PRO 5 HD3 PRO 5 7.628 -6.815 2.591
37 H VAL 6 HN VAL 6 11.123 -3.117 5.279
38 HA VAL 6 HA VAL 6 12.947 -5.138 6.341
39 HB VAL 6 HB VAL 6 14.840 -3.918 5.304
40 1HG1 VAL 6 HG11 VAL 6 12.870 -5.007 3.267
41 2HG1 VAL 6 HG12 VAL 6 14.644 -4.952 3.127
42 3HG1 VAL 6 HG13 VAL 6 13.879 -6.009 4.338
43 1HG2 VAL 6 HG21 VAL 6 12.627 -2.473 3.814
44 2HG2 VAL 6 HG22 VAL 6 13.866 -1.761 4.875
45 3HG2 VAL 6 HG23 VAL 6 14.335 -2.476 3.314
46 H ASP 7 HN ASP 7 13.515 -4.627 8.394
47 HA ASP 7 HA ASP 7 14.237 -2.004 9.049
48 1HB ASP 7 HB2 ASP 7 12.380 -2.141 11.042
49 2HB ASP 7 HB3 ASP 7 12.132 -1.249 9.554
50 HD2 ASP 7 HD2 ASP 7 10.130 -4.687 10.076
51 H SER 8 HN SER 8 12.522 -4.700 10.837
52 HA SER 8 HA SER 8 14.338 -4.341 12.970
53 1HB SER 8 HB2 SER 8 12.999 -6.213 14.024
54 2HB SER 8 HB3 SER 8 12.039 -4.845 13.496
55 HG SER 8 HG SER 8 11.077 -6.042 11.965
56 H LYS 9 HN LYS 9 13.863 -6.696 10.319
57 HA LYS 9 HA LYS 9 15.756 -8.542 11.483
58 1HB LYS 9 HB2 LYS 9 15.155 -10.000 9.680
59 2HB LYS 9 HB3 LYS 9 13.686 -9.308 10.338
60 1HG LYS 9 HG2 LYS 9 14.316 -7.446 8.394
61 2HG LYS 9 HG3 LYS 9 14.931 -8.913 7.659
62 1HD LYS 9 HD2 LYS 9 12.683 -8.871 6.932
63 2HD LYS 9 HD3 LYS 9 12.627 -9.975 8.293
64 1HE LYS 9 HE2 LYS 9 10.778 -8.468 8.597
65 2HE LYS 9 HE3 LYS 9 11.986 -7.979 9.768
66 1HZ LYS 9 HZ1 LYS 9 11.537 -6.687 7.130
67 2HZ LYS 9 HZ2 LYS 9 11.151 -6.051 8.579
68 H GLY 10 HN GLY 10 15.760 -5.736 9.450
69 1HA GLY 10 HA1 GLY 10 17.607 -4.692 8.567
70 2HA GLY 10 HA2 GLY 10 18.565 -6.141 8.797
71 H CYS 11 HN CYS 11 18.049 -8.069 7.329
72 HA CYS 11 HA CYS 11 17.571 -6.921 4.675
73 1HB CYS 11 HB2 CYS 11 19.609 -8.926 5.626
74 2HB CYS 11 HB3 CYS 11 19.162 -8.797 3.937
75 H LYS 12 HN LYS 12 15.185 -7.671 5.436
76 HA LYS 12 HA LYS 12 13.693 -8.594 4.069
77 1HB LYS 12 HB2 LYS 12 16.068 -9.146 2.710
78 2HB LYS 12 HB3 LYS 12 15.275 -10.704 2.820
79 1HG LYS 12 HG2 LYS 12 14.483 -9.620 0.797
80 2HG LYS 12 HG3 LYS 12 13.154 -9.642 1.938
81 1HD LYS 12 HD2 LYS 12 13.036 -7.375 1.960
82 2HD LYS 12 HD3 LYS 12 14.740 -7.231 2.341
83 1HE LYS 12 HE2 LYS 12 15.293 -7.556 -0.094
84 2HE LYS 12 HE3 LYS 12 13.581 -7.646 -0.458
85 1HZ LYS 12 HZ1 LYS 12 14.888 -5.296 0.808
86 2HZ LYS 12 HZ2 LYS 12 14.484 -5.388 -0.766
87 H LEU 13 HN LEU 13 12.165 -10.270 4.333
88 HA LEU 13 HA LEU 13 12.546 -11.927 6.593
89 1HB LEU 13 HB2 LEU 13 10.421 -11.804 4.455
90 2HB LEU 13 HB3 LEU 13 10.354 -12.905 5.818
91 HG LEU 13 HG LEU 13 10.683 -9.962 6.321
92 1HD1 LEU 13 HD11 LEU 13 8.861 -9.927 4.795
93 2HD1 LEU 13 HD12 LEU 13 8.107 -11.350 5.554
94 3HD1 LEU 13 HD13 LEU 13 8.171 -9.803 6.431
95 1HD2 LEU 13 HD21 LEU 13 10.902 -11.589 8.171
96 2HD2 LEU 13 HD22 LEU 13 9.542 -10.462 8.392
97 3HD2 LEU 13 HD23 LEU 13 9.236 -12.133 7.861
98 H SER 14 HN SER 14 13.309 -12.204 3.180
99 HA SER 14 HA SER 14 14.488 -13.685 2.120
100 1HB SER 14 HB2 SER 14 15.167 -14.866 4.849
101 2HB SER 14 HB3 SER 14 16.074 -15.107 3.369
102 HG SER 14 HG SER 14 15.714 -12.630 4.822
103 H CYS 15 HN CYS 15 11.931 -14.311 1.855
104 HA CYS 15 HA CYS 15 11.214 -16.817 2.959
105 1HB CYS 15 HB2 CYS 15 9.284 -16.687 1.474
106 2HB CYS 15 HB3 CYS 15 9.517 -15.209 2.386
107 H VAL 16 HN VAL 16 11.083 -18.875 1.810
108 HA VAL 16 HA VAL 16 12.391 -18.883 -0.818
109 HB VAL 16 HB VAL 16 12.637 -21.161 1.123
110 1HG1 VAL 16 HG11 VAL 16 14.304 -20.219 -1.234
111 2HG1 VAL 16 HG12 VAL 16 14.679 -21.623 -0.206
112 3HG1 VAL 16 HG13 VAL 16 13.201 -21.616 -1.199
113 1HG2 VAL 16 HG21 VAL 16 13.511 -19.324 2.393
114 2HG2 VAL 16 HG22 VAL 16 14.895 -20.234 1.740
115 3HG2 VAL 16 HG23 VAL 16 14.403 -18.698 0.986
116 H ALA 17 HN ALA 17 9.511 -18.771 0.339
117 HA ALA 17 HA ALA 17 8.384 -20.670 -1.444
118 1HB ALA 17 HB1 ALA 17 7.167 -21.945 0.381
119 2HB ALA 17 HB2 ALA 17 8.911 -22.285 0.262
120 3HB ALA 17 HB3 ALA 17 8.298 -21.215 1.546
121 H ASN 18 HN ASN 18 5.974 -20.460 -1.476
122 HA ASN 18 HA ASN 18 5.507 -17.691 -1.350
123 1HB ASN 18 HB2 ASN 18 3.633 -20.028 -1.999
124 2HB ASN 18 HB3 ASN 18 3.226 -18.344 -2.263
125 1HD2 ASN 18 HD21 ASN 18 4.470 -19.834 -5.440
126 2HD2 ASN 18 HD22 ASN 18 3.194 -20.143 -4.310
127 H ASN 19 HN ASN 19 4.209 -20.644 0.313
128 HA ASN 19 HA ASN 19 2.221 -19.353 1.723
129 1HB ASN 19 HB2 ASN 19 2.377 -21.392 3.258
130 2HB ASN 19 HB3 ASN 19 2.220 -21.781 1.556
131 1HD2 ASN 19 HD21 ASN 19 5.380 -23.029 3.730
132 2HD2 ASN 19 HD22 ASN 19 3.998 -22.204 4.371
133 H TYR 20 HN TYR 20 5.726 -19.806 2.256
134 HA TYR 20 HA TYR 20 5.758 -19.313 5.023
135 1HB TYR 20 HB2 TYR 20 7.543 -20.382 3.530
136 2HB TYR 20 HB3 TYR 20 7.801 -18.826 2.765
137 HD1 TYR 20 HD1 TYR 20 8.916 -16.988 3.992
138 HD2 TYR 20 HD2 TYR 20 8.447 -20.869 5.728
139 HE1 TYR 20 HE1 TYR 20 10.666 -16.421 5.748
140 HE2 TYR 20 HE2 TYR 20 10.198 -20.290 7.478
141 HH TYR 20 HH TYR 20 11.592 -18.817 8.207
142 H CYS 21 HN CYS 21 5.842 -17.192 2.138
143 HA CYS 21 HA CYS 21 6.435 -14.865 3.662
144 1HB CYS 21 HB2 CYS 21 7.072 -14.854 1.383
145 2HB CYS 21 HB3 CYS 21 5.474 -15.330 0.843
146 H ASP 22 HN ASP 22 3.481 -16.398 2.189
147 HA ASP 22 HA ASP 22 1.880 -14.234 2.354
148 1HB ASP 22 HB2 ASP 22 1.268 -16.317 1.184
149 2HB ASP 22 HB3 ASP 22 1.172 -17.183 2.704
150 HD2 ASP 22 HD2 ASP 22 -0.445 -16.795 3.976
151 H ASN 23 HN ASN 23 2.445 -16.866 4.793
152 HA ASN 23 HA ASN 23 0.342 -16.056 6.438
153 1HB ASN 23 HB2 ASN 23 1.073 -17.798 7.898
154 2HB ASN 23 HB3 ASN 23 1.594 -18.350 6.319
155 1HD2 ASN 23 HD21 ASN 23 5.058 -17.927 6.825
156 2HD2 ASN 23 HD22 ASN 23 3.758 -18.302 5.743
157 H GLN 24 HN GLN 24 3.744 -15.117 6.062
158 HA GLN 24 HA GLN 24 3.878 -14.202 8.797
159 1HB GLN 24 HB2 GLN 24 6.143 -14.517 8.651
160 2HB GLN 24 HB3 GLN 24 5.696 -15.550 7.308
161 1HG GLN 24 HG2 GLN 24 5.907 -13.463 5.800
162 2HG GLN 24 HG3 GLN 24 6.638 -12.654 7.171
163 1HE2 GLN 24 HE21 GLN 24 9.432 -15.057 7.316
164 2HE2 GLN 24 HE22 GLN 24 8.257 -14.312 8.348
165 H CYS 25 HN CYS 25 3.211 -13.009 5.622
166 HA CYS 25 HA CYS 25 3.953 -10.315 6.170
167 1HB CYS 25 HB2 CYS 25 2.148 -11.579 4.105
168 2HB CYS 25 HB3 CYS 25 2.397 -9.848 4.220
169 H LYS 26 HN LYS 26 1.006 -12.403 6.464
170 HA LYS 26 HA LYS 26 -0.678 -10.114 6.732
171 1HB LYS 26 HB2 LYS 26 -2.481 -11.732 6.830
172 2HB LYS 26 HB3 LYS 26 -1.384 -12.130 5.523
173 1HG LYS 26 HG2 LYS 26 -0.819 -14.131 6.461
174 2HG LYS 26 HG3 LYS 26 -0.566 -13.415 8.040
175 1HD LYS 26 HD2 LYS 26 -3.367 -13.885 6.943
176 2HD LYS 26 HD3 LYS 26 -2.496 -15.147 7.791
177 1HE LYS 26 HE2 LYS 26 -2.218 -13.594 9.761
178 2HE LYS 26 HE3 LYS 26 -3.157 -12.381 8.914
179 1HZ LYS 26 HZ1 LYS 26 -4.538 -13.723 10.420
180 2HZ LYS 26 HZ2 LYS 26 -5.038 -13.920 8.883
181 H MET 27 HN MET 27 1.317 -11.948 8.862
182 HA MET 27 HA MET 27 -0.432 -12.155 11.021
183 1HB MET 27 HB2 MET 27 1.550 -12.893 12.229
184 2HB MET 27 HB3 MET 27 1.754 -13.444 10.578
185 1HG MET 27 HG2 MET 27 3.094 -11.296 10.132
186 2HG MET 27 HG3 MET 27 3.036 -10.984 11.856
187 1HE MET 27 HE1 MET 27 5.745 -11.143 10.441
188 2HE MET 27 HE2 MET 27 5.600 -11.012 12.210
189 3HE MET 27 HE3 MET 27 6.683 -12.229 11.494
190 H LYS 28 HN LYS 28 1.445 -9.487 9.747
191 HA LYS 28 HA LYS 28 0.651 -7.766 11.880
192 1HB LYS 28 HB2 LYS 28 2.539 -8.941 12.955
193 2HB LYS 28 HB3 LYS 28 3.593 -8.466 11.638
194 1HG LYS 28 HG2 LYS 28 2.781 -6.011 12.209
195 2HG LYS 28 HG3 LYS 28 2.289 -6.709 13.739
196 1HD LYS 28 HD2 LYS 28 5.107 -6.915 12.573
197 2HD LYS 28 HD3 LYS 28 4.620 -5.747 13.786
198 1HE LYS 28 HE2 LYS 28 3.921 -7.688 15.281
199 2HE LYS 28 HE3 LYS 28 4.591 -8.787 14.091
200 1HZ LYS 28 HZ1 LYS 28 6.209 -8.246 15.837
201 2HZ LYS 28 HZ2 LYS 28 6.758 -7.720 14.397
202 H LYS 29 HN LYS 29 3.040 -8.250 9.159
203 HA LYS 29 HA LYS 29 3.545 -5.488 9.103
204 1HB LYS 29 HB2 LYS 29 4.255 -7.740 7.206
205 2HB LYS 29 HB3 LYS 29 4.825 -6.095 7.007
206 1HG LYS 29 HG2 LYS 29 5.191 -7.517 9.664
207 2HG LYS 29 HG3 LYS 29 6.303 -7.825 8.345
208 1HD LYS 29 HD2 LYS 29 6.794 -5.380 8.179
209 2HD LYS 29 HD3 LYS 29 5.669 -5.060 9.484
210 1HE LYS 29 HE2 LYS 29 7.696 -5.148 10.656
211 2HE LYS 29 HE3 LYS 29 7.134 -6.798 10.841
212 1HZ LYS 29 HZ1 LYS 29 9.377 -6.911 10.093
213 2HZ LYS 29 HZ2 LYS 29 8.492 -7.310 8.786
214 H ALA 30 HN ALA 30 1.270 -7.617 7.345
215 HA ALA 30 HA ALA 30 0.299 -5.345 5.830
216 1HB ALA 30 HB1 ALA 30 2.396 -6.517 4.719
217 2HB ALA 30 HB2 ALA 30 1.200 -7.756 4.266
218 3HB ALA 30 HB3 ALA 30 0.984 -6.072 3.731
219 H SER 31 HN SER 31 -1.307 -6.618 4.008
220 HA SER 31 HA SER 31 -3.083 -8.085 5.723
221 1HB SER 31 HB2 SER 31 -4.498 -8.042 3.507
222 2HB SER 31 HB3 SER 31 -4.293 -6.563 4.424
223 HG SER 31 HG SER 31 -2.504 -7.286 2.274
224 H GLY 32 HN GLY 32 -0.767 -8.591 3.093
225 1HA GLY 32 HA1 GLY 32 -0.678 -11.380 3.446
226 2HA GLY 32 HA2 GLY 32 -1.700 -11.023 2.067
227 H GLY 33 HN GLY 33 0.036 -12.160 0.796
228 1HA GLY 33 HA1 GLY 33 1.059 -10.547 -1.016
229 2HA GLY 33 HA2 GLY 33 2.324 -10.444 0.192
230 H HIS 34 HN HIS 34 3.777 -11.465 -1.420
231 HA HIS 34 HA HIS 34 3.418 -14.330 -1.596
232 1HB HIS 34 HB2 HIS 34 2.130 -13.268 -3.491
233 2HB HIS 34 HB3 HIS 34 3.651 -12.648 -4.103
234 HD1 HIS 34 HD1 HIS 34 5.402 -14.425 -5.017
235 HD2 HIS 34 HD2 HIS 34 1.643 -15.980 -3.990
236 HE1 HIS 34 HE1 HIS 34 5.280 -16.750 -6.060
237 H CYS 35 HN CYS 35 5.398 -15.379 -2.604
238 HA CYS 35 HA CYS 35 7.686 -13.918 -1.587
239 1HB CYS 35 HB2 CYS 35 7.223 -16.223 -0.810
240 2HB CYS 35 HB3 CYS 35 7.448 -16.809 -2.446
241 H TYR 36 HN TYR 36 8.609 -12.577 -3.118
242 HA TYR 36 HA TYR 36 8.827 -13.653 -5.849
243 1HB TYR 36 HB2 TYR 36 7.383 -11.599 -5.496
244 2HB TYR 36 HB3 TYR 36 8.709 -10.807 -4.668
245 HD1 TYR 36 HD1 TYR 36 7.331 -11.767 -7.921
246 HD2 TYR 36 HD2 TYR 36 10.666 -9.979 -5.926
247 HE1 TYR 36 HE1 TYR 36 8.141 -10.799 -10.128
248 HE2 TYR 36 HE2 TYR 36 11.466 -9.017 -8.139
249 HH TYR 36 HH TYR 36 9.641 -9.623 -11.132
250 H ALA 37 HN ALA 37 10.845 -13.921 -6.699
251 HA ALA 37 HA ALA 37 13.056 -14.209 -6.603
252 1HB ALA 37 HB1 ALA 37 12.909 -11.232 -5.975
253 2HB ALA 37 HB2 ALA 37 14.303 -12.088 -6.675
254 3HB ALA 37 HB3 ALA 37 12.787 -11.955 -7.597
255 H MET 38 HN MET 38 12.115 -15.286 -4.335
256 HA MET 38 HA MET 38 12.633 -15.852 -2.296
257 1HB MET 38 HB2 MET 38 15.339 -14.660 -3.122
258 2HB MET 38 HB3 MET 38 15.120 -15.684 -1.717
259 1HG MET 38 HG2 MET 38 15.684 -17.348 -3.218
260 2HG MET 38 HG3 MET 38 13.966 -17.303 -3.563
261 1HE MET 38 HE1 MET 38 17.488 -16.860 -4.844
262 2HE MET 38 HE2 MET 38 17.376 -15.635 -6.131
263 3HE MET 38 HE3 MET 38 17.181 -15.157 -4.428
264 H SER 39 HN SER 39 11.468 -13.175 -2.613
265 HA SER 39 HA SER 39 12.345 -12.145 -0.063
266 1HB SER 39 HB2 SER 39 11.997 -10.328 -2.487
267 2HB SER 39 HB3 SER 39 12.458 -9.830 -0.872
268 HG SER 39 HG SER 39 13.981 -11.466 -2.708
269 H CYS 40 HN CYS 40 10.581 -11.468 1.189
270 HA CYS 40 HA CYS 40 8.115 -12.425 0.161
271 1HB CYS 40 HB2 CYS 40 8.758 -12.896 2.440
272 2HB CYS 40 HB3 CYS 40 8.862 -11.187 2.816
273 H TYR 41 HN TYR 41 7.411 -11.010 -1.514
274 HA TYR 41 HA TYR 41 7.235 -8.200 -1.108
275 1HB TYR 41 HB2 TYR 41 7.341 -9.545 -3.304
276 2HB TYR 41 HB3 TYR 41 5.745 -10.174 -2.950
277 HD1 TYR 41 HD1 TYR 41 3.843 -9.045 -3.723
278 HD2 TYR 41 HD2 TYR 41 7.563 -6.946 -3.484
279 HE1 TYR 41 HE1 TYR 41 2.801 -7.051 -4.907
280 HE2 TYR 41 HE2 TYR 41 6.509 -4.959 -4.669
281 HH TYR 41 HH TYR 41 4.745 -4.158 -5.613
282 H CYS 42 HN CYS 42 6.099 -7.728 0.814
283 HA CYS 42 HA CYS 42 3.596 -9.078 1.259
284 1HB CYS 42 HB2 CYS 42 5.080 -6.998 2.877
285 2HB CYS 42 HB3 CYS 42 3.568 -7.739 3.362
286 H GLU 43 HN GLU 43 1.571 -7.728 1.714
287 HA GLU 43 HA GLU 43 1.542 -5.480 -0.122
288 1HB GLU 43 HB2 GLU 43 -0.099 -8.032 -0.401
289 2HB GLU 43 HB3 GLU 43 -0.497 -6.547 -1.242
290 1HG GLU 43 HG2 GLU 43 1.968 -6.590 -2.106
291 2HG GLU 43 HG3 GLU 43 2.006 -8.250 -1.546
292 HE2 GLU 43 HE2 GLU 43 0.289 -6.077 -3.438
293 H GLY 44 HN GLY 44 0.307 -3.828 0.677
294 1HA GLY 44 HA1 GLY 44 -1.629 -2.922 1.568
295 2HA GLY 44 HA2 GLY 44 -2.058 -4.471 2.268
296 H LEU 45 HN LEU 45 0.904 -2.360 2.459
297 HA LEU 45 HA LEU 45 0.970 -2.868 5.316
298 1HB LEU 45 HB2 LEU 45 2.907 -1.605 3.378
299 2HB LEU 45 HB3 LEU 45 3.166 -1.631 5.111
300 HG LEU 45 HG LEU 45 2.669 -4.282 4.598
301 1HD1 LEU 45 HD11 LEU 45 4.106 -4.868 2.648
302 2HD1 LEU 45 HD12 LEU 45 2.593 -4.038 2.212
303 3HD1 LEU 45 HD13 LEU 45 4.133 -3.144 2.204
304 1HD2 LEU 45 HD21 LEU 45 5.318 -2.813 4.638
305 2HD2 LEU 45 HD22 LEU 45 4.428 -3.471 6.031
306 3HD2 LEU 45 HD23 LEU 45 5.125 -4.573 4.819
307 HA PRO 46 HA PRO 46 -0.010 1.399 6.207
308 1HB PRO 46 HB2 PRO 46 1.243 1.666 8.621
309 2HB PRO 46 HB3 PRO 46 -0.394 1.063 8.452
310 1HG PRO 46 HG2 PRO 46 2.083 -0.439 9.038
311 2HG PRO 46 HG3 PRO 46 0.419 -0.930 9.281
312 1HD PRO 46 HD2 PRO 46 2.169 -1.783 7.175
313 2HD PRO 46 HD3 PRO 46 0.472 -2.182 7.353
314 H GLU 47 HN GLU 47 1.081 3.538 6.492
315 HA GLU 47 HA GLU 47 3.060 3.235 4.454
316 1HB GLU 47 HB2 GLU 47 1.607 5.653 5.603
317 2HB GLU 47 HB3 GLU 47 2.812 5.785 4.337
318 1HG GLU 47 HG2 GLU 47 1.468 4.215 2.910
319 2HG GLU 47 HG3 GLU 47 0.257 4.116 4.172
320 HE2 GLU 47 HE2 GLU 47 -0.635 6.014 4.797
321 H ASN 48 HN ASN 48 3.173 3.271 7.789
322 HA ASN 48 HA ASN 48 5.407 5.010 8.073
323 1HB ASN 48 HB2 ASN 48 5.423 4.190 10.421
324 2HB ASN 48 HB3 ASN 48 3.794 4.624 9.943
325 1HD2 ASN 48 HD21 ASN 48 4.093 1.224 11.673
326 2HD2 ASN 48 HD22 ASN 48 4.774 2.783 11.997
327 H ALA 49 HN ALA 49 4.822 1.791 6.971
328 HA ALA 49 HA ALA 49 7.145 0.589 8.169
329 1HB ALA 49 HB1 ALA 49 5.015 -0.640 7.824
330 2HB ALA 49 HB2 ALA 49 5.193 -0.433 6.066
331 3HB ALA 49 HB3 ALA 49 6.373 -1.411 6.970
332 H LYS 50 HN LYS 50 9.173 0.572 7.322
333 HA LYS 50 HA LYS 50 9.634 1.722 4.747
334 1HB LYS 50 HB2 LYS 50 11.237 2.168 6.445
335 2HB LYS 50 HB3 LYS 50 11.406 0.472 6.852
336 1HG LYS 50 HG2 LYS 50 13.328 1.116 5.503
337 2HG LYS 50 HG3 LYS 50 12.331 0.039 4.545
338 1HD LYS 50 HD2 LYS 50 11.375 1.904 3.296
339 2HD LYS 50 HD3 LYS 50 12.099 3.077 4.378
340 1HE LYS 50 HE2 LYS 50 13.466 2.992 2.371
341 2HE LYS 50 HE3 LYS 50 14.388 2.256 3.668
342 1HZ LYS 50 HZ1 LYS 50 13.852 0.089 2.834
343 2HZ LYS 50 HZ2 LYS 50 12.753 0.658 1.775
344 H VAL 51 HN VAL 51 9.336 0.680 2.856
345 HA VAL 51 HA VAL 51 10.034 -2.175 2.828
346 HB VAL 51 HB VAL 51 8.299 -2.600 1.286
347 1HG1 VAL 51 HG11 VAL 51 7.134 -0.751 3.394
348 2HG1 VAL 51 HG12 VAL 51 6.293 -2.072 2.547
349 3HG1 VAL 51 HG13 VAL 51 7.624 -2.440 3.671
350 1HG2 VAL 51 HG21 VAL 51 7.970 0.406 1.132
351 2HG2 VAL 51 HG22 VAL 51 8.365 -0.732 -0.178
352 3HG2 VAL 51 HG23 VAL 51 6.737 -0.733 0.540
353 H SER 52 HN SER 52 10.950 -2.924 0.709
354 HA SER 52 HA SER 52 11.746 -0.670 -0.964
355 1HB SER 52 HB2 SER 52 13.737 -1.813 -0.358
356 2HB SER 52 HB3 SER 52 12.989 -3.392 -0.492
357 HG SER 52 HG SER 52 13.935 -1.655 -2.563
358 H ASP 53 HN ASP 53 11.396 -0.898 -3.315
359 HA ASP 53 HA ASP 53 10.066 -3.375 -4.053
360 1HB ASP 53 HB2 ASP 53 8.681 -2.118 -5.692
361 2HB ASP 53 HB3 ASP 53 8.347 -1.616 -4.047
362 HD2 ASP 53 HD2 ASP 53 9.858 -0.798 -6.918
363 H SER 54 HN SER 54 12.905 -2.782 -4.165
364 HA SER 54 HA SER 54 13.275 -1.838 -6.899
365 1HB SER 54 HB2 SER 54 15.424 -0.738 -5.919
366 2HB SER 54 HB3 SER 54 13.885 0.053 -5.639
367 HG SER 54 HG SER 54 15.258 -0.150 -3.704
368 H ALA 55 HN ALA 55 13.207 -4.467 -6.791
369 HA ALA 55 HA ALA 55 14.351 -6.323 -7.181
370 1HB ALA 55 HB1 ALA 55 16.611 -4.381 -7.813
371 2HB ALA 55 HB2 ALA 55 16.475 -6.062 -8.382
372 3HB ALA 55 HB3 ALA 55 15.305 -4.839 -8.932
373 H THR 56 HN THR 56 14.086 -6.007 -4.536
374 HA THR 56 HA THR 56 14.910 -6.802 -2.625
375 HB THR 56 HB THR 56 17.510 -7.469 -4.077
376 HG1 THR 56 HG1 THR 56 16.293 -9.296 -4.872
377 1HG2 THR 56 HG21 THR 56 17.271 -8.010 -1.598
378 2HG2 THR 56 HG22 THR 56 15.850 -9.001 -2.008
379 3HG2 THR 56 HG23 THR 56 17.458 -9.451 -2.626
380 H ASN 57 HN ASN 57 17.909 -5.454 -4.181
381 HA ASN 57 HA ASN 57 18.826 -3.494 -3.948
382 1HB ASN 57 HB2 ASN 57 17.306 -1.810 -3.692
383 2HB ASN 57 HB3 ASN 57 16.145 -2.962 -3.063
384 1HD2 ASN 57 HD21 ASN 57 16.556 -2.194 0.338
385 2HD2 ASN 57 HD22 ASN 57 15.939 -3.293 -0.850
386 H ILE 58 HN ILE 58 18.484 -5.840 -1.663
387 HA ILE 58 HA ILE 58 20.062 -4.469 0.365
388 HB ILE 58 HB ILE 58 17.338 -4.595 0.611
389 1HG1 ILE 58 HG12 ILE 58 19.343 -4.573 2.885
390 2HG1 ILE 58 HG13 ILE 58 19.001 -3.198 1.854
391 1HG2 ILE 58 HG21 ILE 58 18.421 -6.816 2.356
392 2HG2 ILE 58 HG22 ILE 58 16.735 -6.270 2.188
393 3HG2 ILE 58 HG23 ILE 58 17.543 -7.094 0.832
394 1HD1 ILE 58 HD11 ILE 58 16.538 -3.434 2.506
395 2HD1 ILE 58 HD12 ILE 58 17.059 -4.633 3.714
396 3HD1 ILE 58 HD13 ILE 58 17.630 -2.951 3.826
397 H CYS 59 HN CYS 59 20.616 -6.234 2.174
398 HA CYS 59 HA CYS 59 22.057 -8.082 0.521
399 1HB CYS 59 HB2 CYS 59 23.473 -8.425 2.386
400 2HB CYS 59 HB3 CYS 59 23.144 -6.707 2.280
401 H GLY 60 HN GLY 60 19.607 -8.992 0.174
402 1HA GLY 60 HA1 GLY 60 18.387 -10.337 2.351
403 2HA GLY 60 HA2 GLY 60 17.969 -10.463 0.653
Start of MODEL 3
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 -1.005 -0.266
3 1HB LYS 1 HB2 LYS 1 1.593 0.662 -2.049
4 2HB LYS 1 HB3 LYS 1 1.641 1.962 -0.876
5 1HG LYS 1 HG2 LYS 1 3.914 1.276 -0.158
6 2HG LYS 1 HG3 LYS 1 3.868 -0.097 -1.246
7 1HD LYS 1 HD2 LYS 1 3.434 2.700 -2.337
8 2HD LYS 1 HD3 LYS 1 5.061 2.141 -2.005
9 1HE LYS 1 HE2 LYS 1 3.168 0.428 -3.650
10 2HE LYS 1 HE3 LYS 1 4.036 1.751 -4.402
11 1HZ LYS 1 HZ1 LYS 1 6.123 0.741 -3.617
12 2HZ LYS 1 HZ2 LYS 1 5.313 -0.493 -2.930
13 H ASP 2 HN ASP 2 3.250 -1.285 1.355
14 HA ASP 2 HA ASP 2 3.011 0.590 3.576
15 1HB ASP 2 HB2 ASP 2 3.521 -2.421 3.662
16 2HB ASP 2 HB3 ASP 2 3.613 -1.371 5.062
17 HD2 ASP 2 HD2 ASP 2 2.166 -3.175 5.424
18 H GLY 3 HN GLY 3 5.041 1.260 4.491
19 1HA GLY 3 HA1 GLY 3 7.515 0.118 4.231
20 2HA GLY 3 HA2 GLY 3 7.285 0.992 2.729
21 H TYR 4 HN TYR 4 9.035 2.452 3.346
22 HA TYR 4 HA TYR 4 8.190 4.383 5.400
23 1HB TYR 4 HB2 TYR 4 10.931 3.697 4.164
24 2HB TYR 4 HB3 TYR 4 10.687 4.849 5.462
25 HD1 TYR 4 HD1 TYR 4 11.179 1.375 4.610
26 HD2 TYR 4 HD2 TYR 4 9.862 4.007 7.715
27 HE1 TYR 4 HE1 TYR 4 11.485 -0.480 6.322
28 HE2 TYR 4 HE2 TYR 4 10.173 2.144 9.417
29 HH TYR 4 HH TYR 4 11.239 -1.084 8.380
30 HA PRO 5 HA PRO 5 7.581 6.508 1.614
31 1HB PRO 5 HB2 PRO 5 5.839 8.408 2.524
32 2HB PRO 5 HB3 PRO 5 5.334 6.806 2.022
33 1HG PRO 5 HG2 PRO 5 5.589 7.897 4.758
34 2HG PRO 5 HG3 PRO 5 4.703 6.485 4.217
35 1HD PRO 5 HD2 PRO 5 7.229 6.509 5.575
36 2HD PRO 5 HD3 PRO 5 6.398 5.106 4.931
37 H VAL 6 HN VAL 6 8.531 8.150 0.469
38 HA VAL 6 HA VAL 6 9.291 10.443 2.106
39 HB VAL 6 HB VAL 6 11.435 10.494 0.684
40 1HG1 VAL 6 HG11 VAL 6 12.660 9.265 2.363
41 2HG1 VAL 6 HG12 VAL 6 11.296 10.096 3.148
42 3HG1 VAL 6 HG13 VAL 6 11.204 8.349 2.820
43 1HG2 VAL 6 HG21 VAL 6 12.307 8.389 -0.093
44 2HG2 VAL 6 HG22 VAL 6 10.893 7.511 0.538
45 3HG2 VAL 6 HG23 VAL 6 10.706 8.633 -0.831
46 H ASP 7 HN ASP 7 8.765 12.365 1.136
47 HA ASP 7 HA ASP 7 8.970 12.643 -1.643
48 1HB ASP 7 HB2 ASP 7 6.355 13.462 -1.573
49 2HB ASP 7 HB3 ASP 7 6.873 11.900 -2.175
50 HD2 ASP 7 HD2 ASP 7 4.754 10.418 0.072
51 H SER 8 HN SER 8 6.686 13.945 0.892
52 HA SER 8 HA SER 8 7.567 16.594 0.275
53 1HB SER 8 HB2 SER 8 5.787 17.295 1.839
54 2HB SER 8 HB3 SER 8 5.176 16.138 0.674
55 HG SER 8 HG SER 8 5.765 15.751 3.461
56 H LYS 9 HN LYS 9 8.279 14.053 2.582
57 HA LYS 9 HA LYS 9 9.046 15.956 4.644
58 1HB LYS 9 HB2 LYS 9 9.220 13.933 6.068
59 2HB LYS 9 HB3 LYS 9 7.628 14.161 5.372
60 1HG LYS 9 HG2 LYS 9 9.434 12.546 3.659
61 2HG LYS 9 HG3 LYS 9 9.135 11.820 5.226
62 1HD LYS 9 HD2 LYS 9 6.796 12.924 3.653
63 2HD LYS 9 HD3 LYS 9 7.475 11.376 3.189
64 1HE LYS 9 HE2 LYS 9 6.764 11.921 6.092
65 2HE LYS 9 HE3 LYS 9 5.519 11.442 4.956
66 1HZ LYS 9 HZ1 LYS 9 7.989 9.849 5.081
67 2HZ LYS 9 HZ2 LYS 9 6.862 9.629 6.236
68 H GLY 10 HN GLY 10 10.385 13.973 2.097
69 1HA GLY 10 HA1 GLY 10 12.506 14.030 1.287
70 2HA GLY 10 HA2 GLY 10 12.999 15.052 2.622
71 H CYS 11 HN CYS 11 12.963 13.870 4.892
72 HA CYS 11 HA CYS 11 14.248 11.279 4.439
73 1HB CYS 11 HB2 CYS 11 14.742 13.470 6.432
74 2HB CYS 11 HB3 CYS 11 15.200 11.820 6.805
75 H LYS 12 HN LYS 12 14.037 9.851 6.591
76 HA LYS 12 HA LYS 12 11.239 9.369 6.702
77 1HB LYS 12 HB2 LYS 12 13.687 7.935 7.191
78 2HB LYS 12 HB3 LYS 12 12.620 7.733 8.566
79 1HG LYS 12 HG2 LYS 12 12.044 5.985 7.016
80 2HG LYS 12 HG3 LYS 12 10.746 7.159 6.926
81 1HD LYS 12 HD2 LYS 12 11.140 6.911 4.658
82 2HD LYS 12 HD3 LYS 12 12.284 8.199 4.980
83 1HE LYS 12 HE2 LYS 12 14.135 6.607 5.166
84 2HE LYS 12 HE3 LYS 12 13.037 5.242 5.107
85 1HZ LYS 12 HZ1 LYS 12 12.399 5.997 2.833
86 2HZ LYS 12 HZ2 LYS 12 13.538 7.160 2.895
87 H LEU 13 HN LEU 13 10.010 9.070 8.765
88 HA LEU 13 HA LEU 13 10.647 11.241 10.586
89 1HB LEU 13 HB2 LEU 13 8.223 9.576 10.007
90 2HB LEU 13 HB3 LEU 13 8.349 10.442 11.526
91 HG LEU 13 HG LEU 13 7.063 11.668 9.818
92 1HD1 LEU 13 HD11 LEU 13 8.397 12.797 11.652
93 2HD1 LEU 13 HD12 LEU 13 9.622 13.161 10.413
94 3HD1 LEU 13 HD13 LEU 13 7.971 13.807 10.250
95 1HD2 LEU 13 HD21 LEU 13 8.069 12.584 7.845
96 2HD2 LEU 13 HD22 LEU 13 9.666 11.941 8.296
97 3HD2 LEU 13 HD23 LEU 13 8.351 10.827 7.854
98 H SER 14 HN SER 14 11.719 10.923 12.458
99 HA SER 14 HA SER 14 12.356 8.266 13.211
100 1HB SER 14 HB2 SER 14 13.611 9.380 15.066
101 2HB SER 14 HB3 SER 14 14.016 10.029 13.489
102 HG SER 14 HG SER 14 12.130 11.209 15.348
103 H CYS 15 HN CYS 15 10.523 7.130 13.931
104 HA CYS 15 HA CYS 15 8.566 8.381 15.540
105 1HB CYS 15 HB2 CYS 15 7.558 6.182 15.691
106 2HB CYS 15 HB3 CYS 15 7.996 6.568 14.039
107 H VAL 16 HN VAL 16 8.191 8.081 17.827
108 HA VAL 16 HA VAL 16 10.402 6.760 19.246
109 HB VAL 16 HB VAL 16 9.877 8.258 21.119
110 1HG1 VAL 16 HG11 VAL 16 11.650 8.846 19.516
111 2HG1 VAL 16 HG12 VAL 16 10.463 9.732 18.529
112 3HG1 VAL 16 HG13 VAL 16 10.852 10.295 20.172
113 1HG2 VAL 16 HG21 VAL 16 8.376 10.123 20.910
114 2HG2 VAL 16 HG22 VAL 16 8.059 9.746 19.200
115 3HG2 VAL 16 HG23 VAL 16 7.480 8.648 20.475
116 H ALA 17 HN ALA 17 7.294 6.342 18.142
117 HA ALA 17 HA ALA 17 6.588 4.372 20.020
118 1HB ALA 17 HB1 ALA 17 6.224 6.285 21.511
119 2HB ALA 17 HB2 ALA 17 5.190 7.065 20.290
120 3HB ALA 17 HB3 ALA 17 4.665 5.552 21.065
121 H ASN 18 HN ASN 18 4.383 3.471 19.502
122 HA ASN 18 HA ASN 18 4.316 3.280 16.716
123 1HB ASN 18 HB2 ASN 18 2.507 2.224 18.940
124 2HB ASN 18 HB3 ASN 18 2.185 1.868 17.255
125 1HD2 ASN 18 HD21 ASN 18 4.743 -0.369 19.325
126 2HD2 ASN 18 HD22 ASN 18 3.513 0.679 19.950
127 H ASN 19 HN ASN 19 2.261 4.832 19.246
128 HA ASN 19 HA ASN 19 0.174 5.540 17.558
129 1HB ASN 19 HB2 ASN 19 -0.331 7.252 19.382
130 2HB ASN 19 HB3 ASN 19 -0.133 5.615 19.975
131 1HD2 ASN 19 HD21 ASN 19 2.282 8.647 21.175
132 2HD2 ASN 19 HD22 ASN 19 0.963 8.832 20.067
133 H TYR 20 HN TYR 20 3.373 6.928 18.308
134 HA TYR 20 HA TYR 20 2.739 9.548 17.344
135 1HB TYR 20 HB2 TYR 20 4.436 8.955 19.139
136 2HB TYR 20 HB3 TYR 20 5.333 8.005 17.972
137 HD1 TYR 20 HD1 TYR 20 4.673 11.345 19.255
138 HD2 TYR 20 HD2 TYR 20 6.560 9.142 16.111
139 HE1 TYR 20 HE1 TYR 20 6.049 13.392 18.637
140 HE2 TYR 20 HE2 TYR 20 7.930 11.196 15.503
141 HH TYR 20 HH TYR 20 8.395 13.247 15.968
142 H CYS 21 HN CYS 21 4.027 6.522 15.988
143 HA CYS 21 HA CYS 21 4.760 7.720 13.520
144 1HB CYS 21 HB2 CYS 21 5.739 5.632 14.044
145 2HB CYS 21 HB3 CYS 21 4.188 4.889 14.382
146 H ASP 22 HN ASP 22 1.851 5.947 14.824
147 HA ASP 22 HA ASP 22 0.754 5.534 12.353
148 1HB ASP 22 HB2 ASP 22 0.101 4.383 14.488
149 2HB ASP 22 HB3 ASP 22 -0.681 5.854 15.032
150 HD2 ASP 22 HD2 ASP 22 -3.573 5.203 13.270
151 H ASN 23 HN ASN 23 0.161 8.116 14.838
152 HA ASN 23 HA ASN 23 -2.031 9.217 13.567
153 1HB ASN 23 HB2 ASN 23 -1.639 11.168 15.067
154 2HB ASN 23 HB3 ASN 23 -1.429 9.666 15.946
155 1HD2 ASN 23 HD21 ASN 23 1.364 12.184 16.536
156 2HD2 ASN 23 HD22 ASN 23 -0.365 12.290 16.519
157 H GLN 24 HN GLN 24 1.483 9.558 13.147
158 HA GLN 24 HA GLN 24 1.245 12.037 11.746
159 1HB GLN 24 HB2 GLN 24 3.203 11.402 13.234
160 2HB GLN 24 HB3 GLN 24 3.679 10.223 12.028
161 1HG GLN 24 HG2 GLN 24 4.049 11.946 10.356
162 2HG GLN 24 HG3 GLN 24 3.279 13.168 11.349
163 1HE2 GLN 24 HE21 GLN 24 6.404 14.211 12.427
164 2HE2 GLN 24 HE22 GLN 24 4.947 14.544 11.552
165 H CYS 25 HN CYS 25 1.196 8.607 11.030
166 HA CYS 25 HA CYS 25 1.938 8.924 8.291
167 1HB CYS 25 HB2 CYS 25 0.713 6.620 9.816
168 2HB CYS 25 HB3 CYS 25 1.121 6.554 8.113
169 H LYS 26 HN LYS 26 -1.087 8.627 10.266
170 HA LYS 26 HA LYS 26 -2.607 8.074 7.891
171 1HB LYS 26 HB2 LYS 26 -4.429 7.642 9.416
172 2HB LYS 26 HB3 LYS 26 -2.980 6.846 9.996
173 1HG LYS 26 HG2 LYS 26 -3.003 8.036 11.932
174 2HG LYS 26 HG3 LYS 26 -3.121 9.557 11.072
175 1HD LYS 26 HD2 LYS 26 -5.529 7.730 11.461
176 2HD LYS 26 HD3 LYS 26 -5.085 8.946 12.642
177 1HE LYS 26 HE2 LYS 26 -5.169 10.679 10.758
178 2HE LYS 26 HE3 LYS 26 -5.825 9.430 9.719
179 1HZ LYS 26 HZ1 LYS 26 -7.064 10.402 12.238
180 2HZ LYS 26 HZ2 LYS 26 -7.624 10.665 10.731
181 H MET 27 HN MET 27 -1.477 10.869 9.479
182 HA MET 27 HA MET 27 -3.712 12.461 9.536
183 1HB MET 27 HB2 MET 27 -2.105 14.304 9.700
184 2HB MET 27 HB3 MET 27 -1.396 12.925 10.516
185 1HG MET 27 HG2 MET 27 -0.177 12.370 8.330
186 2HG MET 27 HG3 MET 27 -0.760 13.894 7.690
187 1HE MET 27 HE1 MET 27 2.943 14.781 8.426
188 2HE MET 27 HE2 MET 27 2.255 13.288 7.743
189 3HE MET 27 HE3 MET 27 1.604 14.872 7.256
190 H LYS 28 HN LYS 28 -1.783 11.338 6.817
191 HA LYS 28 HA LYS 28 -3.521 12.657 4.970
192 1HB LYS 28 HB2 LYS 28 -2.006 14.514 5.512
193 2HB LYS 28 HB3 LYS 28 -0.618 13.526 5.105
194 1HG LYS 28 HG2 LYS 28 -1.565 13.245 2.768
195 2HG LYS 28 HG3 LYS 28 -2.857 14.348 3.197
196 1HD LYS 28 HD2 LYS 28 0.081 15.113 3.469
197 2HD LYS 28 HD3 LYS 28 -0.812 15.364 1.982
198 1HE LYS 28 HE2 LYS 28 -2.529 16.693 3.319
199 2HE LYS 28 HE3 LYS 28 -1.482 16.550 4.716
200 1HZ LYS 28 HZ1 LYS 28 -1.081 18.622 3.489
201 2HZ LYS 28 HZ2 LYS 28 0.262 17.701 3.470
202 H LYS 29 HN LYS 29 -0.306 10.996 5.414
203 HA LYS 29 HA LYS 29 -0.229 10.370 2.665
204 1HB LYS 29 HB2 LYS 29 1.450 9.431 5.008
205 2HB LYS 29 HB3 LYS 29 1.805 9.063 3.333
206 1HG LYS 29 HG2 LYS 29 1.393 11.935 4.247
207 2HG LYS 29 HG3 LYS 29 2.952 11.152 4.417
208 1HD LYS 29 HD2 LYS 29 3.096 10.753 2.006
209 2HD LYS 29 HD3 LYS 29 1.444 11.287 1.766
210 1HE LYS 29 HE2 LYS 29 2.921 13.117 1.134
211 2HE LYS 29 HE3 LYS 29 2.097 13.579 2.609
212 1HZ LYS 29 HZ1 LYS 29 4.854 12.478 2.470
213 2HZ LYS 29 HZ2 LYS 29 4.467 14.028 2.789
214 H ALA 30 HN ALA 30 -1.188 8.540 5.631
215 HA ALA 30 HA ALA 30 -1.435 6.167 3.913
216 1HB ALA 30 HB1 ALA 30 0.611 6.532 5.626
217 2HB ALA 30 HB2 ALA 30 -0.590 5.880 6.767
218 3HB ALA 30 HB3 ALA 30 -0.118 4.935 5.334
219 H SER 31 HN SER 31 -2.618 4.357 5.455
220 HA SER 31 HA SER 31 -4.946 5.685 6.533
221 1HB SER 31 HB2 SER 31 -5.986 3.498 6.543
222 2HB SER 31 HB3 SER 31 -5.176 3.699 5.002
223 HG SER 31 HG SER 31 -4.788 1.594 6.002
224 H GLY 32 HN GLY 32 -2.058 3.814 7.469
225 1HA GLY 32 HA1 GLY 32 -2.436 4.622 10.228
226 2HA GLY 32 HA2 GLY 32 -2.515 2.894 9.945
227 H GLY 33 HN GLY 33 -0.526 3.052 11.445
228 1HA GLY 33 HA1 GLY 33 1.726 2.423 9.866
229 2HA GLY 33 HA2 GLY 33 1.933 4.021 10.554
230 H HIS 34 HN HIS 34 3.657 1.917 11.285
231 HA HIS 34 HA HIS 34 3.104 2.041 14.124
232 1HB HIS 34 HB2 HIS 34 2.915 -0.393 12.596
233 2HB HIS 34 HB3 HIS 34 4.278 -0.507 13.692
234 HD1 HIS 34 HD1 HIS 34 0.750 0.961 14.147
235 HD2 HIS 34 HD2 HIS 34 3.392 -1.761 15.937
236 HE1 HIS 34 HE1 HIS 34 -0.425 0.096 16.241
237 H CYS 35 HN CYS 35 5.187 1.453 15.393
238 HA CYS 35 HA CYS 35 7.203 3.020 14.011
239 1HB CYS 35 HB2 CYS 35 6.407 3.901 16.116
240 2HB CYS 35 HB3 CYS 35 6.779 2.399 16.939
241 H TYR 36 HN TYR 36 8.539 1.618 12.832
242 HA TYR 36 HA TYR 36 9.618 -0.717 14.162
243 1HB TYR 36 HB2 TYR 36 9.046 -0.181 11.595
244 2HB TYR 36 HB3 TYR 36 10.568 0.688 11.609
245 HD1 TYR 36 HD1 TYR 36 9.193 -2.681 12.539
246 HD2 TYR 36 HD2 TYR 36 12.496 -0.449 10.984
247 HE1 TYR 36 HE1 TYR 36 10.442 -4.844 12.066
248 HE2 TYR 36 HE2 TYR 36 13.733 -2.620 10.517
249 HH TYR 36 HH TYR 36 12.239 -5.751 11.301
250 H ALA 37 HN ALA 37 12.081 -0.984 14.207
251 HA ALA 37 HA ALA 37 12.902 0.822 16.133
252 1HB ALA 37 HB1 ALA 37 13.691 -1.495 15.974
253 2HB ALA 37 HB2 ALA 37 14.516 -1.129 14.440
254 3HB ALA 37 HB3 ALA 37 15.073 -0.375 15.953
255 H MET 38 HN MET 38 13.302 0.806 12.600
256 HA MET 38 HA MET 38 15.439 2.669 12.661
257 1HB MET 38 HB2 MET 38 13.580 1.634 10.452
258 2HB MET 38 HB3 MET 38 14.915 2.721 10.128
259 1HG MET 38 HG2 MET 38 15.311 0.067 11.579
260 2HG MET 38 HG3 MET 38 15.376 0.190 9.832
261 1HE MET 38 HE1 MET 38 17.812 -0.839 10.052
262 2HE MET 38 HE2 MET 38 19.140 -0.074 10.956
263 3HE MET 38 HE3 MET 38 17.762 -0.784 11.831
264 H SER 39 HN SER 39 11.884 2.817 11.919
265 HA SER 39 HA SER 39 11.797 5.600 12.248
266 1HB SER 39 HB2 SER 39 11.865 4.558 9.382
267 2HB SER 39 HB3 SER 39 11.370 6.178 9.829
268 HG SER 39 HG SER 39 13.634 6.120 10.999
269 H CYS 40 HN CYS 40 9.574 6.441 11.204
270 HA CYS 40 HA CYS 40 7.527 4.751 12.058
271 1HB CYS 40 HB2 CYS 40 7.232 7.128 12.053
272 2HB CYS 40 HB3 CYS 40 7.512 7.225 10.326
273 H TYR 41 HN TYR 41 7.108 2.792 11.063
274 HA TYR 41 HA TYR 41 7.280 2.610 8.173
275 1HB TYR 41 HB2 TYR 41 8.032 0.788 9.770
276 2HB TYR 41 HB3 TYR 41 6.425 0.736 10.467
277 HD1 TYR 41 HD1 TYR 41 8.321 0.105 7.320
278 HD2 TYR 41 HD2 TYR 41 4.737 -0.640 9.534
279 HE1 TYR 41 HE1 TYR 41 7.641 -1.674 5.636
280 HE2 TYR 41 HE2 TYR 41 4.069 -2.416 7.842
281 HH TYR 41 HH TYR 41 6.150 -3.112 5.044
282 H CYS 42 HN CYS 42 5.609 3.567 7.068
283 HA CYS 42 HA CYS 42 3.088 3.803 8.450
284 1HB CYS 42 HB2 CYS 42 4.120 4.999 5.873
285 2HB CYS 42 HB3 CYS 42 2.501 5.263 6.490
286 H GLU 43 HN GLU 43 1.017 3.262 7.246
287 HA GLU 43 HA GLU 43 1.439 0.982 5.503
288 1HB GLU 43 HB2 GLU 43 -0.029 0.928 8.171
289 2HB GLU 43 HB3 GLU 43 -0.232 -0.314 6.951
290 1HG GLU 43 HG2 GLU 43 2.294 -0.661 6.986
291 2HG GLU 43 HG3 GLU 43 2.380 0.456 8.333
292 HE2 GLU 43 HE2 GLU 43 1.127 -0.034 10.064
293 H GLY 44 HN GLY 44 -0.235 0.653 4.004
294 1HA GLY 44 HA1 GLY 44 -2.257 0.958 3.002
295 2HA GLY 44 HA2 GLY 44 -2.796 1.935 4.354
296 H LEU 45 HN LEU 45 0.231 2.444 2.462
297 HA LEU 45 HA LEU 45 -0.601 5.099 1.783
298 1HB LEU 45 HB2 LEU 45 1.812 3.502 0.914
299 2HB LEU 45 HB3 LEU 45 1.569 5.220 0.668
300 HG LEU 45 HG LEU 45 1.472 4.163 3.468
301 1HD1 LEU 45 HD11 LEU 45 3.442 3.069 2.476
302 2HD1 LEU 45 HD12 LEU 45 4.062 4.660 1.974
303 3HD1 LEU 45 HD13 LEU 45 3.886 4.280 3.704
304 1HD2 LEU 45 HD21 LEU 45 2.587 6.724 2.292
305 2HD2 LEU 45 HD22 LEU 45 0.952 6.525 2.968
306 3HD2 LEU 45 HD23 LEU 45 2.377 6.340 4.018
307 HA PRO 46 HA PRO 46 -1.844 4.107 -2.369
308 1HB PRO 46 HB2 PRO 46 -1.571 6.583 -3.494
309 2HB PRO 46 HB3 PRO 46 -3.030 6.056 -2.680
310 1HG PRO 46 HG2 PRO 46 -0.946 7.922 -1.725
311 2HG PRO 46 HG3 PRO 46 -2.583 7.712 -1.137
312 1HD PRO 46 HD2 PRO 46 -0.179 6.747 0.095
313 2HD PRO 46 HD3 PRO 46 -1.823 6.438 0.620
314 H GLU 47 HN GLU 47 -0.940 4.025 -4.595
315 HA GLU 47 HA GLU 47 1.667 3.059 -3.990
316 1HB GLU 47 HB2 GLU 47 -0.064 2.908 -6.493
317 2HB GLU 47 HB3 GLU 47 1.512 2.153 -6.372
318 1HG GLU 47 HG2 GLU 47 0.732 0.831 -4.397
319 2HG GLU 47 HG3 GLU 47 -0.842 1.593 -4.506
320 HE2 GLU 47 HE2 GLU 47 -1.853 -0.404 -7.170
321 H ASN 48 HN ASN 48 0.396 6.010 -5.124
322 HA ASN 48 HA ASN 48 2.316 6.573 -7.096
323 1HB ASN 48 HB2 ASN 48 1.441 8.894 -6.935
324 2HB ASN 48 HB3 ASN 48 0.114 7.749 -6.951
325 1HD2 ASN 48 HD21 ASN 48 -0.133 10.419 -4.224
326 2HD2 ASN 48 HD22 ASN 48 0.278 10.472 -5.906
327 H ALA 49 HN ALA 49 2.206 6.609 -3.587
328 HA ALA 49 HA ALA 49 4.272 8.583 -3.268
329 1HB ALA 49 HB1 ALA 49 2.454 8.299 -1.620
330 2HB ALA 49 HB2 ALA 49 2.992 6.630 -1.312
331 3HB ALA 49 HB3 ALA 49 4.045 7.999 -0.881
332 H LYS 50 HN LYS 50 6.448 8.229 -3.232
333 HA LYS 50 HA LYS 50 7.368 5.567 -3.780
334 1HB LYS 50 HB2 LYS 50 8.278 7.611 -4.885
335 2HB LYS 50 HB3 LYS 50 8.938 8.125 -3.346
336 1HG LYS 50 HG2 LYS 50 9.594 5.324 -4.200
337 2HG LYS 50 HG3 LYS 50 10.331 6.610 -5.135
338 1HD LYS 50 HD2 LYS 50 11.309 7.600 -3.101
339 2HD LYS 50 HD3 LYS 50 10.460 6.450 -2.087
340 1HE LYS 50 HE2 LYS 50 11.703 4.576 -3.291
341 2HE LYS 50 HE3 LYS 50 12.636 5.799 -4.131
342 1HZ LYS 50 HZ1 LYS 50 13.367 6.630 -1.932
343 2HZ LYS 50 HZ2 LYS 50 12.546 5.441 -1.183
344 H VAL 51 HN VAL 51 8.285 4.120 -2.379
345 HA VAL 51 HA VAL 51 8.746 5.091 0.353
346 HB VAL 51 HB VAL 51 7.697 3.187 1.264
347 1HG1 VAL 51 HG11 VAL 51 6.177 5.001 0.524
348 2HG1 VAL 51 HG12 VAL 51 5.924 4.137 -1.012
349 3HG1 VAL 51 HG13 VAL 51 5.391 3.404 0.521
350 1HG2 VAL 51 HG21 VAL 51 7.526 2.124 -1.572
351 2HG2 VAL 51 HG22 VAL 51 8.444 1.445 -0.207
352 3HG2 VAL 51 HG23 VAL 51 6.665 1.409 -0.188
353 H SER 52 HN SER 52 10.569 4.154 1.431
354 HA SER 52 HA SER 52 12.134 2.327 -0.155
355 1HB SER 52 HB2 SER 52 13.420 3.959 1.054
356 2HB SER 52 HB3 SER 52 12.542 3.668 2.542
357 HG SER 52 HG SER 52 14.543 2.047 1.276
358 H ASP 53 HN ASP 53 12.556 0.086 0.524
359 HA ASP 53 HA ASP 53 11.320 -0.580 3.075
360 1HB ASP 53 HB2 ASP 53 11.041 -2.913 2.258
361 2HB ASP 53 HB3 ASP 53 10.117 -1.777 1.295
362 HD2 ASP 53 HD2 ASP 53 12.844 -3.708 1.404
363 H SER 54 HN SER 54 13.976 0.525 2.636
364 HA SER 54 HA SER 54 15.658 -1.855 2.747
365 1HB SER 54 HB2 SER 54 17.412 -0.380 1.576
366 2HB SER 54 HB3 SER 54 16.077 -0.947 0.592
367 HG SER 54 HG SER 54 16.396 1.289 0.205
368 H ALA 55 HN ALA 55 14.612 -0.647 5.093
369 HA ALA 55 HA ALA 55 15.423 -0.268 7.115
370 1HB ALA 55 HB1 ALA 55 17.733 -0.928 7.564
371 2HB ALA 55 HB2 ALA 55 17.006 -2.060 6.398
372 3HB ALA 55 HB3 ALA 55 18.133 -0.804 5.834
373 H THR 56 HN THR 56 14.937 1.993 5.375
374 HA THR 56 HA THR 56 15.176 4.204 5.480
375 HB THR 56 HB THR 56 16.423 3.548 8.202
376 HG1 THR 56 HG1 THR 56 14.319 2.532 7.722
377 1HG2 THR 56 HG21 THR 56 15.596 5.694 8.908
378 2HG2 THR 56 HG22 THR 56 16.407 6.018 7.358
379 3HG2 THR 56 HG23 THR 56 14.632 5.893 7.425
380 H ASN 57 HN ASN 57 16.724 3.884 3.640
381 HA ASN 57 HA ASN 57 19.483 4.019 4.401
382 1HB ASN 57 HB2 ASN 57 19.923 3.767 1.988
383 2HB ASN 57 HB3 ASN 57 18.700 2.607 2.465
384 1HD2 ASN 57 HD21 ASN 57 16.026 4.015 0.680
385 2HD2 ASN 57 HD22 ASN 57 16.604 2.808 1.779
386 H ILE 58 HN ILE 58 16.847 6.147 3.756
387 HA ILE 58 HA ILE 58 18.574 8.277 2.764
388 HB ILE 58 HB ILE 58 15.576 8.157 3.115
389 1HG1 ILE 58 HG12 ILE 58 17.322 7.739 0.673
390 2HG1 ILE 58 HG13 ILE 58 16.285 6.556 1.446
391 1HG2 ILE 58 HG21 ILE 58 16.565 10.440 3.246
392 2HG2 ILE 58 HG22 ILE 58 17.244 10.195 1.619
393 3HG2 ILE 58 HG23 ILE 58 15.480 10.199 1.855
394 1HD1 ILE 58 HD11 ILE 58 14.333 8.213 0.998
395 2HD1 ILE 58 HD12 ILE 58 15.465 9.042 -0.098
396 3HD1 ILE 58 HD13 ILE 58 15.010 7.349 -0.403
397 H CYS 59 HN CYS 59 18.946 10.233 3.970
398 HA CYS 59 HA CYS 59 20.022 10.833 5.793
399 1HB CYS 59 HB2 CYS 59 17.231 10.401 6.783
400 2HB CYS 59 HB3 CYS 59 18.490 10.781 7.941
401 H GLY 60 HN GLY 60 17.900 8.389 7.427
402 1HA GLY 60 HA1 GLY 60 18.411 6.624 8.721
403 2HA GLY 60 HA2 GLY 60 19.806 6.349 7.697
Start of MODEL 4
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 -0.993 0.307
3 1HB LYS 1 HB2 LYS 1 3.034 -0.070 -1.466
4 2HB LYS 1 HB3 LYS 1 1.440 -0.385 -2.122
5 1HG LYS 1 HG2 LYS 1 0.877 2.080 -1.527
6 2HG LYS 1 HG3 LYS 1 2.596 2.300 -1.265
7 1HD LYS 1 HD2 LYS 1 2.933 1.313 -3.640
8 2HD LYS 1 HD3 LYS 1 1.204 1.497 -3.854
9 1HE LYS 1 HE2 LYS 1 3.281 3.672 -3.409
10 2HE LYS 1 HE3 LYS 1 2.156 3.507 -4.742
11 1HZ LYS 1 HZ1 LYS 1 1.555 5.185 -2.946
12 2HZ LYS 1 HZ2 LYS 1 0.364 4.155 -3.359
13 H ASP 2 HN ASP 2 3.856 0.221 0.954
14 HA ASP 2 HA ASP 2 3.067 2.440 2.661
15 1HB ASP 2 HB2 ASP 2 4.818 0.089 3.515
16 2HB ASP 2 HB3 ASP 2 4.353 1.443 4.525
17 HD2 ASP 2 HD2 ASP 2 3.998 -0.960 5.248
18 H GLY 3 HN GLY 3 4.940 3.836 3.266
19 1HA GLY 3 HA1 GLY 3 7.567 3.476 2.970
20 2HA GLY 3 HA2 GLY 3 7.088 3.758 1.309
21 H TYR 4 HN TYR 4 8.313 5.762 1.282
22 HA TYR 4 HA TYR 4 7.097 7.895 2.894
23 1HB TYR 4 HB2 TYR 4 9.661 7.880 1.201
24 2HB TYR 4 HB3 TYR 4 9.267 9.005 2.485
25 HD1 TYR 4 HD1 TYR 4 9.076 8.042 4.890
26 HD2 TYR 4 HD2 TYR 4 10.951 5.968 1.652
27 HE1 TYR 4 HE1 TYR 4 10.340 6.584 6.546
28 HE2 TYR 4 HE2 TYR 4 12.209 4.517 3.318
29 HH TYR 4 HH TYR 4 12.565 4.060 5.393
30 HA PRO 5 HA PRO 5 5.409 9.143 -0.983
31 1HB PRO 5 HB2 PRO 5 3.560 10.877 0.038
32 2HB PRO 5 HB3 PRO 5 3.243 9.170 -0.201
33 1HG PRO 5 HG2 PRO 5 3.771 10.622 2.320
34 2HG PRO 5 HG3 PRO 5 3.046 9.042 2.094
35 1HD PRO 5 HD2 PRO 5 5.726 9.594 2.955
36 2HD PRO 5 HD3 PRO 5 5.037 8.019 2.618
37 H VAL 6 HN VAL 6 5.981 10.682 -2.440
38 HA VAL 6 HA VAL 6 6.686 13.252 -1.233
39 HB VAL 6 HB VAL 6 8.621 13.444 -2.671
40 1HG1 VAL 6 HG11 VAL 6 8.800 12.397 -0.387
41 2HG1 VAL 6 HG12 VAL 6 8.791 10.806 -1.185
42 3HG1 VAL 6 HG13 VAL 6 10.105 11.959 -1.515
43 1HG2 VAL 6 HG21 VAL 6 9.462 11.403 -3.894
44 2HG2 VAL 6 HG22 VAL 6 7.867 10.664 -3.616
45 3HG2 VAL 6 HG23 VAL 6 8.003 12.150 -4.586
46 H ASP 7 HN ASP 7 5.707 14.948 -2.246
47 HA ASP 7 HA ASP 7 5.254 14.990 -4.983
48 1HB ASP 7 HB2 ASP 7 2.587 15.144 -4.493
49 2HB ASP 7 HB3 ASP 7 3.374 13.670 -5.020
50 HD2 ASP 7 HD2 ASP 7 1.760 12.252 -2.308
51 H SER 8 HN SER 8 3.246 15.921 -2.072
52 HA SER 8 HA SER 8 3.041 18.555 -3.141
53 1HB SER 8 HB2 SER 8 1.660 18.856 -0.936
54 2HB SER 8 HB3 SER 8 1.019 17.830 -2.204
55 HG SER 8 HG SER 8 2.339 17.028 0.236
56 H LYS 9 HN LYS 9 4.773 16.840 -0.541
57 HA LYS 9 HA LYS 9 5.644 19.248 0.738
58 1HB LYS 9 HB2 LYS 9 6.886 17.793 2.182
59 2HB LYS 9 HB3 LYS 9 5.297 17.099 1.936
60 1HG LYS 9 HG2 LYS 9 6.635 15.904 -0.130
61 2HG LYS 9 HG3 LYS 9 7.966 16.120 0.989
62 1HD LYS 9 HD2 LYS 9 7.097 14.003 1.593
63 2HD LYS 9 HD3 LYS 9 6.395 15.075 2.789
64 1HE LYS 9 HE2 LYS 9 4.283 15.190 1.519
65 2HE LYS 9 HE3 LYS 9 4.978 14.260 0.207
66 1HZ LYS 9 HZ1 LYS 9 5.253 12.392 1.775
67 2HZ LYS 9 HZ2 LYS 9 4.571 13.257 2.975
68 H GLY 10 HN GLY 10 6.573 17.343 -2.039
69 1HA GLY 10 HA1 GLY 10 8.174 17.963 -3.591
70 2HA GLY 10 HA2 GLY 10 8.943 19.007 -2.413
71 H CYS 11 HN CYS 11 9.945 17.811 -0.421
72 HA CYS 11 HA CYS 11 11.134 15.313 -1.352
73 1HB CYS 11 HB2 CYS 11 12.627 17.811 -0.551
74 2HB CYS 11 HB3 CYS 11 13.362 16.220 -0.521
75 H LYS 12 HN LYS 12 9.705 14.349 0.308
76 HA LYS 12 HA LYS 12 9.742 13.189 2.191
77 1HB LYS 12 HB2 LYS 12 12.440 14.210 2.033
78 2HB LYS 12 HB3 LYS 12 11.927 14.153 3.707
79 1HG LYS 12 HG2 LYS 12 12.833 11.984 3.258
80 2HG LYS 12 HG3 LYS 12 11.095 11.761 3.259
81 1HD LYS 12 HD2 LYS 12 11.085 11.957 0.752
82 2HD LYS 12 HD3 LYS 12 12.828 12.134 0.769
83 1HE LYS 12 HE2 LYS 12 13.098 9.888 1.751
84 2HE LYS 12 HE3 LYS 12 11.363 9.713 1.922
85 1HZ LYS 12 HZ1 LYS 12 11.138 9.749 -0.475
86 2HZ LYS 12 HZ2 LYS 12 12.717 10.079 -0.697
87 H LEU 13 HN LEU 13 9.168 13.406 4.513
88 HA LEU 13 HA LEU 13 7.824 15.980 4.795
89 1HB LEU 13 HB2 LEU 13 6.623 13.732 4.757
90 2HB LEU 13 HB3 LEU 13 7.309 13.449 6.345
91 HG LEU 13 HG LEU 13 6.214 15.689 7.019
92 1HD1 LEU 13 HD11 LEU 13 4.206 16.297 5.732
93 2HD1 LEU 13 HD12 LEU 13 5.701 16.513 4.791
94 3HD1 LEU 13 HD13 LEU 13 4.653 15.107 4.486
95 1HD2 LEU 13 HD21 LEU 13 4.628 13.181 6.425
96 2HD2 LEU 13 HD22 LEU 13 5.434 13.640 7.944
97 3HD2 LEU 13 HD23 LEU 13 4.005 14.543 7.388
98 H SER 14 HN SER 14 10.344 13.933 6.181
99 HA SER 14 HA SER 14 11.608 14.094 7.939
100 1HB SER 14 HB2 SER 14 11.012 17.083 7.794
101 2HB SER 14 HB3 SER 14 12.357 16.356 8.650
102 HG SER 14 HG SER 14 11.884 16.231 5.793
103 H CYS 15 HN CYS 15 9.909 12.905 9.174
104 HA CYS 15 HA CYS 15 7.905 14.265 10.561
105 1HB CYS 15 HB2 CYS 15 7.641 12.168 11.821
106 2HB CYS 15 HB3 CYS 15 7.670 11.938 10.084
107 H VAL 16 HN VAL 16 7.803 14.904 12.805
108 HA VAL 16 HA VAL 16 10.433 15.237 14.040
109 HB VAL 16 HB VAL 16 7.762 16.515 14.659
110 1HG1 VAL 16 HG11 VAL 16 10.550 17.008 15.747
111 2HG1 VAL 16 HG12 VAL 16 9.190 18.137 15.956
112 3HG1 VAL 16 HG13 VAL 16 9.100 16.499 16.646
113 1HG2 VAL 16 HG21 VAL 16 10.159 17.561 13.118
114 2HG2 VAL 16 HG22 VAL 16 8.530 17.233 12.480
115 3HG2 VAL 16 HG23 VAL 16 8.779 18.554 13.648
116 H ALA 17 HN ALA 17 7.568 13.283 14.110
117 HA ALA 17 HA ALA 17 8.218 11.997 16.538
118 1HB ALA 17 HB1 ALA 17 6.270 12.836 17.855
119 2HB ALA 17 HB2 ALA 17 7.485 14.099 17.545
120 3HB ALA 17 HB3 ALA 17 5.980 14.061 16.597
121 H ASN 18 HN ASN 18 6.311 10.488 17.183
122 HA ASN 18 HA ASN 18 5.795 9.084 14.838
123 1HB ASN 18 HB2 ASN 18 4.652 8.775 17.664
124 2HB ASN 18 HB3 ASN 18 4.421 7.591 16.393
125 1HD2 ASN 18 HD21 ASN 18 7.245 6.413 18.423
126 2HD2 ASN 18 HD22 ASN 18 5.543 6.693 18.586
127 H ASN 19 HN ASN 19 3.765 11.037 17.122
128 HA ASN 19 HA ASN 19 1.344 10.431 15.892
129 1HB ASN 19 HB2 ASN 19 0.513 12.463 17.172
130 2HB ASN 19 HB3 ASN 19 1.395 11.325 18.170
131 1HD2 ASN 19 HD21 ASN 19 2.459 15.004 18.527
132 2HD2 ASN 19 HD22 ASN 19 0.910 14.242 18.382
133 H TYR 20 HN TYR 20 3.830 13.002 15.491
134 HA TYR 20 HA TYR 20 2.355 14.750 13.895
135 1HB TYR 20 HB2 TYR 20 4.572 15.175 15.028
136 2HB TYR 20 HB3 TYR 20 5.329 13.951 14.029
137 HD1 TYR 20 HD1 TYR 20 5.647 14.365 11.574
138 HD2 TYR 20 HD2 TYR 20 4.242 17.413 14.227
139 HE1 TYR 20 HE1 TYR 20 6.232 16.143 9.853
140 HE2 TYR 20 HE2 TYR 20 4.831 19.180 12.497
141 HH TYR 20 HH TYR 20 6.268 18.244 9.381
142 H CYS 21 HN CYS 21 4.331 11.843 13.092
143 HA CYS 21 HA CYS 21 4.060 12.117 10.314
144 1HB CYS 21 HB2 CYS 21 5.761 10.698 11.099
145 2HB CYS 21 HB3 CYS 21 4.670 9.801 12.136
146 H ASP 22 HN ASP 22 2.256 10.131 12.802
147 HA ASP 22 HA ASP 22 0.945 8.666 10.909
148 1HB ASP 22 HB2 ASP 22 1.154 8.164 13.383
149 2HB ASP 22 HB3 ASP 22 -0.058 9.389 13.703
150 HD2 ASP 22 HD2 ASP 22 -1.347 7.969 14.582
151 H ASN 23 HN ASN 23 -0.041 11.649 12.725
152 HA ASN 23 HA ASN 23 -2.699 11.543 11.932
153 1HB ASN 23 HB2 ASN 23 -2.909 13.648 13.030
154 2HB ASN 23 HB3 ASN 23 -1.551 12.907 13.854
155 1HD2 ASN 23 HD21 ASN 23 -1.157 16.293 11.593
156 2HD2 ASN 23 HD22 ASN 23 -2.624 15.379 11.689
157 H GLN 24 HN GLN 24 0.285 12.742 10.446
158 HA GLN 24 HA GLN 24 -1.121 14.544 8.713
159 1HB GLN 24 HB2 GLN 24 1.141 15.059 9.729
160 2HB GLN 24 HB3 GLN 24 1.835 13.795 8.732
161 1HG GLN 24 HG2 GLN 24 1.394 14.968 6.706
162 2HG GLN 24 HG3 GLN 24 0.185 15.996 7.451
163 1HE2 GLN 24 HE21 GLN 24 2.815 18.369 7.201
164 2HE2 GLN 24 HE22 GLN 24 1.470 17.661 6.370
165 H CYS 25 HN CYS 25 0.254 11.276 8.688
166 HA CYS 25 HA CYS 25 0.116 10.961 5.877
167 1HB CYS 25 HB2 CYS 25 0.169 8.938 8.125
168 2HB CYS 25 HB3 CYS 25 0.240 8.524 6.424
169 H LYS 26 HN LYS 26 -2.042 10.254 8.711
170 HA LYS 26 HA LYS 26 -3.814 8.753 7.025
171 1HB LYS 26 HB2 LYS 26 -4.806 8.019 8.994
172 2HB LYS 26 HB3 LYS 26 -3.132 8.250 9.458
173 1HG LYS 26 HG2 LYS 26 -3.991 10.723 10.062
174 2HG LYS 26 HG3 LYS 26 -5.546 9.921 10.163
175 1HD LYS 26 HD2 LYS 26 -3.025 9.163 11.714
176 2HD LYS 26 HD3 LYS 26 -4.451 9.937 12.376
177 1HE LYS 26 HE2 LYS 26 -5.814 7.912 11.699
178 2HE LYS 26 HE3 LYS 26 -4.340 7.137 11.155
179 1HZ LYS 26 HZ1 LYS 26 -4.821 6.474 13.419
180 2HZ LYS 26 HZ2 LYS 26 -3.472 7.386 13.452
181 H MET 27 HN MET 27 -3.348 12.061 7.754
182 HA MET 27 HA MET 27 -5.881 13.059 7.737
183 1HB MET 27 HB2 MET 27 -3.605 14.281 7.852
184 2HB MET 27 HB3 MET 27 -3.515 14.134 6.108
185 1HG MET 27 HG2 MET 27 -5.939 15.246 6.178
186 2HG MET 27 HG3 MET 27 -5.440 15.778 7.772
187 1HE MET 27 HE1 MET 27 -2.219 17.821 7.060
188 2HE MET 27 HE2 MET 27 -3.241 17.000 8.264
189 3HE MET 27 HE3 MET 27 -2.160 16.049 7.218
190 H LYS 28 HN LYS 28 -4.052 11.524 5.057
191 HA LYS 28 HA LYS 28 -6.094 11.970 3.142
192 1HB LYS 28 HB2 LYS 28 -5.380 14.301 3.405
193 2HB LYS 28 HB3 LYS 28 -3.718 13.854 3.077
194 1HG LYS 28 HG2 LYS 28 -5.651 12.910 1.021
195 2HG LYS 28 HG3 LYS 28 -5.556 14.654 1.160
196 1HD LYS 28 HD2 LYS 28 -3.057 14.524 0.924
197 2HD LYS 28 HD3 LYS 28 -3.174 12.784 0.750
198 1HE LYS 28 HE2 LYS 28 -3.038 13.725 -1.483
199 2HE LYS 28 HE3 LYS 28 -4.674 13.134 -1.266
200 1HZ LYS 28 HZ1 LYS 28 -3.824 15.966 -0.971
201 2HZ LYS 28 HZ2 LYS 28 -4.708 15.362 -2.197
202 H LYS 29 HN LYS 29 -2.537 11.580 3.749
203 HA LYS 29 HA LYS 29 -2.063 10.702 1.125
204 1HB LYS 29 HB2 LYS 29 -0.374 10.448 3.632
205 2HB LYS 29 HB3 LYS 29 0.193 10.151 2.000
206 1HG LYS 29 HG2 LYS 29 -1.127 12.793 2.720
207 2HG LYS 29 HG3 LYS 29 0.571 12.525 3.057
208 1HD LYS 29 HD2 LYS 29 0.909 11.915 0.619
209 2HD LYS 29 HD3 LYS 29 -0.768 12.326 0.319
210 1HE LYS 29 HE2 LYS 29 -0.269 14.652 1.283
211 2HE LYS 29 HE3 LYS 29 1.426 14.207 1.301
212 1HZ LYS 29 HZ1 LYS 29 -0.321 14.417 -1.084
213 2HZ LYS 29 HZ2 LYS 29 1.019 15.287 -0.764
214 H ALA 30 HN ALA 30 -2.851 8.999 4.192
215 HA ALA 30 HA ALA 30 -2.674 6.450 2.821
216 1HB ALA 30 HB1 ALA 30 -0.337 7.295 3.688
217 2HB ALA 30 HB2 ALA 30 -0.979 6.843 5.285
218 3HB ALA 30 HB3 ALA 30 -0.841 5.617 4.003
219 H SER 31 HN SER 31 -2.852 4.705 4.883
220 HA SER 31 HA SER 31 -5.269 5.539 6.191
221 1HB SER 31 HB2 SER 31 -3.776 2.881 6.316
222 2HB SER 31 HB3 SER 31 -5.385 3.175 6.943
223 HG SER 31 HG SER 31 -6.071 3.688 4.740
224 H GLY 32 HN GLY 32 -1.831 4.886 6.884
225 1HA GLY 32 HA1 GLY 32 -2.136 6.173 9.476
226 2HA GLY 32 HA2 GLY 32 -1.599 4.505 9.509
227 H GLY 33 HN GLY 33 0.339 5.749 10.548
228 1HA GLY 33 HA1 GLY 33 2.443 5.380 8.699
229 2HA GLY 33 HA2 GLY 33 2.207 7.095 8.977
230 H HIS 34 HN HIS 34 4.587 5.689 9.761
231 HA HIS 34 HA HIS 34 4.437 6.573 12.523
232 1HB HIS 34 HB2 HIS 34 4.307 4.054 12.455
233 2HB HIS 34 HB3 HIS 34 5.906 4.045 11.738
234 HD1 HIS 34 HD1 HIS 34 7.892 5.064 13.275
235 HD2 HIS 34 HD2 HIS 34 4.253 4.286 15.212
236 HE1 HIS 34 HE1 HIS 34 8.403 5.043 15.775
237 H CYS 35 HN CYS 35 6.646 7.186 13.368
238 HA CYS 35 HA CYS 35 7.853 8.667 11.212
239 1HB CYS 35 HB2 CYS 35 7.221 9.874 13.201
240 2HB CYS 35 HB3 CYS 35 8.172 8.807 14.214
241 H TYR 36 HN TYR 36 9.475 7.611 10.084
242 HA TYR 36 HA TYR 36 11.414 6.083 11.664
243 1HB TYR 36 HB2 TYR 36 10.146 5.441 9.370
244 2HB TYR 36 HB3 TYR 36 11.322 6.513 8.636
245 HD1 TYR 36 HD1 TYR 36 11.204 3.599 11.003
246 HD2 TYR 36 HD2 TYR 36 13.310 5.595 7.858
247 HE1 TYR 36 HE1 TYR 36 12.890 1.698 10.915
248 HE2 TYR 36 HE2 TYR 36 14.989 3.687 7.782
249 HH TYR 36 HH TYR 36 14.648 0.897 9.961
250 H ALA 37 HN ALA 37 13.778 6.396 10.975
251 HA ALA 37 HA ALA 37 14.398 8.963 11.801
252 1HB ALA 37 HB1 ALA 37 16.111 6.866 10.405
253 2HB ALA 37 HB2 ALA 37 16.733 8.275 11.297
254 3HB ALA 37 HB3 ALA 37 15.832 7.004 12.158
255 H MET 38 HN MET 38 14.043 7.541 8.545
256 HA MET 38 HA MET 38 15.356 9.670 7.250
257 1HB MET 38 HB2 MET 38 13.399 7.509 6.295
258 2HB MET 38 HB3 MET 38 14.223 8.597 5.196
259 1HG MET 38 HG2 MET 38 15.726 6.839 7.188
260 2HG MET 38 HG3 MET 38 15.334 6.300 5.567
261 1HE MET 38 HE1 MET 38 19.204 7.299 5.670
262 2HE MET 38 HE2 MET 38 18.301 6.962 7.166
263 3HE MET 38 HE3 MET 38 18.045 5.950 5.724
264 H SER 39 HN SER 39 11.899 8.810 7.872
265 HA SER 39 HA SER 39 11.044 11.402 7.996
266 1HB SER 39 HB2 SER 39 11.271 10.372 5.229
267 2HB SER 39 HB3 SER 39 9.672 10.982 5.610
268 HG SER 39 HG SER 39 12.176 12.411 5.905
269 H CYS 40 HN CYS 40 8.429 11.392 7.405
270 HA CYS 40 HA CYS 40 7.264 9.450 8.988
271 1HB CYS 40 HB2 CYS 40 6.194 11.565 8.548
272 2HB CYS 40 HB3 CYS 40 6.075 11.209 6.837
273 H TYR 41 HN TYR 41 7.568 7.264 8.497
274 HA TYR 41 HA TYR 41 7.190 6.296 5.823
275 1HB TYR 41 HB2 TYR 41 8.630 5.257 7.658
276 2HB TYR 41 HB3 TYR 41 7.191 5.014 8.628
277 HD1 TYR 41 HD1 TYR 41 5.857 3.073 8.369
278 HD2 TYR 41 HD2 TYR 41 8.829 4.006 5.437
279 HE1 TYR 41 HE1 TYR 41 5.530 0.790 7.299
280 HE2 TYR 41 HE2 TYR 41 8.492 1.720 4.377
281 HH TYR 41 HH TYR 41 6.448 -0.689 5.902
282 H CYS 42 HN CYS 42 5.150 6.703 4.983
283 HA CYS 42 HA CYS 42 2.904 6.573 6.773
284 1HB CYS 42 HB2 CYS 42 3.128 7.308 3.849
285 2HB CYS 42 HB3 CYS 42 1.627 7.319 4.753
286 H GLU 43 HN GLU 43 0.885 5.276 6.019
287 HA GLU 43 HA GLU 43 1.882 2.704 5.101
288 1HB GLU 43 HB2 GLU 43 1.798 3.252 7.761
289 2HB GLU 43 HB3 GLU 43 0.146 2.709 7.544
290 1HG GLU 43 HG2 GLU 43 0.991 0.606 6.463
291 2HG GLU 43 HG3 GLU 43 2.638 1.147 6.714
292 HE2 GLU 43 HE2 GLU 43 0.537 -0.230 9.833
293 H GLY 44 HN GLY 44 0.504 1.886 3.585
294 1HA GLY 44 HA1 GLY 44 -1.477 1.111 2.776
295 2HA GLY 44 HA2 GLY 44 -2.334 1.881 4.097
296 H LEU 45 HN LEU 45 -0.367 2.802 1.175
297 HA LEU 45 HA LEU 45 -2.132 5.095 0.818
298 1HB LEU 45 HB2 LEU 45 0.514 4.301 -0.388
299 2HB LEU 45 HB3 LEU 45 -0.445 5.635 -0.999
300 HG LEU 45 HG LEU 45 -0.350 6.349 1.596
301 1HD1 LEU 45 HD11 LEU 45 0.946 4.493 2.381
302 2HD1 LEU 45 HD12 LEU 45 2.180 4.754 1.125
303 3HD1 LEU 45 HD13 LEU 45 1.969 5.949 2.427
304 1HD2 LEU 45 HD21 LEU 45 0.247 7.791 -0.248
305 2HD2 LEU 45 HD22 LEU 45 1.529 7.842 0.986
306 3HD2 LEU 45 HD23 LEU 45 1.765 6.897 -0.504
307 HA PRO 46 HA PRO 46 -3.746 3.244 -2.917
308 1HB PRO 46 HB2 PRO 46 -4.455 5.506 -4.276
309 2HB PRO 46 HB3 PRO 46 -5.514 4.703 -3.134
310 1HG PRO 46 HG2 PRO 46 -3.979 7.207 -2.795
311 2HG PRO 46 HG3 PRO 46 -5.342 6.620 -1.862
312 1HD PRO 46 HD2 PRO 46 -2.582 6.574 -1.083
313 2HD PRO 46 HD3 PRO 46 -3.931 5.884 -0.203
314 H GLU 47 HN GLU 47 -3.227 3.047 -5.241
315 HA GLU 47 HA GLU 47 -0.459 2.758 -5.054
316 1HB GLU 47 HB2 GLU 47 -0.625 1.611 -7.176
317 2HB GLU 47 HB3 GLU 47 -2.048 1.197 -6.241
318 1HG GLU 47 HG2 GLU 47 -3.276 3.097 -7.453
319 2HG GLU 47 HG3 GLU 47 -1.876 3.245 -8.496
320 HE2 GLU 47 HE2 GLU 47 -4.176 1.103 -7.337
321 H ASN 48 HN ASN 48 -2.491 5.333 -6.220
322 HA ASN 48 HA ASN 48 -0.902 6.113 -8.384
323 1HB ASN 48 HB2 ASN 48 -2.293 8.186 -8.336
324 2HB ASN 48 HB3 ASN 48 -3.295 6.759 -8.160
325 1HD2 ASN 48 HD21 ASN 48 -3.890 9.597 -5.601
326 2HD2 ASN 48 HD22 ASN 48 -3.529 9.629 -7.295
327 H ALA 49 HN ALA 49 -0.929 6.734 -4.880
328 HA ALA 49 HA ALA 49 0.746 9.083 -5.125
329 1HB ALA 49 HB1 ALA 49 -1.086 9.051 -3.493
330 2HB ALA 49 HB2 ALA 49 -0.401 7.598 -2.727
331 3HB ALA 49 HB3 ALA 49 0.481 9.141 -2.654
332 H LYS 50 HN LYS 50 2.599 8.026 -6.170
333 HA LYS 50 HA LYS 50 3.600 5.598 -5.239
334 1HB LYS 50 HB2 LYS 50 5.369 5.932 -6.789
335 2HB LYS 50 HB3 LYS 50 3.923 6.607 -7.512
336 1HG LYS 50 HG2 LYS 50 5.221 8.458 -7.863
337 2HG LYS 50 HG3 LYS 50 4.874 8.817 -6.184
338 1HD LYS 50 HD2 LYS 50 6.952 7.515 -5.529
339 2HD LYS 50 HD3 LYS 50 7.317 7.310 -7.231
340 1HE LYS 50 HE2 LYS 50 7.496 9.745 -7.545
341 2HE LYS 50 HE3 LYS 50 6.950 10.039 -5.906
342 1HZ LYS 50 HZ1 LYS 50 8.949 8.917 -5.089
343 2HZ LYS 50 HZ2 LYS 50 9.450 8.590 -6.604
344 H VAL 51 HN VAL 51 5.589 5.113 -4.086
345 HA VAL 51 HA VAL 51 6.422 7.296 -2.314
346 HB VAL 51 HB VAL 51 6.324 5.841 -0.418
347 1HG1 VAL 51 HG11 VAL 51 3.966 5.663 -0.121
348 2HG1 VAL 51 HG12 VAL 51 4.239 7.053 -1.199
349 3HG1 VAL 51 HG13 VAL 51 3.687 5.501 -1.872
350 1HG2 VAL 51 HG21 VAL 51 5.307 3.544 -0.615
351 2HG2 VAL 51 HG22 VAL 51 5.463 3.695 -2.381
352 3HG2 VAL 51 HG23 VAL 51 6.917 3.716 -1.355
353 H SER 52 HN SER 52 8.625 6.975 -1.400
354 HA SER 52 HA SER 52 10.177 5.050 -2.890
355 1HB SER 52 HB2 SER 52 11.264 7.173 -2.621
356 2HB SER 52 HB3 SER 52 10.876 7.250 -0.914
357 HG SER 52 HG SER 52 12.837 5.622 -2.245
358 H ASP 53 HN ASP 53 11.310 3.256 -1.826
359 HA ASP 53 HA ASP 53 10.957 3.236 1.065
360 1HB ASP 53 HB2 ASP 53 11.053 0.752 1.001
361 2HB ASP 53 HB3 ASP 53 9.671 1.365 0.116
362 HD2 ASP 53 HD2 ASP 53 12.723 0.026 -0.138
363 H SER 54 HN SER 54 13.073 4.558 -0.428
364 HA SER 54 HA SER 54 15.237 2.607 -0.330
365 1HB SER 54 HB2 SER 54 16.129 3.837 -2.419
366 2HB SER 54 HB3 SER 54 14.772 2.753 -2.649
367 HG SER 54 HG SER 54 14.291 4.687 -3.734
368 H ALA 55 HN ALA 55 14.313 4.815 1.561
369 HA ALA 55 HA ALA 55 15.444 6.019 3.034
370 1HB ALA 55 HB1 ALA 55 16.864 3.997 3.048
371 2HB ALA 55 HB2 ALA 55 17.858 4.683 1.741
372 3HB ALA 55 HB3 ALA 55 17.829 5.463 3.340
373 H THR 56 HN THR 56 14.567 7.567 0.997
374 HA THR 56 HA THR 56 14.840 9.639 0.240
375 HB THR 56 HB THR 56 17.340 9.712 2.004
376 HG1 THR 56 HG1 THR 56 15.719 10.184 3.654
377 1HG2 THR 56 HG21 THR 56 16.669 12.058 2.363
378 2HG2 THR 56 HG22 THR 56 16.837 11.775 0.613
379 3HG2 THR 56 HG23 THR 56 15.220 11.826 1.355
380 H ASN 57 HN ASN 57 15.203 8.585 -1.885
381 HA ASN 57 HA ASN 57 17.881 9.243 -2.784
382 1HB ASN 57 HB2 ASN 57 17.213 8.193 -4.918
383 2HB ASN 57 HB3 ASN 57 16.834 7.105 -3.597
384 1HD2 ASN 57 HD21 ASN 57 13.355 7.174 -3.950
385 2HD2 ASN 57 HD22 ASN 57 14.731 6.712 -3.005
386 H ILE 58 HN ILE 58 14.816 10.619 -2.245
387 HA ILE 58 HA ILE 58 14.842 12.288 -4.625
388 HB ILE 58 HB ILE 58 12.867 11.828 -2.399
389 1HG1 ILE 58 HG12 ILE 58 11.677 11.496 -4.908
390 2HG1 ILE 58 HG13 ILE 58 13.270 10.788 -5.092
391 1HG2 ILE 58 HG21 ILE 58 12.768 13.914 -4.592
392 2HG2 ILE 58 HG22 ILE 58 11.366 13.402 -3.623
393 3HG2 ILE 58 HG23 ILE 58 12.757 14.183 -2.833
394 1HD1 ILE 58 HD11 ILE 58 12.903 9.439 -3.011
395 2HD1 ILE 58 HD12 ILE 58 11.265 10.126 -2.886
396 3HD1 ILE 58 HD13 ILE 58 11.692 9.090 -4.269
397 H CYS 59 HN CYS 59 15.045 14.630 -4.527
398 HA CYS 59 HA CYS 59 16.727 16.019 -4.195
399 1HB CYS 59 HB2 CYS 59 15.486 15.863 -1.458
400 2HB CYS 59 HB3 CYS 59 16.850 16.917 -1.772
401 H GLY 60 HN GLY 60 17.716 13.475 -4.472
402 1HA GLY 60 HA1 GLY 60 19.603 12.297 -4.144
403 2HA GLY 60 HA2 GLY 60 20.217 13.630 -3.185
Start of MODEL 5
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 -1.035 0.098
3 1HB LYS 1 HB2 LYS 1 1.575 -0.073 -2.153
4 2HB LYS 1 HB3 LYS 1 1.660 1.546 -1.490
5 1HG LYS 1 HG2 LYS 1 3.930 1.038 -0.552
6 2HG LYS 1 HG3 LYS 1 3.846 -0.574 -1.234
7 1HD LYS 1 HD2 LYS 1 3.629 0.416 -3.529
8 2HD LYS 1 HD3 LYS 1 3.737 2.024 -2.840
9 1HE LYS 1 HE2 LYS 1 6.005 1.414 -1.886
10 2HE LYS 1 HE3 LYS 1 5.897 -0.134 -2.700
11 1HZ LYS 1 HZ1 LYS 1 5.915 2.523 -4.026
12 2HZ LYS 1 HZ2 LYS 1 7.096 1.404 -4.094
13 H ASP 2 HN ASP 2 2.975 -0.862 1.912
14 HA ASP 2 HA ASP 2 3.288 1.780 3.036
15 1HB ASP 2 HB2 ASP 2 2.609 -0.581 4.827
16 2HB ASP 2 HB3 ASP 2 2.637 1.118 5.256
17 HD2 ASP 2 HD2 ASP 2 -0.538 1.649 3.697
18 H GLY 3 HN GLY 3 5.237 1.883 4.450
19 1HA GLY 3 HA1 GLY 3 6.835 -0.085 5.361
20 2HA GLY 3 HA2 GLY 3 7.247 -0.042 3.658
21 H TYR 4 HN TYR 4 9.431 0.631 4.492
22 HA TYR 4 HA TYR 4 9.512 3.441 5.290
23 1HB TYR 4 HB2 TYR 4 11.814 1.473 4.819
24 2HB TYR 4 HB3 TYR 4 11.802 2.844 5.910
25 HD1 TYR 4 HD1 TYR 4 10.131 2.710 7.927
26 HD2 TYR 4 HD2 TYR 4 11.408 -0.678 5.648
27 HE1 TYR 4 HE1 TYR 4 9.491 1.169 9.845
28 HE2 TYR 4 HE2 TYR 4 10.763 -2.207 7.574
29 HH TYR 4 HH TYR 4 9.837 -0.907 10.676
30 HA PRO 5 HA PRO 5 10.491 4.384 1.110
31 1HB PRO 5 HB2 PRO 5 10.366 7.102 1.366
32 2HB PRO 5 HB3 PRO 5 8.968 6.108 1.010
33 1HG PRO 5 HG2 PRO 5 9.712 7.417 3.554
34 2HG PRO 5 HG3 PRO 5 8.152 6.793 3.056
35 1HD PRO 5 HD2 PRO 5 9.992 5.558 4.876
36 2HD PRO 5 HD3 PRO 5 8.487 4.882 4.289
37 H VAL 6 HN VAL 6 12.396 4.467 0.060
38 HA VAL 6 HA VAL 6 14.361 6.239 1.280
39 HB VAL 6 HB VAL 6 16.127 4.540 0.898
40 1HG1 VAL 6 HG11 VAL 6 15.795 3.386 2.958
41 2HG1 VAL 6 HG12 VAL 6 15.011 4.975 3.131
42 3HG1 VAL 6 HG13 VAL 6 14.025 3.524 2.830
43 1HG2 VAL 6 HG21 VAL 6 15.501 2.173 0.665
44 2HG2 VAL 6 HG22 VAL 6 13.790 2.638 0.516
45 3HG2 VAL 6 HG23 VAL 6 14.958 3.131 -0.733
46 H ASP 7 HN ASP 7 15.618 7.341 -0.239
47 HA ASP 7 HA ASP 7 15.866 6.318 -2.855
48 1HB ASP 7 HB2 ASP 7 14.899 8.690 -3.720
49 2HB ASP 7 HB3 ASP 7 13.899 7.256 -3.601
50 HD2 ASP 7 HD2 ASP 7 13.994 10.418 -2.735
51 H SER 8 HN SER 8 15.598 9.683 -1.467
52 HA SER 8 HA SER 8 18.210 10.234 -2.518
53 1HB SER 8 HB2 SER 8 17.681 12.590 -1.783
54 2HB SER 8 HB3 SER 8 16.517 11.916 -2.906
55 HG SER 8 HG SER 8 15.511 13.013 -1.081
56 H LYS 9 HN LYS 9 16.569 9.626 0.570
57 HA LYS 9 HA LYS 9 18.583 10.849 2.172
58 1HB LYS 9 HB2 LYS 9 17.310 9.995 4.039
59 2HB LYS 9 HB3 LYS 9 16.221 10.696 2.859
60 1HG LYS 9 HG2 LYS 9 16.309 8.088 1.971
61 2HG LYS 9 HG3 LYS 9 16.539 7.846 3.691
62 1HD LYS 9 HD2 LYS 9 14.188 7.810 3.476
63 2HD LYS 9 HD3 LYS 9 14.499 9.454 3.998
64 1HE LYS 9 HE2 LYS 9 14.321 10.292 1.701
65 2HE LYS 9 HE3 LYS 9 14.246 8.663 1.059
66 1HZ LYS 9 HZ1 LYS 9 12.197 9.953 2.777
67 2HZ LYS 9 HZ2 LYS 9 12.022 9.525 1.216
68 H GLY 10 HN GLY 10 18.114 7.740 0.604
69 1HA GLY 10 HA1 GLY 10 19.654 6.091 0.324
70 2HA GLY 10 HA2 GLY 10 20.752 6.914 1.413
71 H CYS 11 HN CYS 11 20.133 6.880 3.831
72 HA CYS 11 HA CYS 11 19.215 4.152 4.367
73 1HB CYS 11 HB2 CYS 11 21.527 5.696 5.262
74 2HB CYS 11 HB3 CYS 11 20.629 5.004 6.597
75 H LYS 12 HN LYS 12 16.995 5.467 4.199
76 HA LYS 12 HA LYS 12 15.160 5.548 5.427
77 1HB LYS 12 HB2 LYS 12 16.939 4.110 7.041
78 2HB LYS 12 HB3 LYS 12 16.252 5.310 8.116
79 1HG LYS 12 HG2 LYS 12 14.685 3.554 8.255
80 2HG LYS 12 HG3 LYS 12 13.943 4.625 7.084
81 1HD LYS 12 HD2 LYS 12 14.155 3.111 5.383
82 2HD LYS 12 HD3 LYS 12 15.801 2.705 5.825
83 1HE LYS 12 HE2 LYS 12 13.290 1.657 7.219
84 2HE LYS 12 HE3 LYS 12 14.270 0.751 6.083
85 1HZ LYS 12 HZ1 LYS 12 16.143 1.466 7.824
86 2HZ LYS 12 HZ2 LYS 12 14.876 1.452 8.847
87 H LEU 13 HN LEU 13 14.062 6.953 7.276
88 HA LEU 13 HA LEU 13 15.835 9.182 7.999
89 1HB LEU 13 HB2 LEU 13 13.751 10.522 8.283
90 2HB LEU 13 HB3 LEU 13 14.185 10.128 6.632
91 HG LEU 13 HG LEU 13 12.304 8.237 7.917
92 1HD1 LEU 13 HD11 LEU 13 11.485 11.091 7.315
93 2HD1 LEU 13 HD12 LEU 13 10.359 9.738 7.582
94 3HD1 LEU 13 HD13 LEU 13 11.442 10.267 8.892
95 1HD2 LEU 13 HD21 LEU 13 12.306 9.656 5.239
96 2HD2 LEU 13 HD22 LEU 13 12.978 8.041 5.569
97 3HD2 LEU 13 HD23 LEU 13 11.228 8.327 5.730
98 H SER 14 HN SER 14 16.356 9.259 10.125
99 HA SER 14 HA SER 14 15.372 7.124 11.694
100 1HB SER 14 HB2 SER 14 17.228 9.427 12.444
101 2HB SER 14 HB3 SER 14 16.981 7.977 13.397
102 HG SER 14 HG SER 14 17.830 6.717 11.608
103 H CYS 15 HN CYS 15 13.065 7.712 11.842
104 HA CYS 15 HA CYS 15 12.183 10.097 12.949
105 1HB CYS 15 HB2 CYS 15 10.111 8.829 13.480
106 2HB CYS 15 HB3 CYS 15 10.635 8.720 11.811
107 H VAL 16 HN VAL 16 11.705 10.693 15.138
108 HA VAL 16 HA VAL 16 13.068 9.017 17.118
109 HB VAL 16 HB VAL 16 13.705 11.454 16.647
110 1HG1 VAL 16 HG11 VAL 16 11.340 12.279 16.589
111 2HG1 VAL 16 HG12 VAL 16 11.248 11.996 18.344
112 3HG1 VAL 16 HG13 VAL 16 12.400 13.187 17.694
113 1HG2 VAL 16 HG21 VAL 16 14.159 11.886 19.029
114 2HG2 VAL 16 HG22 VAL 16 13.017 10.596 19.479
115 3HG2 VAL 16 HG23 VAL 16 14.505 10.197 18.588
116 H ALA 17 HN ALA 17 10.002 9.668 15.832
117 HA ALA 17 HA ALA 17 8.611 8.613 18.067
118 1HB ALA 17 HB1 ALA 17 7.289 10.679 18.551
119 2HB ALA 17 HB2 ALA 17 9.005 10.834 18.997
120 3HB ALA 17 HB3 ALA 17 8.400 11.599 17.508
121 H ASN 18 HN ASN 18 6.180 8.624 17.597
122 HA ASN 18 HA ASN 18 5.966 7.690 14.966
123 1HB ASN 18 HB2 ASN 18 3.872 8.202 17.141
124 2HB ASN 18 HB3 ASN 18 3.496 7.414 15.622
125 1HD2 ASN 18 HD21 ASN 18 5.069 5.376 18.719
126 2HD2 ASN 18 HD22 ASN 18 4.477 7.003 18.777
127 H ASN 19 HN ASN 19 4.767 10.566 16.807
128 HA ASN 19 HA ASN 19 3.162 11.597 14.812
129 1HB ASN 19 HB2 ASN 19 3.587 13.820 16.051
130 2HB ASN 19 HB3 ASN 19 2.971 12.510 17.039
131 1HD2 ASN 19 HD21 ASN 19 5.693 12.286 19.175
132 2HD2 ASN 19 HD22 ASN 19 4.130 11.720 18.686
133 H TYR 20 HN TYR 20 6.677 11.722 15.472
134 HA TYR 20 HA TYR 20 7.221 13.932 13.774
135 1HB TYR 20 HB2 TYR 20 8.601 13.072 15.737
136 2HB TYR 20 HB3 TYR 20 8.888 11.579 14.866
137 HD1 TYR 20 HD1 TYR 20 10.360 11.564 12.854
138 HD2 TYR 20 HD2 TYR 20 9.861 15.071 15.253
139 HE1 TYR 20 HE1 TYR 20 12.446 12.580 11.814
140 HE2 TYR 20 HE2 TYR 20 11.949 16.076 14.205
141 HH TYR 20 HH TYR 20 13.747 14.296 11.706
142 H CYS 21 HN CYS 21 7.208 10.352 13.392
143 HA CYS 21 HA CYS 21 8.176 10.356 10.766
144 1HB CYS 21 HB2 CYS 21 8.173 8.305 11.904
145 2HB CYS 21 HB3 CYS 21 6.490 8.450 12.369
146 H ASP 22 HN ASP 22 4.865 10.645 12.240
147 HA ASP 22 HA ASP 22 3.538 9.861 9.988
148 1HB ASP 22 HB2 ASP 22 2.555 10.038 12.280
149 2HB ASP 22 HB3 ASP 22 2.614 11.786 12.173
150 HD2 ASP 22 HD2 ASP 22 1.054 12.750 11.255
151 H ASN 23 HN ASN 23 4.344 13.175 11.241
152 HA ASN 23 HA ASN 23 2.883 14.501 9.268
153 1HB ASN 23 HB2 ASN 23 3.916 16.524 10.156
154 2HB ASN 23 HB3 ASN 23 3.627 15.456 11.514
155 1HD2 ASN 23 HD21 ASN 23 7.394 16.560 10.361
156 2HD2 ASN 23 HD22 ASN 23 5.961 16.988 9.486
157 H GLN 24 HN GLN 24 6.160 13.153 9.512
158 HA GLN 24 HA GLN 24 7.217 14.826 7.464
159 1HB GLN 24 HB2 GLN 24 8.538 13.911 9.431
160 2HB GLN 24 HB3 GLN 24 8.434 12.320 8.703
161 1HG GLN 24 HG2 GLN 24 9.676 13.041 6.739
162 2HG GLN 24 HG3 GLN 24 9.567 14.725 7.209
163 1HE2 GLN 24 HE21 GLN 24 12.921 14.059 8.206
164 2HE2 GLN 24 HE22 GLN 24 11.921 14.507 6.864
165 H CYS 25 HN CYS 25 5.587 11.716 7.704
166 HA CYS 25 HA CYS 25 6.406 10.725 5.196
167 1HB CYS 25 HB2 CYS 25 3.960 10.148 6.877
168 2HB CYS 25 HB3 CYS 25 4.370 9.285 5.408
169 H LYS 26 HN LYS 26 3.526 12.591 6.404
170 HA LYS 26 HA LYS 26 2.387 12.562 3.763
171 1HB LYS 26 HB2 LYS 26 0.427 13.345 4.775
172 2HB LYS 26 HB3 LYS 26 1.128 12.267 5.965
173 1HG LYS 26 HG2 LYS 26 2.172 14.259 7.111
174 2HG LYS 26 HG3 LYS 26 1.386 15.312 5.951
175 1HD LYS 26 HD2 LYS 26 -0.064 15.304 7.851
176 2HD LYS 26 HD3 LYS 26 -0.848 14.259 6.684
177 1HE LYS 26 HE2 LYS 26 -0.101 12.256 7.822
178 2HE LYS 26 HE3 LYS 26 1.030 13.154 8.814
179 1HZ LYS 26 HZ1 LYS 26 -1.928 13.249 8.984
180 2HZ LYS 26 HZ2 LYS 26 -0.892 12.751 10.138
181 H MET 27 HN MET 27 4.680 14.473 5.453
182 HA MET 27 HA MET 27 4.370 16.945 4.438
183 1HB MET 27 HB2 MET 27 6.317 16.072 5.800
184 2HB MET 27 HB3 MET 27 6.909 15.218 4.389
185 1HG MET 27 HG2 MET 27 6.415 18.035 3.746
186 2HG MET 27 HG3 MET 27 7.483 17.901 5.129
187 1HE MET 27 HE1 MET 27 10.523 15.974 3.866
188 2HE MET 27 HE2 MET 27 9.771 16.940 5.159
189 3HE MET 27 HE3 MET 27 9.150 15.314 4.788
190 H LYS 28 HN LYS 28 5.135 13.933 2.676
191 HA LYS 28 HA LYS 28 4.870 15.370 0.171
192 1HB LYS 28 HB2 LYS 28 7.275 15.533 0.735
193 2HB LYS 28 HB3 LYS 28 7.368 13.787 0.845
194 1HG LYS 28 HG2 LYS 28 6.427 13.743 -1.578
195 2HG LYS 28 HG3 LYS 28 6.761 15.462 -1.625
196 1HD LYS 28 HD2 LYS 28 8.855 13.345 -0.943
197 2HD LYS 28 HD3 LYS 28 8.626 14.005 -2.551
198 1HE LYS 28 HE2 LYS 28 9.021 16.330 -1.576
199 2HE LYS 28 HE3 LYS 28 9.415 15.569 -0.048
200 1HZ LYS 28 HZ1 LYS 28 11.405 15.983 -1.405
201 2HZ LYS 28 HZ2 LYS 28 11.227 14.384 -1.154
202 H LYS 29 HN LYS 29 5.633 12.132 1.735
203 HA LYS 29 HA LYS 29 5.289 11.045 -0.897
204 1HB LYS 29 HB2 LYS 29 6.092 9.712 1.707
205 2HB LYS 29 HB3 LYS 29 6.198 8.998 0.110
206 1HG LYS 29 HG2 LYS 29 7.594 11.215 -0.443
207 2HG LYS 29 HG3 LYS 29 7.830 11.250 1.293
208 1HD LYS 29 HD2 LYS 29 9.660 9.951 0.644
209 2HD LYS 29 HD3 LYS 29 8.486 8.696 0.988
210 1HE LYS 29 HE2 LYS 29 7.851 8.663 -1.457
211 2HE LYS 29 HE3 LYS 29 9.094 9.857 -1.774
212 1HZ LYS 29 HZ1 LYS 29 9.923 7.606 -2.161
213 2HZ LYS 29 HZ2 LYS 29 10.748 8.269 -0.923
214 H ALA 30 HN ALA 30 3.585 10.815 2.318
215 HA ALA 30 HA ALA 30 2.021 8.645 1.097
216 1HB ALA 30 HB1 ALA 30 2.820 8.448 3.966
217 2HB ALA 30 HB2 ALA 30 2.661 7.175 2.732
218 3HB ALA 30 HB3 ALA 30 4.109 8.209 2.763
219 H SER 31 HN SER 31 0.327 8.009 3.134
220 HA SER 31 HA SER 31 -1.201 10.415 3.381
221 1HB SER 31 HB2 SER 31 -1.757 7.565 4.320
222 2HB SER 31 HB3 SER 31 -2.910 8.882 4.405
223 HG SER 31 HG SER 31 -1.682 7.930 1.958
224 H GLY 32 HN GLY 32 0.900 8.330 5.337
225 1HA GLY 32 HA1 GLY 32 1.298 10.154 7.385
226 2HA GLY 32 HA2 GLY 32 -0.033 9.134 7.894
227 H GLY 33 HN GLY 33 1.356 8.245 9.623
228 1HA GLY 33 HA1 GLY 33 1.619 5.677 9.361
229 2HA GLY 33 HA2 GLY 33 3.135 6.137 8.613
230 H HIS 34 HN HIS 34 4.287 5.017 10.379
231 HA HIS 34 HA HIS 34 4.174 6.427 12.915
232 1HB HIS 34 HB2 HIS 34 3.695 3.443 12.729
233 2HB HIS 34 HB3 HIS 34 3.712 4.422 14.182
234 HD1 HIS 34 HD1 HIS 34 1.821 6.649 13.747
235 HD2 HIS 34 HD2 HIS 34 1.114 2.847 12.120
236 HE1 HIS 34 HE1 HIS 34 -0.687 6.518 13.298
237 H CYS 35 HN CYS 35 5.883 5.339 14.481
238 HA CYS 35 HA CYS 35 8.253 5.215 12.781
239 1HB CYS 35 HB2 CYS 35 8.071 7.135 14.304
240 2HB CYS 35 HB3 CYS 35 7.974 6.049 15.676
241 H TYR 36 HN TYR 36 8.668 3.026 12.423
242 HA TYR 36 HA TYR 36 8.530 1.277 14.787
243 1HB TYR 36 HB2 TYR 36 6.952 1.148 12.596
244 2HB TYR 36 HB3 TYR 36 8.372 0.445 11.848
245 HD1 TYR 36 HD1 TYR 36 9.342 -1.694 12.817
246 HD2 TYR 36 HD2 TYR 36 5.539 -0.141 14.010
247 HE1 TYR 36 HE1 TYR 36 8.698 -3.970 13.750
248 HE2 TYR 36 HE2 TYR 36 4.907 -2.422 14.939
249 HH TYR 36 HH TYR 36 5.517 -4.462 15.263
250 H ALA 37 HN ALA 37 10.308 0.025 15.280
251 HA ALA 37 HA ALA 37 12.501 -0.357 15.379
252 1HB ALA 37 HB1 ALA 37 11.964 -1.001 12.451
253 2HB ALA 37 HB2 ALA 37 13.382 -1.547 13.377
254 3HB ALA 37 HB3 ALA 37 11.753 -2.102 13.833
255 H MET 38 HN MET 38 12.541 2.177 15.634
256 HA MET 38 HA MET 38 13.122 4.201 14.903
257 1HB MET 38 HB2 MET 38 15.664 4.248 14.587
258 2HB MET 38 HB3 MET 38 15.139 3.349 15.997
259 1HG MET 38 HG2 MET 38 15.393 1.212 14.805
260 2HG MET 38 HG3 MET 38 15.726 2.042 13.298
261 1HE MET 38 HE1 MET 38 19.223 0.581 14.154
262 2HE MET 38 HE2 MET 38 17.636 -0.176 14.432
263 3HE MET 38 HE3 MET 38 17.936 0.740 12.935
264 H SER 39 HN SER 39 11.671 3.193 12.787
265 HA SER 39 HA SER 39 13.016 4.585 10.673
266 1HB SER 39 HB2 SER 39 11.998 1.734 10.287
267 2HB SER 39 HB3 SER 39 12.525 2.789 8.991
268 HG SER 39 HG SER 39 14.106 1.674 11.133
269 H CYS 40 HN CYS 40 11.525 5.746 9.411
270 HA CYS 40 HA CYS 40 8.948 5.953 10.550
271 1HB CYS 40 HB2 CYS 40 10.121 7.901 9.715
272 2HB CYS 40 HB3 CYS 40 10.169 7.232 8.096
273 H TYR 41 HN TYR 41 7.783 3.996 10.251
274 HA TYR 41 HA TYR 41 7.529 2.820 7.662
275 1HB TYR 41 HB2 TYR 41 7.277 1.748 10.002
276 2HB TYR 41 HB3 TYR 41 5.815 2.689 10.221
277 HD1 TYR 41 HD1 TYR 41 7.350 0.013 8.136
278 HD2 TYR 41 HD2 TYR 41 3.731 1.934 9.369
279 HE1 TYR 41 HE1 TYR 41 5.988 -1.835 7.044
280 HE2 TYR 41 HE2 TYR 41 2.381 0.079 8.273
281 HH TYR 41 HH TYR 41 2.441 -1.825 7.253
282 H CYS 42 HN CYS 42 6.734 4.287 6.127
283 HA CYS 42 HA CYS 42 4.592 6.033 6.938
284 1HB CYS 42 HB2 CYS 42 6.186 5.816 4.379
285 2HB CYS 42 HB3 CYS 42 4.889 6.968 4.626
286 H GLU 43 HN GLU 43 2.527 6.132 5.699
287 HA GLU 43 HA GLU 43 1.870 3.424 4.832
288 1HB GLU 43 HB2 GLU 43 0.368 5.318 6.675
289 2HB GLU 43 HB3 GLU 43 -0.436 3.971 5.893
290 1HG GLU 43 HG2 GLU 43 1.187 2.383 6.917
291 2HG GLU 43 HG3 GLU 43 2.041 3.718 7.665
292 HE2 GLU 43 HE2 GLU 43 1.332 2.095 9.246
293 H GLY 44 HN GLY 44 0.778 3.231 2.898
294 1HA GLY 44 HA1 GLY 44 -0.533 3.822 1.139
295 2HA GLY 44 HA2 GLY 44 -0.866 5.368 1.892
296 H LEU 45 HN LEU 45 2.069 3.616 0.623
297 HA LEU 45 HA LEU 45 3.149 6.182 -0.176
298 1HB LEU 45 HB2 LEU 45 4.248 3.388 0.024
299 2HB LEU 45 HB3 LEU 45 5.128 4.667 -0.788
300 HG LEU 45 HG LEU 45 4.163 5.021 2.045
301 1HD1 LEU 45 HD11 LEU 45 5.477 2.874 1.809
302 2HD1 LEU 45 HD12 LEU 45 6.868 3.877 1.328
303 3HD1 LEU 45 HD13 LEU 45 6.142 4.077 2.941
304 1HD2 LEU 45 HD21 LEU 45 6.022 6.599 2.183
305 2HD2 LEU 45 HD22 LEU 45 6.481 6.221 0.505
306 3HD2 LEU 45 HD23 LEU 45 4.924 7.013 0.844
307 HA PRO 46 HA PRO 46 2.276 5.611 -4.400
308 1HB PRO 46 HB2 PRO 46 4.295 7.024 -5.581
309 2HB PRO 46 HB3 PRO 46 2.857 7.778 -4.920
310 1HG PRO 46 HG2 PRO 46 5.594 7.712 -3.805
311 2HG PRO 46 HG3 PRO 46 4.270 8.787 -3.402
312 1HD PRO 46 HD2 PRO 46 5.192 6.549 -1.863
313 2HD PRO 46 HD3 PRO 46 3.797 7.553 -1.521
314 H GLU 47 HN GLU 47 2.865 4.571 -6.436
315 HA GLU 47 HA GLU 47 4.026 2.172 -5.480
316 1HB GLU 47 HB2 GLU 47 3.164 1.173 -7.482
317 2HB GLU 47 HB3 GLU 47 1.975 2.357 -6.978
318 1HG GLU 47 HG2 GLU 47 3.137 4.020 -8.573
319 2HG GLU 47 HG3 GLU 47 4.049 2.657 -9.193
320 HE2 GLU 47 HE2 GLU 47 0.209 3.060 -10.192
321 H ASN 48 HN ASN 48 5.221 4.984 -7.079
322 HA ASN 48 HA ASN 48 7.083 3.560 -8.713
323 1HB ASN 48 HB2 ASN 48 7.769 5.810 -9.476
324 2HB ASN 48 HB3 ASN 48 6.020 5.706 -9.472
325 1HD2 ASN 48 HD21 ASN 48 8.072 8.255 -7.003
326 2HD2 ASN 48 HD22 ASN 48 8.848 7.044 -7.968
327 H ALA 49 HN ALA 49 6.845 4.531 -5.453
328 HA ALA 49 HA ALA 49 9.578 5.396 -5.132
329 1HB ALA 49 HB1 ALA 49 7.323 4.865 -3.154
330 2HB ALA 49 HB2 ALA 49 8.897 5.589 -2.746
331 3HB ALA 49 HB3 ALA 49 7.780 6.444 -3.837
332 H LYS 50 HN LYS 50 11.283 4.169 -4.342
333 HA LYS 50 HA LYS 50 10.838 1.342 -4.013
334 1HB LYS 50 HB2 LYS 50 12.839 2.331 -5.166
335 2HB LYS 50 HB3 LYS 50 13.375 2.952 -3.618
336 1HG LYS 50 HG2 LYS 50 12.650 0.036 -3.727
337 2HG LYS 50 HG3 LYS 50 14.117 0.515 -4.558
338 1HD LYS 50 HD2 LYS 50 15.064 1.460 -2.526
339 2HD LYS 50 HD3 LYS 50 13.539 1.322 -1.674
340 1HE LYS 50 HE2 LYS 50 13.677 -1.207 -1.981
341 2HE LYS 50 HE3 LYS 50 15.281 -0.988 -2.653
342 1HZ LYS 50 HZ1 LYS 50 14.450 -0.177 0.082
343 2HZ LYS 50 HZ2 LYS 50 15.419 -1.434 -0.282
344 H VAL 51 HN VAL 51 10.545 0.259 -2.115
345 HA VAL 51 HA VAL 51 10.938 1.799 0.345
346 HB VAL 51 HB VAL 51 8.783 1.155 1.163
347 1HG1 VAL 51 HG11 VAL 51 8.480 2.278 -1.643
348 2HG1 VAL 51 HG12 VAL 51 7.324 2.449 -0.300
349 3HG1 VAL 51 HG13 VAL 51 8.927 3.216 -0.198
350 1HG2 VAL 51 HG21 VAL 51 7.137 -0.044 -0.252
351 2HG2 VAL 51 HG22 VAL 51 8.404 -0.300 -1.476
352 3HG2 VAL 51 HG23 VAL 51 8.561 -1.039 0.136
353 H SER 52 HN SER 52 11.271 0.439 2.259
354 HA SER 52 HA SER 52 11.591 -2.378 1.580
355 1HB SER 52 HB2 SER 52 13.654 -1.612 2.478
356 2HB SER 52 HB3 SER 52 12.869 -0.623 3.694
357 HG SER 52 HG SER 52 13.584 -2.424 4.801
358 H ASP 53 HN ASP 53 10.552 -3.972 2.952
359 HA ASP 53 HA ASP 53 9.036 -2.874 5.162
360 1HB ASP 53 HB2 ASP 53 7.146 -4.465 4.591
361 2HB ASP 53 HB3 ASP 53 7.341 -3.140 3.460
362 HD2 ASP 53 HD2 ASP 53 7.778 -6.416 3.966
363 H SER 54 HN SER 54 11.431 -4.017 5.703
364 HA SER 54 HA SER 54 11.005 -6.894 5.837
365 1HB SER 54 HB2 SER 54 13.450 -7.113 5.082
366 2HB SER 54 HB3 SER 54 12.294 -6.651 3.849
367 HG SER 54 HG SER 54 12.953 -4.438 4.088
368 H ALA 55 HN ALA 55 10.820 -4.822 7.927
369 HA ALA 55 HA ALA 55 11.467 -4.503 10.020
370 1HB ALA 55 HB1 ALA 55 12.304 -6.464 11.222
371 2HB ALA 55 HB2 ALA 55 11.055 -6.960 10.056
372 3HB ALA 55 HB3 ALA 55 12.775 -7.234 9.688
373 H THR 56 HN THR 56 13.041 -3.135 8.171
374 HA THR 56 HA THR 56 14.852 -1.848 8.265
375 HB THR 56 HB THR 56 15.005 -2.944 11.124
376 HG1 THR 56 HG1 THR 56 12.948 -1.950 10.412
377 1HG2 THR 56 HG21 THR 56 17.028 -1.623 10.554
378 2HG2 THR 56 HG22 THR 56 16.011 -0.346 9.845
379 3HG2 THR 56 HG23 THR 56 15.956 -0.657 11.597
380 H ASN 57 HN ASN 57 15.537 -3.693 6.649
381 HA ASN 57 HA ASN 57 17.996 -4.834 7.538
382 1HB ASN 57 HB2 ASN 57 18.240 -5.596 5.264
383 2HB ASN 57 HB3 ASN 57 16.523 -5.701 5.599
384 1HD2 ASN 57 HD21 ASN 57 15.476 -3.277 3.319
385 2HD2 ASN 57 HD22 ASN 57 15.089 -4.453 4.530
386 H ILE 58 HN ILE 58 16.747 -1.776 6.365
387 HA ILE 58 HA ILE 58 19.345 -0.829 5.505
388 HB ILE 58 HB ILE 58 16.675 0.568 5.718
389 1HG1 ILE 58 HG12 ILE 58 18.059 -0.617 3.293
390 2HG1 ILE 58 HG13 ILE 58 16.698 -1.339 4.129
391 1HG2 ILE 58 HG21 ILE 58 18.415 2.203 5.826
392 2HG2 ILE 58 HG22 ILE 58 19.306 1.429 4.493
393 3HG2 ILE 58 HG23 ILE 58 17.745 2.223 4.177
394 1HD1 ILE 58 HD11 ILE 58 15.659 -0.154 2.374
395 2HD1 ILE 58 HD12 ILE 58 15.515 0.978 3.741
396 3HD1 ILE 58 HD13 ILE 58 16.780 1.222 2.512
397 H CYS 59 HN CYS 59 20.222 1.246 6.482
398 HA CYS 59 HA CYS 59 21.181 0.623 8.866
399 1HB CYS 59 HB2 CYS 59 20.583 3.481 8.086
400 2HB CYS 59 HB3 CYS 59 21.832 2.923 9.181
401 H GLY 60 HN GLY 60 18.377 2.899 8.361
402 1HA GLY 60 HA1 GLY 60 16.585 3.341 9.656
403 2HA GLY 60 HA2 GLY 60 16.931 1.903 10.597
Start of MODEL 6
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 -0.891 0.537
3 1HB LYS 1 HB2 LYS 1 3.037 -0.409 -1.406
4 2HB LYS 1 HB3 LYS 1 1.448 -0.891 -1.964
5 1HG LYS 1 HG2 LYS 1 0.850 1.627 -2.006
6 2HG LYS 1 HG3 LYS 1 2.559 1.940 -1.773
7 1HD LYS 1 HD2 LYS 1 1.292 0.421 -4.099
8 2HD LYS 1 HD3 LYS 1 2.042 2.003 -4.172
9 1HE LYS 1 HE2 LYS 1 4.155 0.685 -3.170
10 2HE LYS 1 HE3 LYS 1 3.349 -0.704 -3.871
11 1HZ LYS 1 HZ1 LYS 1 4.594 0.070 -5.646
12 2HZ LYS 1 HZ2 LYS 1 3.202 0.858 -5.950
13 H ASP 2 HN ASP 2 3.889 0.518 0.717
14 HA ASP 2 HA ASP 2 3.219 3.213 1.508
15 1HB ASP 2 HB2 ASP 2 4.937 1.501 3.331
16 2HB ASP 2 HB3 ASP 2 4.158 3.027 3.698
17 HD2 ASP 2 HD2 ASP 2 1.134 1.511 4.550
18 H GLY 3 HN GLY 3 5.144 4.621 1.462
19 1HA GLY 3 HA1 GLY 3 7.759 4.032 1.348
20 2HA GLY 3 HA2 GLY 3 7.237 3.610 -0.271
21 H TYR 4 HN TYR 4 8.666 5.391 -1.015
22 HA TYR 4 HA TYR 4 7.488 8.036 -0.582
23 1HB TYR 4 HB2 TYR 4 9.928 7.322 -2.274
24 2HB TYR 4 HB3 TYR 4 9.659 8.783 -1.344
25 HD1 TYR 4 HD1 TYR 4 11.311 5.642 -1.419
26 HD2 TYR 4 HD2 TYR 4 9.599 8.498 1.268
27 HE1 TYR 4 HE1 TYR 4 12.699 4.692 0.488
28 HE2 TYR 4 HE2 TYR 4 10.993 7.538 3.166
29 HH TYR 4 HH TYR 4 12.201 5.765 3.789
30 HA PRO 5 HA PRO 5 5.495 7.195 -4.381
31 1HB PRO 5 HB2 PRO 5 3.697 9.251 -4.303
32 2HB PRO 5 HB3 PRO 5 3.425 7.710 -3.515
33 1HG PRO 5 HG2 PRO 5 4.158 10.306 -2.306
34 2HG PRO 5 HG3 PRO 5 3.477 8.889 -1.533
35 1HD PRO 5 HD2 PRO 5 6.208 9.757 -1.425
36 2HD PRO 5 HD3 PRO 5 5.550 8.279 -0.750
37 H VAL 6 HN VAL 6 5.322 7.951 -6.551
38 HA VAL 6 HA VAL 6 6.827 10.445 -6.916
39 HB VAL 6 HB VAL 6 8.090 9.530 -8.648
40 1HG1 VAL 6 HG11 VAL 6 9.325 7.749 -7.642
41 2HG1 VAL 6 HG12 VAL 6 8.717 8.774 -6.320
42 3HG1 VAL 6 HG13 VAL 6 7.918 7.225 -6.685
43 1HG2 VAL 6 HG21 VAL 6 6.459 8.363 -9.933
44 2HG2 VAL 6 HG22 VAL 6 7.705 7.170 -9.494
45 3HG2 VAL 6 HG23 VAL 6 6.154 7.199 -8.621
46 H ASP 7 HN ASP 7 5.961 11.876 -8.432
47 HA ASP 7 HA ASP 7 4.634 10.937 -10.656
48 1HB ASP 7 HB2 ASP 7 2.408 12.292 -9.981
49 2HB ASP 7 HB3 ASP 7 2.575 10.575 -9.674
50 HD2 ASP 7 HD2 ASP 7 2.748 9.927 -7.696
51 H SER 8 HN SER 8 4.350 13.789 -8.302
52 HA SER 8 HA SER 8 3.444 15.193 -10.607
53 1HB SER 8 HB2 SER 8 3.123 17.042 -8.740
54 2HB SER 8 HB3 SER 8 2.070 15.642 -8.784
55 HG SER 8 HG SER 8 3.005 14.804 -6.991
56 H LYS 9 HN LYS 9 6.416 14.841 -8.858
57 HA LYS 9 HA LYS 9 7.473 17.139 -10.350
58 1HB LYS 9 HB2 LYS 9 9.133 17.440 -8.557
59 2HB LYS 9 HB3 LYS 9 7.493 17.698 -7.998
60 1HG LYS 9 HG2 LYS 9 8.330 14.878 -7.734
61 2HG LYS 9 HG3 LYS 9 9.380 15.966 -6.848
62 1HD LYS 9 HD2 LYS 9 6.353 16.180 -6.632
63 2HD LYS 9 HD3 LYS 9 7.254 15.053 -5.637
64 1HE LYS 9 HE2 LYS 9 8.069 17.978 -5.768
65 2HE LYS 9 HE3 LYS 9 6.774 17.465 -4.705
66 1HZ LYS 9 HZ1 LYS 9 9.294 15.965 -4.602
67 2HZ LYS 9 HZ2 LYS 9 9.258 17.431 -3.893
68 H GLY 10 HN GLY 10 7.046 14.083 -10.811
69 1HA GLY 10 HA1 GLY 10 8.218 12.688 -12.197
70 2HA GLY 10 HA2 GLY 10 9.662 13.658 -11.987
71 H CYS 11 HN CYS 11 10.498 13.661 -9.529
72 HA CYS 11 HA CYS 11 10.422 10.855 -8.685
73 1HB CYS 11 HB2 CYS 11 12.792 12.721 -8.857
74 2HB CYS 11 HB3 CYS 11 12.811 11.220 -7.952
75 H LYS 12 HN LYS 12 9.210 10.914 -6.725
76 HA LYS 12 HA LYS 12 9.490 10.805 -4.527
77 1HB LYS 12 HB2 LYS 12 11.977 12.450 -5.057
78 2HB LYS 12 HB3 LYS 12 11.508 11.906 -3.459
79 1HG LYS 12 HG2 LYS 12 11.668 9.908 -5.734
80 2HG LYS 12 HG3 LYS 12 13.137 10.422 -4.929
81 1HD LYS 12 HD2 LYS 12 12.425 9.558 -2.811
82 2HD LYS 12 HD3 LYS 12 10.750 9.454 -3.316
83 1HE LYS 12 HE2 LYS 12 12.924 7.818 -4.686
84 2HE LYS 12 HE3 LYS 12 12.126 7.243 -3.235
85 1HZ LYS 12 HZ1 LYS 12 9.972 7.579 -4.464
86 2HZ LYS 12 HZ2 LYS 12 10.820 7.876 -5.822
87 H LEU 13 HN LEU 13 7.594 11.793 -3.818
88 HA LEU 13 HA LEU 13 7.440 14.580 -3.402
89 1HB LEU 13 HB2 LEU 13 6.079 12.149 -2.321
90 2HB LEU 13 HB3 LEU 13 5.879 13.675 -1.482
91 HG LEU 13 HG LEU 13 5.144 14.656 -3.729
92 1HD1 LEU 13 HD11 LEU 13 4.212 13.028 -5.348
93 2HD1 LEU 13 HD12 LEU 13 5.985 12.952 -5.216
94 3HD1 LEU 13 HD13 LEU 13 4.981 11.712 -4.427
95 1HD2 LEU 13 HD21 LEU 13 3.421 12.525 -2.433
96 2HD2 LEU 13 HD22 LEU 13 3.605 14.208 -1.882
97 3HD2 LEU 13 HD23 LEU 13 2.847 13.864 -3.456
98 H SER 14 HN SER 14 8.833 15.791 -2.222
99 HA SER 14 HA SER 14 10.382 14.298 -0.254
100 1HB SER 14 HB2 SER 14 11.188 16.667 -1.998
101 2HB SER 14 HB3 SER 14 12.206 15.978 -0.749
102 HG SER 14 HG SER 14 11.991 13.884 -1.938
103 H CYS 15 HN CYS 15 9.635 14.827 1.780
104 HA CYS 15 HA CYS 15 8.455 17.307 2.373
105 1HB CYS 15 HB2 CYS 15 8.657 16.586 4.723
106 2HB CYS 15 HB3 CYS 15 7.893 15.400 3.684
107 H VAL 16 HN VAL 16 9.384 19.023 3.773
108 HA VAL 16 HA VAL 16 12.316 18.978 3.873
109 HB VAL 16 HB VAL 16 12.277 21.399 3.380
110 1HG1 VAL 16 HG11 VAL 16 11.030 19.691 1.200
111 2HG1 VAL 16 HG12 VAL 16 11.971 21.184 0.970
112 3HG1 VAL 16 HG13 VAL 16 12.759 19.727 1.622
113 1HG2 VAL 16 HG21 VAL 16 9.374 20.951 2.609
114 2HG2 VAL 16 HG22 VAL 16 9.926 21.820 4.061
115 3HG2 VAL 16 HG23 VAL 16 10.304 22.460 2.444
116 H ALA 17 HN ALA 17 9.883 18.399 5.733
117 HA ALA 17 HA ALA 17 11.014 19.570 8.036
118 1HB ALA 17 HB1 ALA 17 10.005 21.626 7.521
119 2HB ALA 17 HB2 ALA 17 8.565 20.854 6.816
120 3HB ALA 17 HB3 ALA 17 8.802 20.851 8.580
121 H ASN 18 HN ASN 18 9.719 18.886 10.031
122 HA ASN 18 HA ASN 18 9.682 16.163 9.622
123 1HB ASN 18 HB2 ASN 18 8.708 17.828 12.002
124 2HB ASN 18 HB3 ASN 18 8.921 16.089 12.063
125 1HD2 ASN 18 HD21 ASN 18 12.051 18.676 12.390
126 2HD2 ASN 18 HD22 ASN 18 10.393 19.152 12.236
127 H ASN 19 HN ASN 19 7.087 18.628 10.046
128 HA ASN 19 HA ASN 19 5.105 16.646 10.507
129 1HB ASN 19 HB2 ASN 19 3.544 18.650 10.468
130 2HB ASN 19 HB3 ASN 19 4.869 18.822 11.602
131 1HD2 ASN 19 HD21 ASN 19 6.441 21.517 10.041
132 2HD2 ASN 19 HD22 ASN 19 6.422 20.338 11.310
133 H TYR 20 HN TYR 20 6.616 18.158 7.733
134 HA TYR 20 HA TYR 20 4.333 19.052 6.399
135 1HB TYR 20 HB2 TYR 20 6.812 19.705 6.134
136 2HB TYR 20 HB3 TYR 20 7.097 18.153 5.371
137 HD1 TYR 20 HD1 TYR 20 5.701 21.510 4.943
138 HD2 TYR 20 HD2 TYR 20 6.235 17.684 3.105
139 HE1 TYR 20 HE1 TYR 20 5.119 22.508 2.678
140 HE2 TYR 20 HE2 TYR 20 5.651 18.695 0.847
141 HH TYR 20 HH TYR 20 5.131 20.479 -0.243
142 H CYS 21 HN CYS 21 6.053 15.919 6.381
143 HA CYS 21 HA CYS 21 5.117 14.989 3.951
144 1HB CYS 21 HB2 CYS 21 6.936 13.918 5.100
145 2HB CYS 21 HB3 CYS 21 5.913 13.513 6.464
146 H ASP 22 HN ASP 22 3.687 15.043 7.263
147 HA ASP 22 HA ASP 22 2.036 12.879 6.876
148 1HB ASP 22 HB2 ASP 22 2.672 13.998 9.073
149 2HB ASP 22 HB3 ASP 22 1.539 15.280 8.697
150 HD2 ASP 22 HD2 ASP 22 1.761 11.940 9.022
151 H ASN 23 HN ASN 23 1.390 16.461 6.733
152 HA ASN 23 HA ASN 23 -1.287 16.179 6.022
153 1HB ASN 23 HB2 ASN 23 -0.945 18.625 5.200
154 2HB ASN 23 HB3 ASN 23 -0.618 18.310 6.892
155 1HD2 ASN 23 HD21 ASN 23 2.315 19.441 4.266
156 2HD2 ASN 23 HD22 ASN 23 0.679 19.119 3.798
157 H GLN 24 HN GLN 24 1.815 16.475 4.216
158 HA GLN 24 HA GLN 24 0.768 17.030 1.734
159 1HB GLN 24 HB2 GLN 24 3.170 17.219 2.326
160 2HB GLN 24 HB3 GLN 24 3.291 15.475 2.457
161 1HG GLN 24 HG2 GLN 24 2.608 15.274 0.037
162 2HG GLN 24 HG3 GLN 24 2.572 17.022 -0.079
163 1HE2 GLN 24 HE21 GLN 24 5.828 16.648 -1.354
164 2HE2 GLN 24 HE22 GLN 24 4.146 16.829 -1.728
165 H CYS 25 HN CYS 25 1.105 13.960 3.526
166 HA CYS 25 HA CYS 25 0.655 12.394 1.165
167 1HB CYS 25 HB2 CYS 25 0.870 11.596 4.075
168 2HB CYS 25 HB3 CYS 25 0.738 10.478 2.732
169 H LYS 26 HN LYS 26 -1.109 13.377 4.192
170 HA LYS 26 HA LYS 26 -3.016 11.304 3.806
171 1HB LYS 26 HB2 LYS 26 -3.819 11.886 5.917
172 2HB LYS 26 HB3 LYS 26 -2.109 12.256 6.008
173 1HG LYS 26 HG2 LYS 26 -2.824 14.672 5.234
174 2HG LYS 26 HG3 LYS 26 -4.436 14.184 5.717
175 1HD LYS 26 HD2 LYS 26 -1.961 14.146 7.509
176 2HD LYS 26 HD3 LYS 26 -3.243 15.340 7.571
177 1HE LYS 26 HE2 LYS 26 -3.537 12.352 8.141
178 2HE LYS 26 HE3 LYS 26 -3.583 13.640 9.329
179 1HZ LYS 26 HZ1 LYS 26 -5.824 12.918 8.637
180 2HZ LYS 26 HZ2 LYS 26 -5.595 14.490 8.281
181 H MET 27 HN MET 27 -2.673 14.601 2.710
182 HA MET 27 HA MET 27 -5.336 15.357 2.841
183 1HB MET 27 HB2 MET 27 -4.613 17.208 1.384
184 2HB MET 27 HB3 MET 27 -3.317 16.866 2.512
185 1HG MET 27 HG2 MET 27 -2.303 15.336 0.696
186 2HG MET 27 HG3 MET 27 -3.488 16.000 -0.410
187 1HE MET 27 HE1 MET 27 -1.975 17.179 -2.094
188 2HE MET 27 HE2 MET 27 -0.465 18.006 -1.641
189 3HE MET 27 HE3 MET 27 -0.671 16.273 -1.289
190 H LYS 28 HN LYS 28 -3.631 13.221 0.650
191 HA LYS 28 HA LYS 28 -5.974 12.871 -0.965
192 1HB LYS 28 HB2 LYS 28 -4.979 14.928 -1.940
193 2HB LYS 28 HB3 LYS 28 -3.491 14.054 -2.243
194 1HG LYS 28 HG2 LYS 28 -5.958 12.712 -3.257
195 2HG LYS 28 HG3 LYS 28 -5.580 14.237 -4.033
196 1HD LYS 28 HD2 LYS 28 -3.285 12.343 -3.646
197 2HD LYS 28 HD3 LYS 28 -4.499 11.860 -4.814
198 1HE LYS 28 HE2 LYS 28 -2.819 13.138 -6.010
199 2HE LYS 28 HE3 LYS 28 -4.261 14.131 -5.924
200 1HZ LYS 28 HZ1 LYS 28 -2.043 15.205 -5.272
201 2HZ LYS 28 HZ2 LYS 28 -3.296 15.471 -4.265
202 H LYS 29 HN LYS 29 -2.382 12.336 -0.682
203 HA LYS 29 HA LYS 29 -2.451 10.289 -2.587
204 1HB LYS 29 HB2 LYS 29 -0.377 11.107 -0.537
205 2HB LYS 29 HB3 LYS 29 -0.104 9.856 -1.733
206 1HG LYS 29 HG2 LYS 29 -1.095 12.600 -2.581
207 2HG LYS 29 HG3 LYS 29 0.611 12.325 -2.288
208 1HD LYS 29 HD2 LYS 29 0.589 10.445 -3.947
209 2HD LYS 29 HD3 LYS 29 -1.114 10.732 -4.244
210 1HE LYS 29 HE2 LYS 29 -0.461 13.156 -4.870
211 2HE LYS 29 HE3 LYS 29 1.207 12.618 -4.843
212 1HZ LYS 29 HZ1 LYS 29 0.142 12.467 -7.073
213 2HZ LYS 29 HZ2 LYS 29 0.715 11.028 -6.573
214 H ALA 30 HN ALA 30 -2.471 10.238 1.042
215 HA ALA 30 HA ALA 30 -2.750 7.332 0.892
216 1HB ALA 30 HB1 ALA 30 -0.669 8.630 2.667
217 2HB ALA 30 HB2 ALA 30 -0.811 6.926 2.173
218 3HB ALA 30 HB3 ALA 30 -0.289 8.154 0.995
219 H SER 31 HN SER 31 -2.757 6.597 3.460
220 HA SER 31 HA SER 31 -4.923 8.067 4.575
221 1HB SER 31 HB2 SER 31 -4.858 5.615 4.748
222 2HB SER 31 HB3 SER 31 -3.326 5.678 5.596
223 HG SER 31 HG SER 31 -5.855 6.729 6.543
224 H GLY 32 HN GLY 32 -1.407 7.642 5.123
225 1HA GLY 32 HA1 GLY 32 -1.382 10.059 6.732
226 2HA GLY 32 HA2 GLY 32 -0.910 8.596 7.573
227 H GLY 33 HN GLY 33 1.208 9.848 7.746
228 1HA GLY 33 HA1 GLY 33 3.118 8.602 6.164
229 2HA GLY 33 HA2 GLY 33 2.848 10.184 5.460
230 H HIS 34 HN HIS 34 5.341 9.437 6.624
231 HA HIS 34 HA HIS 34 5.433 11.585 8.569
232 1HB HIS 34 HB2 HIS 34 5.301 9.681 10.010
233 2HB HIS 34 HB3 HIS 34 6.478 8.791 9.064
234 HD1 HIS 34 HD1 HIS 34 6.468 12.166 10.914
235 HD2 HIS 34 HD2 HIS 34 8.909 8.814 10.280
236 HE1 HIS 34 HE1 HIS 34 8.596 12.566 12.263
237 H CYS 35 HN CYS 35 7.593 12.579 8.711
238 HA CYS 35 HA CYS 35 8.652 12.571 6.042
239 1HB CYS 35 HB2 CYS 35 8.103 14.678 7.130
240 2HB CYS 35 HB3 CYS 35 9.229 14.337 8.429
241 H TYR 36 HN TYR 36 9.704 10.388 6.152
242 HA TYR 36 HA TYR 36 12.066 10.067 7.654
243 1HB TYR 36 HB2 TYR 36 10.780 8.354 6.250
244 2HB TYR 36 HB3 TYR 36 11.233 9.234 4.803
245 HD1 TYR 36 HD1 TYR 36 12.744 7.452 7.730
246 HD2 TYR 36 HD2 TYR 36 13.184 8.652 3.646
247 HE1 TYR 36 HE1 TYR 36 14.867 6.066 7.543
248 HE2 TYR 36 HE2 TYR 36 15.305 7.262 3.474
249 HH TYR 36 HH TYR 36 16.659 5.917 4.474
250 H ALA 37 HN ALA 37 14.338 10.237 6.787
251 HA ALA 37 HA ALA 37 14.591 12.996 6.583
252 1HB ALA 37 HB1 ALA 37 16.642 10.775 6.206
253 2HB ALA 37 HB2 ALA 37 17.023 12.490 6.494
254 3HB ALA 37 HB3 ALA 37 16.188 11.542 7.747
255 H MET 38 HN MET 38 14.810 10.374 4.139
256 HA MET 38 HA MET 38 16.158 12.028 2.291
257 1HB MET 38 HB2 MET 38 16.196 9.437 2.512
258 2HB MET 38 HB3 MET 38 14.620 9.434 1.745
259 1HG MET 38 HG2 MET 38 16.820 10.977 0.377
260 2HG MET 38 HG3 MET 38 16.906 9.227 0.318
261 1HE MET 38 HE1 MET 38 16.029 11.983 -1.751
262 2HE MET 38 HE2 MET 38 16.784 10.480 -2.333
263 3HE MET 38 HE3 MET 38 15.221 11.008 -3.002
264 H SER 39 HN SER 39 12.756 11.008 2.827
265 HA SER 39 HA SER 39 11.745 13.131 1.349
266 1HB SER 39 HB2 SER 39 12.174 10.557 -0.125
267 2HB SER 39 HB3 SER 39 10.631 11.347 -0.377
268 HG SER 39 HG SER 39 13.246 12.533 -0.767
269 H CYS 40 HN CYS 40 9.220 12.669 0.913
270 HA CYS 40 HA CYS 40 8.279 12.097 3.492
271 1HB CYS 40 HB2 CYS 40 7.192 13.780 2.222
272 2HB CYS 40 HB3 CYS 40 6.899 12.694 0.878
273 H TYR 41 HN TYR 41 8.378 9.968 4.225
274 HA TYR 41 HA TYR 41 7.608 7.788 2.529
275 1HB TYR 41 HB2 TYR 41 9.236 7.764 4.516
276 2HB TYR 41 HB3 TYR 41 7.897 8.149 5.578
277 HD1 TYR 41 HD1 TYR 41 9.018 5.562 3.113
278 HD2 TYR 41 HD2 TYR 41 6.680 6.424 6.591
279 HE1 TYR 41 HE1 TYR 41 8.534 3.084 3.411
280 HE2 TYR 41 HE2 TYR 41 6.204 3.943 6.877
281 HH TYR 41 HH TYR 41 7.587 1.570 4.617
282 H CYS 42 HN CYS 42 5.495 7.919 1.789
283 HA CYS 42 HA CYS 42 3.466 8.813 3.630
284 1HB CYS 42 HB2 CYS 42 3.394 8.069 0.702
285 2HB CYS 42 HB3 CYS 42 1.969 8.514 1.620
286 H GLU 43 HN GLU 43 1.538 7.454 4.115
287 HA GLU 43 HA GLU 43 2.315 4.646 4.102
288 1HB GLU 43 HB2 GLU 43 1.529 6.368 6.483
289 2HB GLU 43 HB3 GLU 43 1.442 4.618 6.536
290 1HG GLU 43 HG2 GLU 43 3.858 4.449 5.997
291 2HG GLU 43 HG3 GLU 43 3.967 6.191 5.836
292 HE2 GLU 43 HE2 GLU 43 3.963 6.716 9.295
293 H GLY 44 HN GLY 44 0.670 3.296 3.484
294 1HA GLY 44 HA1 GLY 44 -1.479 2.542 3.258
295 2HA GLY 44 HA2 GLY 44 -2.093 4.013 3.985
296 H LEU 45 HN LEU 45 0.187 3.691 1.189
297 HA LEU 45 HA LEU 45 -1.502 5.268 -0.476
298 1HB LEU 45 HB2 LEU 45 1.003 3.661 -0.959
299 2HB LEU 45 HB3 LEU 45 0.171 4.531 -2.232
300 HG LEU 45 HG LEU 45 1.062 5.949 0.274
301 1HD1 LEU 45 HD11 LEU 45 2.755 5.459 -2.192
302 2HD1 LEU 45 HD12 LEU 45 3.164 6.539 -0.837
303 3HD1 LEU 45 HD13 LEU 45 3.034 4.784 -0.569
304 1HD2 LEU 45 HD21 LEU 45 0.579 6.888 -2.567
305 2HD2 LEU 45 HD22 LEU 45 -0.501 7.132 -1.173
306 3HD2 LEU 45 HD23 LEU 45 1.102 7.907 -1.204
307 HA PRO 46 HA PRO 46 -3.652 1.938 -2.430
308 1HB PRO 46 HB2 PRO 46 -4.170 3.040 -4.876
309 2HB PRO 46 HB3 PRO 46 -5.173 3.320 -3.467
310 1HG PRO 46 HG2 PRO 46 -3.223 5.137 -4.744
311 2HG PRO 46 HG3 PRO 46 -4.517 5.525 -3.628
312 1HD PRO 46 HD2 PRO 46 -1.719 5.362 -3.020
313 2HD PRO 46 HD3 PRO 46 -3.025 5.636 -1.883
314 H GLU 47 HN GLU 47 -3.527 0.325 -4.191
315 HA GLU 47 HA GLU 47 -0.798 -0.346 -4.081
316 1HB GLU 47 HB2 GLU 47 -3.213 -1.693 -5.356
317 2HB GLU 47 HB3 GLU 47 -1.613 -2.407 -5.382
318 1HG GLU 47 HG2 GLU 47 -1.533 -2.345 -2.887
319 2HG GLU 47 HG3 GLU 47 -3.120 -1.601 -2.848
320 HE2 GLU 47 HE2 GLU 47 -2.811 -5.522 -3.552
321 H ASN 48 HN ASN 48 -2.758 1.392 -6.351
322 HA ASN 48 HA ASN 48 -1.381 0.446 -8.655
323 1HB ASN 48 HB2 ASN 48 -2.795 2.122 -9.857
324 2HB ASN 48 HB3 ASN 48 -3.766 1.132 -8.786
325 1HD2 ASN 48 HD21 ASN 48 -5.033 3.754 -6.937
326 2HD2 ASN 48 HD22 ASN 48 -5.025 2.073 -7.352
327 H ALA 49 HN ALA 49 -0.723 2.644 -6.137
328 HA ALA 49 HA ALA 49 0.361 4.789 -7.683
329 1HB ALA 49 HB1 ALA 49 -0.646 5.068 -5.426
330 2HB ALA 49 HB2 ALA 49 0.667 4.084 -4.736
331 3HB ALA 49 HB3 ALA 49 1.033 5.654 -5.490
332 H LYS 50 HN LYS 50 2.608 5.346 -7.902
333 HA LYS 50 HA LYS 50 4.314 2.970 -7.805
334 1HB LYS 50 HB2 LYS 50 4.071 3.893 -10.014
335 2HB LYS 50 HB3 LYS 50 4.446 5.509 -9.451
336 1HG LYS 50 HG2 LYS 50 6.460 4.628 -10.463
337 2HG LYS 50 HG3 LYS 50 6.733 4.670 -8.733
338 1HD LYS 50 HD2 LYS 50 6.282 2.273 -8.530
339 2HD LYS 50 HD3 LYS 50 5.748 2.179 -10.196
340 1HE LYS 50 HE2 LYS 50 8.043 1.336 -10.055
341 2HE LYS 50 HE3 LYS 50 8.049 2.837 -10.960
342 1HZ LYS 50 HZ1 LYS 50 8.879 4.001 -9.066
343 2HZ LYS 50 HZ2 LYS 50 8.601 2.761 -8.048
344 H VAL 51 HN VAL 51 5.899 2.816 -6.308
345 HA VAL 51 HA VAL 51 6.797 5.320 -5.073
346 HB VAL 51 HB VAL 51 6.608 4.452 -2.920
347 1HG1 VAL 51 HG11 VAL 51 4.439 5.113 -3.908
348 2HG1 VAL 51 HG12 VAL 51 4.156 3.423 -4.389
349 3HG1 VAL 51 HG13 VAL 51 4.258 3.852 -2.664
350 1HG2 VAL 51 HG21 VAL 51 5.914 2.058 -2.482
351 2HG2 VAL 51 HG22 VAL 51 6.208 1.737 -4.208
352 3HG2 VAL 51 HG23 VAL 51 7.545 2.270 -3.161
353 H SER 52 HN SER 52 9.108 5.100 -4.134
354 HA SER 52 HA SER 52 10.052 2.365 -4.501
355 1HB SER 52 HB2 SER 52 11.682 3.844 -5.439
356 2HB SER 52 HB3 SER 52 11.541 4.982 -4.115
357 HG SER 52 HG SER 52 13.433 3.297 -4.255
358 H ASP 53 HN ASP 53 11.061 1.329 -2.577
359 HA ASP 53 HA ASP 53 10.755 2.821 -0.124
360 1HB ASP 53 HB2 ASP 53 9.834 0.766 1.018
361 2HB ASP 53 HB3 ASP 53 8.731 1.485 -0.139
362 HD2 ASP 53 HD2 ASP 53 8.077 -0.682 0.419
363 H SER 54 HN SER 54 13.072 2.178 -1.781
364 HA SER 54 HA SER 54 14.470 0.357 -0.036
365 1HB SER 54 HB2 SER 54 15.424 -0.808 -2.138
366 2HB SER 54 HB3 SER 54 13.800 -1.245 -1.645
367 HG SER 54 HG SER 54 13.752 -0.867 -3.880
368 H ALA 55 HN ALA 55 15.070 2.851 0.287
369 HA ALA 55 HA ALA 55 16.589 4.451 0.113
370 1HB ALA 55 HB1 ALA 55 18.288 2.306 -1.221
371 2HB ALA 55 HB2 ALA 55 18.872 3.766 -0.387
372 3HB ALA 55 HB3 ALA 55 18.067 2.474 0.537
373 H THR 56 HN THR 56 14.593 4.510 -1.869
374 HA THR 56 HA THR 56 14.207 5.986 -3.498
375 HB THR 56 HB THR 56 17.195 6.466 -3.821
376 HG1 THR 56 HG1 THR 56 17.026 7.656 -1.843
377 1HG2 THR 56 HG21 THR 56 15.329 7.754 -5.131
378 2HG2 THR 56 HG22 THR 56 14.913 8.469 -3.555
379 3HG2 THR 56 HG23 THR 56 16.530 8.730 -4.252
380 H ASN 57 HN ASN 57 17.379 4.538 -4.529
381 HA ASN 57 HA ASN 57 17.954 4.143 -6.625
382 1HB ASN 57 HB2 ASN 57 16.855 2.019 -7.502
383 2HB ASN 57 HB3 ASN 57 17.399 1.897 -5.841
384 1HD2 ASN 57 HD21 ASN 57 14.314 1.295 -4.423
385 2HD2 ASN 57 HD22 ASN 57 15.912 1.902 -4.143
386 H ILE 58 HN ILE 58 16.192 6.392 -6.613
387 HA ILE 58 HA ILE 58 15.039 6.072 -9.258
388 HB ILE 58 HB ILE 58 13.501 6.661 -6.777
389 1HG1 ILE 58 HG12 ILE 58 12.888 5.213 -9.369
390 2HG1 ILE 58 HG13 ILE 58 13.303 4.475 -7.835
391 1HG2 ILE 58 HG21 ILE 58 13.318 8.759 -7.997
392 2HG2 ILE 58 HG22 ILE 58 12.853 7.882 -9.474
393 3HG2 ILE 58 HG23 ILE 58 11.781 7.863 -8.053
394 1HD1 ILE 58 HD11 ILE 58 10.944 4.353 -7.860
395 2HD1 ILE 58 HD12 ILE 58 11.252 5.808 -6.881
396 3HD1 ILE 58 HD13 ILE 58 10.776 5.969 -8.589
397 H CYS 59 HN CYS 59 15.071 8.038 -10.481
398 HA CYS 59 HA CYS 59 16.534 9.522 -11.220
399 1HB CYS 59 HB2 CYS 59 15.380 10.789 -8.763
400 2HB CYS 59 HB3 CYS 59 16.641 11.627 -9.646
401 H GLY 60 HN GLY 60 18.090 7.558 -10.480
402 1HA GLY 60 HA1 GLY 60 19.728 7.922 -8.207
403 2HA GLY 60 HA2 GLY 60 20.042 6.885 -9.584
Start of MODEL 7
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 -1.031 -0.133
3 1HB LYS 1 HB2 LYS 1 1.379 0.603 -2.070
4 2HB LYS 1 HB3 LYS 1 1.908 1.868 -0.979
5 1HG LYS 1 HG2 LYS 1 3.962 1.306 -1.899
6 2HG LYS 1 HG3 LYS 1 3.956 0.189 -0.548
7 1HD LYS 1 HD2 LYS 1 3.167 -1.640 -1.970
8 2HD LYS 1 HD3 LYS 1 2.901 -0.548 -3.315
9 1HE LYS 1 HE2 LYS 1 5.384 -0.025 -3.319
10 2HE LYS 1 HE3 LYS 1 5.605 -1.227 -2.063
11 1HZ LYS 1 HZ1 LYS 1 4.555 -1.752 -4.792
12 2HZ LYS 1 HZ2 LYS 1 5.995 -2.238 -4.205
13 H ASP 2 HN ASP 2 2.366 -1.427 1.962
14 HA ASP 2 HA ASP 2 3.248 0.879 3.441
15 1HB ASP 2 HB2 ASP 2 1.373 -1.201 4.660
16 2HB ASP 2 HB3 ASP 2 2.076 0.165 5.503
17 HD2 ASP 2 HD2 ASP 2 0.036 -0.710 2.987
18 H GLY 3 HN GLY 3 4.994 0.299 4.892
19 1HA GLY 3 HA1 GLY 3 5.674 -1.984 6.073
20 2HA GLY 3 HA2 GLY 3 6.123 -2.343 4.418
21 H TYR 4 HN TYR 4 8.370 -2.315 4.569
22 HA TYR 4 HA TYR 4 9.559 0.122 5.699
23 1HB TYR 4 HB2 TYR 4 10.920 -2.521 4.960
24 2HB TYR 4 HB3 TYR 4 11.449 -1.355 6.157
25 HD1 TYR 4 HD1 TYR 4 9.980 -1.071 8.274
26 HD2 TYR 4 HD2 TYR 4 9.649 -4.394 5.600
27 HE1 TYR 4 HE1 TYR 4 8.834 -2.429 10.093
28 HE2 TYR 4 HE2 TYR 4 8.505 -5.741 7.428
29 HH TYR 4 HH TYR 4 7.703 -5.732 9.432
30 HA PRO 5 HA PRO 5 10.003 0.795 1.411
31 1HB PRO 5 HB2 PRO 5 10.492 3.483 1.485
32 2HB PRO 5 HB3 PRO 5 8.878 2.801 1.526
33 1HG PRO 5 HG2 PRO 5 10.445 3.987 3.734
34 2HG PRO 5 HG3 PRO 5 8.720 3.697 3.645
35 1HD PRO 5 HD2 PRO 5 10.648 2.146 5.096
36 2HD PRO 5 HD3 PRO 5 8.942 1.791 4.911
37 H VAL 6 HN VAL 6 11.554 0.944 -0.216
38 HA VAL 6 HA VAL 6 14.144 1.903 0.691
39 HB VAL 6 HB VAL 6 14.445 -0.371 1.138
40 1HG1 VAL 6 HG11 VAL 6 12.469 -1.341 0.202
41 2HG1 VAL 6 HG12 VAL 6 12.970 -0.923 -1.454
42 3HG1 VAL 6 HG13 VAL 6 13.861 -2.165 -0.542
43 1HG2 VAL 6 HG21 VAL 6 16.139 -1.068 -0.401
44 2HG2 VAL 6 HG22 VAL 6 15.428 -0.105 -1.718
45 3HG2 VAL 6 HG23 VAL 6 16.189 0.710 -0.331
46 H ASP 7 HN ASP 7 14.856 3.368 -0.773
47 HA ASP 7 HA ASP 7 14.908 2.659 -3.482
48 1HB ASP 7 HB2 ASP 7 13.663 5.038 -3.971
49 2HB ASP 7 HB3 ASP 7 12.842 3.491 -4.027
50 HD2 ASP 7 HD2 ASP 7 12.095 5.940 -0.939
51 H SER 8 HN SER 8 14.472 5.833 -1.733
52 HA SER 8 HA SER 8 16.834 6.803 -2.999
53 1HB SER 8 HB2 SER 8 16.242 8.942 -1.825
54 2HB SER 8 HB3 SER 8 14.933 8.302 -2.798
55 HG SER 8 HG SER 8 14.211 9.000 -0.681
56 H LYS 9 HN LYS 9 16.000 5.202 -0.032
57 HA LYS 9 HA LYS 9 18.138 6.508 1.455
58 1HB LYS 9 HB2 LYS 9 17.132 5.347 3.403
59 2HB LYS 9 HB3 LYS 9 16.022 6.427 2.585
60 1HG LYS 9 HG2 LYS 9 15.969 3.675 1.490
61 2HG LYS 9 HG3 LYS 9 15.534 3.743 3.186
62 1HD LYS 9 HD2 LYS 9 14.301 5.675 1.188
63 2HD LYS 9 HD3 LYS 9 13.646 4.062 1.395
64 1HE LYS 9 HE2 LYS 9 13.216 4.468 3.775
65 2HE LYS 9 HE3 LYS 9 14.063 6.002 3.717
66 1HZ LYS 9 HZ1 LYS 9 12.362 6.875 2.262
67 2HZ LYS 9 HZ2 LYS 9 11.626 5.429 2.117
68 H GLY 10 HN GLY 10 17.491 3.684 -0.453
69 1HA GLY 10 HA1 GLY 10 19.205 2.455 -1.340
70 2HA GLY 10 HA2 GLY 10 20.293 3.038 -0.096
71 H CYS 11 HN CYS 11 19.634 2.265 2.269
72 HA CYS 11 HA CYS 11 18.719 -0.501 2.101
73 1HB CYS 11 HB2 CYS 11 21.318 0.445 3.313
74 2HB CYS 11 HB3 CYS 11 20.579 -1.091 3.720
75 H LYS 12 HN LYS 12 17.026 1.510 2.890
76 HA LYS 12 HA LYS 12 15.508 1.704 4.485
77 1HB LYS 12 HB2 LYS 12 16.565 -0.781 4.977
78 2HB LYS 12 HB3 LYS 12 16.792 0.005 6.526
79 1HG LYS 12 HG2 LYS 12 14.611 -0.881 6.710
80 2HG LYS 12 HG3 LYS 12 14.311 0.792 6.282
81 1HD LYS 12 HD2 LYS 12 12.932 -0.244 4.726
82 2HD LYS 12 HD3 LYS 12 14.406 -0.158 3.782
83 1HE LYS 12 HE2 LYS 12 14.989 -2.499 4.664
84 2HE LYS 12 HE3 LYS 12 13.380 -2.566 5.353
85 1HZ LYS 12 HZ1 LYS 12 12.540 -2.097 3.036
86 2HZ LYS 12 HZ2 LYS 12 14.054 -2.315 2.476
87 H LEU 13 HN LEU 13 15.149 2.800 6.633
88 HA LEU 13 HA LEU 13 17.338 4.425 7.473
89 1HB LEU 13 HB2 LEU 13 14.503 3.990 8.276
90 2HB LEU 13 HB3 LEU 13 15.585 4.700 9.457
91 HG LEU 13 HG LEU 13 16.162 6.482 7.804
92 1HD1 LEU 13 HD11 LEU 13 15.711 5.395 5.722
93 2HD1 LEU 13 HD12 LEU 13 14.005 5.137 6.159
94 3HD1 LEU 13 HD13 LEU 13 14.609 6.786 5.865
95 1HD2 LEU 13 HD21 LEU 13 14.485 6.835 9.563
96 2HD2 LEU 13 HD22 LEU 13 14.100 7.745 8.083
97 3HD2 LEU 13 HD23 LEU 13 13.213 6.250 8.465
98 H SER 14 HN SER 14 16.035 1.227 8.266
99 HA SER 14 HA SER 14 16.702 -0.319 9.649
100 1HB SER 14 HB2 SER 14 18.991 1.369 10.698
101 2HB SER 14 HB3 SER 14 18.896 -0.376 10.567
102 HG SER 14 HG SER 14 19.511 1.561 8.585
103 H CYS 15 HN CYS 15 17.528 2.853 11.302
104 HA CYS 15 HA CYS 15 16.217 4.056 12.603
105 1HB CYS 15 HB2 CYS 15 13.964 3.812 12.638
106 2HB CYS 15 HB3 CYS 15 14.342 2.819 11.245
107 H VAL 16 HN VAL 16 16.410 4.309 14.842
108 HA VAL 16 HA VAL 16 16.425 1.866 16.452
109 HB VAL 16 HB VAL 16 18.751 2.613 15.803
110 1HG1 VAL 16 HG11 VAL 16 19.718 4.542 16.889
111 2HG1 VAL 16 HG12 VAL 16 18.285 5.062 15.970
112 3HG1 VAL 16 HG13 VAL 16 18.192 4.883 17.739
113 1HG2 VAL 16 HG21 VAL 16 18.211 1.178 17.772
114 2HG2 VAL 16 HG22 VAL 16 19.669 2.175 17.996
115 3HG2 VAL 16 HG23 VAL 16 18.140 2.646 18.776
116 H ALA 17 HN ALA 17 14.607 4.309 15.770
117 HA ALA 17 HA ALA 17 13.759 4.862 18.420
118 1HB ALA 17 HB1 ALA 17 14.218 7.380 18.180
119 2HB ALA 17 HB2 ALA 17 15.611 6.346 18.580
120 3HB ALA 17 HB3 ALA 17 15.388 6.933 16.915
121 H ASN 18 HN ASN 18 11.750 6.148 18.405
122 HA ASN 18 HA ASN 18 10.308 5.191 16.190
123 1HB ASN 18 HB2 ASN 18 9.337 7.052 18.420
124 2HB ASN 18 HB3 ASN 18 8.330 6.029 17.414
125 1HD2 ASN 18 HD21 ASN 18 9.349 2.930 18.931
126 2HD2 ASN 18 HD22 ASN 18 8.977 3.661 17.405
127 H ASN 19 HN ASN 19 11.225 8.428 17.530
128 HA ASN 19 HA ASN 19 9.730 9.936 15.760
129 1HB ASN 19 HB2 ASN 19 11.434 11.768 16.362
130 2HB ASN 19 HB3 ASN 19 10.646 11.005 17.729
131 1HD2 ASN 19 HD21 ASN 19 13.493 9.568 19.125
132 2HD2 ASN 19 HD22 ASN 19 11.780 9.826 19.166
133 H TYR 20 HN TYR 20 12.956 8.387 15.599
134 HA TYR 20 HA TYR 20 14.034 9.973 13.553
135 1HB TYR 20 HB2 TYR 20 15.228 8.421 15.185
136 2HB TYR 20 HB3 TYR 20 14.456 7.044 14.422
137 HD1 TYR 20 HD1 TYR 20 17.055 9.628 14.060
138 HD2 TYR 20 HD2 TYR 20 15.222 6.204 12.264
139 HE1 TYR 20 HE1 TYR 20 18.997 9.433 12.431
140 HE2 TYR 20 HE2 TYR 20 17.171 6.020 10.642
141 HH TYR 20 HH TYR 20 19.051 6.846 9.991
142 H CYS 21 HN CYS 21 12.022 6.996 13.542
143 HA CYS 21 HA CYS 21 12.164 6.728 10.715
144 1HB CYS 21 HB2 CYS 21 11.684 4.770 11.937
145 2HB CYS 21 HB3 CYS 21 10.405 5.542 12.852
146 H ASP 22 HN ASP 22 9.742 8.054 13.118
147 HA ASP 22 HA ASP 22 7.723 7.992 11.258
148 1HB ASP 22 HB2 ASP 22 7.453 8.112 13.755
149 2HB ASP 22 HB3 ASP 22 7.987 9.781 13.721
150 HD2 ASP 22 HD2 ASP 22 4.668 10.653 13.555
151 H ASN 23 HN ASN 23 9.992 10.594 12.314
152 HA ASN 23 HA ASN 23 8.618 12.722 11.257
153 1HB ASN 23 HB2 ASN 23 10.572 13.976 11.728
154 2HB ASN 23 HB3 ASN 23 10.760 12.603 12.800
155 1HD2 ASN 23 HD21 ASN 23 13.385 11.028 11.006
156 2HD2 ASN 23 HD22 ASN 23 12.111 10.846 12.165
157 H GLN 24 HN GLN 24 10.780 10.281 9.816
158 HA GLN 24 HA GLN 24 11.174 11.875 7.456
159 1HB GLN 24 HB2 GLN 24 13.040 10.540 8.466
160 2HB GLN 24 HB3 GLN 24 12.156 9.065 8.127
161 1HG GLN 24 HG2 GLN 24 12.401 9.294 5.779
162 2HG GLN 24 HG3 GLN 24 12.696 11.019 5.875
163 1HE2 GLN 24 HE21 GLN 24 15.873 9.167 5.152
164 2HE2 GLN 24 HE22 GLN 24 14.295 9.264 4.443
165 H CYS 25 HN CYS 25 9.238 9.141 8.630
166 HA CYS 25 HA CYS 25 8.319 8.218 6.174
167 1HB CYS 25 HB2 CYS 25 6.976 8.307 8.881
168 2HB CYS 25 HB3 CYS 25 6.316 7.472 7.489
169 H LYS 26 HN LYS 26 7.079 10.780 8.446
170 HA LYS 26 HA LYS 26 4.794 11.209 6.790
171 1HB LYS 26 HB2 LYS 26 4.161 12.836 8.483
172 2HB LYS 26 HB3 LYS 26 4.668 11.335 9.232
173 1HG LYS 26 HG2 LYS 26 6.371 12.360 10.336
174 2HG LYS 26 HG3 LYS 26 6.970 13.099 8.864
175 1HD LYS 26 HD2 LYS 26 4.526 14.190 10.318
176 2HD LYS 26 HD3 LYS 26 6.151 14.687 10.750
177 1HE LYS 26 HE2 LYS 26 6.526 15.366 8.329
178 2HE LYS 26 HE3 LYS 26 4.846 14.989 8.003
179 1HZ LYS 26 HZ1 LYS 26 5.174 17.355 8.533
180 2HZ LYS 26 HZ2 LYS 26 4.196 16.665 9.637
181 H MET 27 HN MET 27 8.063 12.227 6.700
182 HA MET 27 HA MET 27 7.916 14.891 6.247
183 1HB MET 27 HB2 MET 27 9.996 13.434 6.429
184 2HB MET 27 HB3 MET 27 9.707 12.860 4.799
185 1HG MET 27 HG2 MET 27 9.837 15.267 3.988
186 2HG MET 27 HG3 MET 27 10.270 15.752 5.615
187 1HE MET 27 HE1 MET 27 13.756 14.394 6.205
188 2HE MET 27 HE2 MET 27 12.509 15.587 6.641
189 3HE MET 27 HE3 MET 27 12.195 13.849 6.862
190 H LYS 28 HN LYS 28 7.466 12.203 3.864
191 HA LYS 28 HA LYS 28 6.010 13.773 2.059
192 1HB LYS 28 HB2 LYS 28 7.670 14.064 0.277
193 2HB LYS 28 HB3 LYS 28 8.084 14.986 1.708
194 1HG LYS 28 HG2 LYS 28 9.574 12.995 2.405
195 2HG LYS 28 HG3 LYS 28 9.308 12.345 0.800
196 1HD LYS 28 HD2 LYS 28 10.213 14.474 -0.192
197 2HD LYS 28 HD3 LYS 28 10.521 15.079 1.424
198 1HE LYS 28 HE2 LYS 28 12.615 14.175 0.764
199 2HE LYS 28 HE3 LYS 28 11.935 12.924 1.786
200 1HZ LYS 28 HZ1 LYS 28 12.827 12.116 -0.396
201 2HZ LYS 28 HZ2 LYS 28 11.275 11.692 -0.148
202 H LYS 29 HN LYS 29 8.344 11.070 2.549
203 HA LYS 29 HA LYS 29 7.596 9.538 0.383
204 1HB LYS 29 HB2 LYS 29 8.662 8.778 3.113
205 2HB LYS 29 HB3 LYS 29 8.446 7.619 1.818
206 1HG LYS 29 HG2 LYS 29 9.854 10.064 0.929
207 2HG LYS 29 HG3 LYS 29 10.701 9.231 2.218
208 1HD LYS 29 HD2 LYS 29 11.511 8.264 0.173
209 2HD LYS 29 HD3 LYS 29 10.437 7.068 0.872
210 1HE LYS 29 HE2 LYS 29 8.624 7.693 -0.639
211 2HE LYS 29 HE3 LYS 29 9.505 9.097 -1.208
212 1HZ LYS 29 HZ1 LYS 29 9.644 7.106 -2.700
213 2HZ LYS 29 HZ2 LYS 29 11.106 7.675 -2.263
214 H ALA 30 HN ALA 30 6.060 9.895 3.623
215 HA ALA 30 HA ALA 30 3.932 8.106 2.758
216 1HB ALA 30 HB1 ALA 30 5.817 6.741 3.774
217 2HB ALA 30 HB2 ALA 30 5.524 7.610 5.300
218 3HB ALA 30 HB3 ALA 30 4.246 6.590 4.597
219 H SER 31 HN SER 31 2.383 7.893 4.897
220 HA SER 31 HA SER 31 1.771 10.602 5.548
221 1HB SER 31 HB2 SER 31 0.459 8.021 6.509
222 2HB SER 31 HB3 SER 31 -0.212 9.632 6.665
223 HG SER 31 HG SER 31 -0.250 9.777 4.314
224 H GLY 32 HN GLY 32 3.373 7.801 7.012
225 1HA GLY 32 HA1 GLY 32 4.667 9.000 9.053
226 2HA GLY 32 HA2 GLY 32 3.071 8.741 9.728
227 H GLY 33 HN GLY 33 4.747 7.363 11.151
228 1HA GLY 33 HA1 GLY 33 3.725 4.908 11.280
229 2HA GLY 33 HA2 GLY 33 5.004 4.659 10.108
230 H HIS 34 HN HIS 34 6.505 3.441 11.385
231 HA HIS 34 HA HIS 34 7.135 4.503 14.004
232 1HB HIS 34 HB2 HIS 34 4.929 3.289 14.169
233 2HB HIS 34 HB3 HIS 34 5.764 1.819 13.706
234 HD1 HIS 34 HD1 HIS 34 5.424 4.269 16.556
235 HD2 HIS 34 HD2 HIS 34 7.369 0.649 15.710
236 HE1 HIS 34 HE1 HIS 34 6.299 3.389 18.786
237 H CYS 35 HN CYS 35 8.936 3.361 15.025
238 HA CYS 35 HA CYS 35 10.612 2.106 13.029
239 1HB CYS 35 HB2 CYS 35 11.647 3.834 14.307
240 2HB CYS 35 HB3 CYS 35 11.134 3.122 15.823
241 H TYR 36 HN TYR 36 10.055 -0.062 12.750
242 HA TYR 36 HA TYR 36 9.395 -1.558 15.198
243 1HB TYR 36 HB2 TYR 36 7.537 -1.067 13.509
244 2HB TYR 36 HB3 TYR 36 8.504 -1.822 12.257
245 HD1 TYR 36 HD1 TYR 36 6.453 -2.428 15.257
246 HD2 TYR 36 HD2 TYR 36 8.707 -4.243 12.106
247 HE1 TYR 36 HE1 TYR 36 5.409 -4.682 15.799
248 HE2 TYR 36 HE2 TYR 36 7.656 -6.491 12.659
249 HH TYR 36 HH TYR 36 5.290 -6.774 15.300
250 H ALA 37 HN ALA 37 10.702 -3.258 15.684
251 HA ALA 37 HA ALA 37 12.311 -4.786 15.453
252 1HB ALA 37 HB1 ALA 37 11.760 -6.520 13.813
253 2HB ALA 37 HB2 ALA 37 10.269 -5.891 14.554
254 3HB ALA 37 HB3 ALA 37 10.734 -5.376 12.915
255 H MET 38 HN MET 38 13.388 -2.376 14.761
256 HA MET 38 HA MET 38 15.133 -1.529 13.779
257 1HB MET 38 HB2 MET 38 15.936 -3.956 14.427
258 2HB MET 38 HB3 MET 38 15.821 -4.311 12.715
259 1HG MET 38 HG2 MET 38 18.100 -3.652 13.064
260 2HG MET 38 HG3 MET 38 17.339 -2.269 12.304
261 1HE MET 38 HE1 MET 38 19.550 -0.254 14.658
262 2HE MET 38 HE2 MET 38 19.859 -1.546 13.473
263 3HE MET 38 HE3 MET 38 18.691 -0.257 13.099
264 H SER 39 HN SER 39 12.655 -1.609 12.209
265 HA SER 39 HA SER 39 14.055 -0.614 9.935
266 1HB SER 39 HB2 SER 39 11.882 -2.728 9.616
267 2HB SER 39 HB3 SER 39 12.416 -1.693 8.306
268 HG SER 39 HG SER 39 14.678 -2.643 9.244
269 H CYS 40 HN CYS 40 12.853 1.100 8.880
270 HA CYS 40 HA CYS 40 10.971 2.283 10.666
271 1HB CYS 40 HB2 CYS 40 12.605 3.696 9.651
272 2HB CYS 40 HB3 CYS 40 12.169 3.165 8.039
273 H TYR 41 HN TYR 41 8.993 1.166 10.652
274 HA TYR 41 HA TYR 41 7.800 0.332 8.185
275 1HB TYR 41 HB2 TYR 41 7.571 -0.718 10.525
276 2HB TYR 41 HB3 TYR 41 6.736 0.730 11.051
277 HD1 TYR 41 HD1 TYR 41 6.506 -2.025 8.528
278 HD2 TYR 41 HD2 TYR 41 4.403 0.869 10.874
279 HE1 TYR 41 HE1 TYR 41 4.289 -3.026 7.788
280 HE2 TYR 41 HE2 TYR 41 2.193 -0.141 10.126
281 HH TYR 41 HH TYR 41 2.142 -2.944 7.938
282 H CYS 42 HN CYS 42 7.407 2.091 6.818
283 HA CYS 42 HA CYS 42 5.948 4.326 7.966
284 1HB CYS 42 HB2 CYS 42 7.190 3.976 5.229
285 2HB CYS 42 HB3 CYS 42 6.364 5.417 5.788
286 H GLU 43 HN GLU 43 3.956 5.096 6.777
287 HA GLU 43 HA GLU 43 2.581 2.813 5.603
288 1HB GLU 43 HB2 GLU 43 1.642 4.574 7.901
289 2HB GLU 43 HB3 GLU 43 0.536 3.587 6.967
290 1HG GLU 43 HG2 GLU 43 1.855 1.546 7.546
291 2HG GLU 43 HG3 GLU 43 2.980 2.527 8.463
292 HE2 GLU 43 HE2 GLU 43 0.860 2.755 11.203
293 H GLY 44 HN GLY 44 1.304 3.305 3.828
294 1HA GLY 44 HA1 GLY 44 -0.015 4.620 2.480
295 2HA GLY 44 HA2 GLY 44 0.398 6.039 3.422
296 H LEU 45 HN LEU 45 2.231 3.539 1.505
297 HA LEU 45 HA LEU 45 3.995 5.648 0.584
298 1HB LEU 45 HB2 LEU 45 4.037 2.644 0.487
299 2HB LEU 45 HB3 LEU 45 5.119 3.598 -0.508
300 HG LEU 45 HG LEU 45 6.132 2.790 1.611
301 1HD1 LEU 45 HD11 LEU 45 6.994 4.775 0.421
302 2HD1 LEU 45 HD12 LEU 45 5.954 5.809 1.429
303 3HD1 LEU 45 HD13 LEU 45 7.256 4.856 2.180
304 1HD2 LEU 45 HD21 LEU 45 5.503 3.642 3.741
305 2HD2 LEU 45 HD22 LEU 45 4.334 4.774 3.019
306 3HD2 LEU 45 HD23 LEU 45 4.025 3.022 2.966
307 HA PRO 46 HA PRO 46 2.381 5.370 -3.569
308 1HB PRO 46 HB2 PRO 46 4.580 6.192 -4.968
309 2HB PRO 46 HB3 PRO 46 3.391 7.301 -4.314
310 1HG PRO 46 HG2 PRO 46 6.113 6.708 -3.325
311 2HG PRO 46 HG3 PRO 46 5.089 8.083 -2.962
312 1HD PRO 46 HD2 PRO 46 5.592 5.823 -1.268
313 2HD PRO 46 HD3 PRO 46 4.479 7.140 -0.956
314 H GLU 47 HN GLU 47 2.610 4.098 -5.539
315 HA GLU 47 HA GLU 47 3.250 1.541 -4.657
316 1HB GLU 47 HB2 GLU 47 2.530 2.704 -7.367
317 2HB GLU 47 HB3 GLU 47 2.892 0.999 -7.186
318 1HG GLU 47 HG2 GLU 47 0.823 2.416 -5.451
319 2HG GLU 47 HG3 GLU 47 0.409 1.680 -6.987
320 HE2 GLU 47 HE2 GLU 47 1.406 -1.567 -5.611
321 H ASN 48 HN ASN 48 5.092 4.040 -6.354
322 HA ASN 48 HA ASN 48 6.825 2.251 -7.652
323 1HB ASN 48 HB2 ASN 48 8.168 4.334 -8.121
324 2HB ASN 48 HB3 ASN 48 6.472 4.530 -8.519
325 1HD2 ASN 48 HD21 ASN 48 5.977 7.267 -6.485
326 2HD2 ASN 48 HD22 ASN 48 5.437 6.210 -7.747
327 H ALA 49 HN ALA 49 6.545 3.579 -4.430
328 HA ALA 49 HA ALA 49 9.347 3.241 -3.797
329 1HB ALA 49 HB1 ALA 49 8.054 5.104 -2.836
330 2HB ALA 49 HB2 ALA 49 6.923 3.948 -2.093
331 3HB ALA 49 HB3 ALA 49 8.620 4.004 -1.557
332 H LYS 50 HN LYS 50 9.837 1.044 -4.056
333 HA LYS 50 HA LYS 50 8.109 -1.015 -3.309
334 1HB LYS 50 HB2 LYS 50 9.970 -1.234 -4.917
335 2HB LYS 50 HB3 LYS 50 11.127 -1.038 -3.616
336 1HG LYS 50 HG2 LYS 50 9.039 -3.143 -3.190
337 2HG LYS 50 HG3 LYS 50 10.197 -3.470 -4.464
338 1HD LYS 50 HD2 LYS 50 12.076 -3.066 -2.860
339 2HD LYS 50 HD3 LYS 50 10.919 -2.738 -1.586
340 1HE LYS 50 HE2 LYS 50 9.952 -5.079 -1.988
341 2HE LYS 50 HE3 LYS 50 11.298 -5.380 -3.069
342 1HZ LYS 50 HZ1 LYS 50 12.809 -4.893 -1.190
343 2HZ LYS 50 HZ2 LYS 50 11.540 -4.680 -0.191
344 H VAL 51 HN VAL 51 7.765 -2.136 -1.415
345 HA VAL 51 HA VAL 51 9.406 -1.284 0.870
346 HB VAL 51 HB VAL 51 7.500 -1.391 2.267
347 1HG1 VAL 51 HG11 VAL 51 6.142 0.392 1.430
348 2HG1 VAL 51 HG12 VAL 51 7.792 0.652 0.813
349 3HG1 VAL 51 HG13 VAL 51 6.535 -0.015 -0.257
350 1HG2 VAL 51 HG21 VAL 51 5.219 -1.957 1.323
351 2HG2 VAL 51 HG22 VAL 51 6.057 -2.582 -0.117
352 3HG2 VAL 51 HG23 VAL 51 6.349 -3.324 1.474
353 H SER 52 HN SER 52 10.288 -2.958 2.151
354 HA SER 52 HA SER 52 9.515 -5.640 1.562
355 1HB SER 52 HB2 SER 52 11.722 -5.512 2.348
356 2HB SER 52 HB3 SER 52 11.342 -4.290 3.545
357 HG SER 52 HG SER 52 11.551 -6.100 4.780
358 H ASP 53 HN ASP 53 8.584 -7.079 3.352
359 HA ASP 53 HA ASP 53 6.990 -5.603 5.248
360 1HB ASP 53 HB2 ASP 53 4.929 -6.857 4.608
361 2HB ASP 53 HB3 ASP 53 5.488 -5.806 3.322
362 HD2 ASP 53 HD2 ASP 53 4.632 -9.083 1.930
363 H SER 54 HN SER 54 9.348 -7.324 5.473
364 HA SER 54 HA SER 54 8.309 -9.266 7.253
365 1HB SER 54 HB2 SER 54 9.571 -11.183 6.063
366 2HB SER 54 HB3 SER 54 8.026 -10.700 5.391
367 HG SER 54 HG SER 54 9.650 -10.932 3.734
368 H ALA 55 HN ALA 55 9.720 -7.449 8.325
369 HA ALA 55 HA ALA 55 11.520 -7.072 9.559
370 1HB ALA 55 HB1 ALA 55 12.038 -10.031 9.055
371 2HB ALA 55 HB2 ALA 55 12.713 -9.059 10.384
372 3HB ALA 55 HB3 ALA 55 10.962 -9.368 10.308
373 H THR 56 HN THR 56 11.913 -6.023 7.121
374 HA THR 56 HA THR 56 13.656 -5.014 6.151
375 HB THR 56 HB THR 56 15.611 -6.917 7.488
376 HG1 THR 56 HG1 THR 56 14.002 -4.713 8.572
377 1HG2 THR 56 HG21 THR 56 16.493 -5.007 6.115
378 2HG2 THR 56 HG22 THR 56 15.529 -3.878 7.098
379 3HG2 THR 56 HG23 THR 56 16.862 -4.793 7.843
380 H ASN 57 HN ASN 57 14.631 -8.515 6.389
381 HA ASN 57 HA ASN 57 15.880 -9.577 4.905
382 1HB ASN 57 HB2 ASN 57 14.516 -10.234 2.861
383 2HB ASN 57 HB3 ASN 57 13.644 -10.409 4.371
384 1HD2 ASN 57 HD21 ASN 57 11.240 -7.934 3.784
385 2HD2 ASN 57 HD22 ASN 57 11.997 -9.006 4.914
386 H ILE 58 HN ILE 58 16.878 -6.994 4.888
387 HA ILE 58 HA ILE 58 17.794 -6.821 2.172
388 HB ILE 58 HB ILE 58 15.653 -5.176 2.968
389 1HG1 ILE 58 HG12 ILE 58 17.479 -4.810 0.580
390 2HG1 ILE 58 HG13 ILE 58 16.294 -6.096 0.697
391 1HG2 ILE 58 HG21 ILE 58 16.490 -2.944 2.877
392 2HG2 ILE 58 HG22 ILE 58 17.396 -3.809 4.142
393 3HG2 ILE 58 HG23 ILE 58 18.146 -3.511 2.555
394 1HD1 ILE 58 HD11 ILE 58 15.287 -4.235 -0.509
395 2HD1 ILE 58 HD12 ILE 58 14.503 -4.348 1.085
396 3HD1 ILE 58 HD13 ILE 58 15.734 -3.098 0.785
397 H CYS 59 HN CYS 59 19.645 -5.193 2.029
398 HA CYS 59 HA CYS 59 21.601 -5.850 3.687
399 1HB CYS 59 HB2 CYS 59 22.423 -3.355 3.218
400 2HB CYS 59 HB3 CYS 59 22.456 -4.626 2.013
401 H GLY 60 HN GLY 60 19.510 -2.890 4.083
402 1HA GLY 60 HA1 GLY 60 18.622 -2.021 5.981
403 2HA GLY 60 HA2 GLY 60 19.331 -3.322 6.917
Start of MODEL 8
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 0.631 -0.827
3 1HB LYS 1 HB2 LYS 1 1.641 1.658 1.367
4 2HB LYS 1 HB3 LYS 1 1.593 0.092 2.150
5 1HG LYS 1 HG2 LYS 1 3.864 -0.436 1.345
6 2HG LYS 1 HG3 LYS 1 3.913 1.042 0.405
7 1HD LYS 1 HD2 LYS 1 3.392 1.203 3.385
8 2HD LYS 1 HD3 LYS 1 5.030 0.948 2.816
9 1HE LYS 1 HE2 LYS 1 4.827 2.998 1.368
10 2HE LYS 1 HE3 LYS 1 3.210 3.262 1.991
11 1HZ LYS 1 HZ1 LYS 1 4.055 3.736 4.119
12 2HZ LYS 1 HZ2 LYS 1 5.499 3.033 3.847
13 H ASP 2 HN ASP 2 3.409 -0.734 -1.536
14 HA ASP 2 HA ASP 2 3.484 -3.379 -0.413
15 1HB ASP 2 HB2 ASP 2 3.223 -2.898 -3.419
16 2HB ASP 2 HB3 ASP 2 3.490 -4.456 -2.663
17 HD2 ASP 2 HD2 ASP 2 1.685 -5.571 -2.314
18 H GLY 3 HN GLY 3 5.680 -4.037 -0.295
19 1HA GLY 3 HA1 GLY 3 7.781 -3.099 -1.893
20 2HA GLY 3 HA2 GLY 3 7.551 -1.959 -0.582
21 H TYR 4 HN TYR 4 9.702 -2.610 0.211
22 HA TYR 4 HA TYR 4 9.602 -5.209 1.591
23 1HB TYR 4 HB2 TYR 4 11.911 -3.545 0.403
24 2HB TYR 4 HB3 TYR 4 12.148 -5.045 1.278
25 HD1 TYR 4 HD1 TYR 4 10.708 -3.582 -1.818
26 HD2 TYR 4 HD2 TYR 4 11.892 -7.162 0.203
27 HE1 TYR 4 HE1 TYR 4 10.467 -4.892 -3.983
28 HE2 TYR 4 HE2 TYR 4 11.648 -8.460 -1.970
29 HH TYR 4 HH TYR 4 10.556 -6.827 -4.933
30 HA PRO 5 HA PRO 5 9.732 -2.122 4.759
31 1HB PRO 5 HB2 PRO 5 8.472 -3.564 6.709
32 2HB PRO 5 HB3 PRO 5 7.614 -2.595 5.528
33 1HG PRO 5 HG2 PRO 5 7.906 -5.534 5.654
34 2HG PRO 5 HG3 PRO 5 6.733 -4.585 4.763
35 1HD PRO 5 HD2 PRO 5 9.052 -5.892 3.694
36 2HD PRO 5 HD3 PRO 5 7.944 -4.848 2.826
37 H VAL 6 HN VAL 6 11.449 -1.537 6.042
38 HA VAL 6 HA VAL 6 11.977 -3.654 7.991
39 HB VAL 6 HB VAL 6 14.314 -2.886 8.143
40 1HG1 VAL 6 HG11 VAL 6 13.576 -3.818 5.349
41 2HG1 VAL 6 HG12 VAL 6 15.128 -4.060 6.186
42 3HG1 VAL 6 HG13 VAL 6 13.659 -4.867 6.785
43 1HG2 VAL 6 HG21 VAL 6 13.664 -1.296 5.638
44 2HG2 VAL 6 HG22 VAL 6 14.048 -0.625 7.241
45 3HG2 VAL 6 HG23 VAL 6 15.286 -1.527 6.334
46 H ASP 7 HN ASP 7 11.954 -2.952 10.130
47 HA ASP 7 HA ASP 7 12.284 -0.213 10.716
48 1HB ASP 7 HB2 ASP 7 9.866 -0.425 11.976
49 2HB ASP 7 HB3 ASP 7 10.086 0.355 10.422
50 HD2 ASP 7 HD2 ASP 7 7.649 -1.741 9.212
51 H SER 8 HN SER 8 10.219 -2.867 12.129
52 HA SER 8 HA SER 8 11.593 -2.571 14.612
53 1HB SER 8 HB2 SER 8 9.937 -4.179 15.461
54 2HB SER 8 HB3 SER 8 9.141 -2.927 14.529
55 HG SER 8 HG SER 8 9.618 -5.671 13.832
56 H LYS 9 HN LYS 9 11.526 -4.779 11.822
57 HA LYS 9 HA LYS 9 13.047 -6.816 13.138
58 1HB LYS 9 HB2 LYS 9 13.145 -7.814 10.879
59 2HB LYS 9 HB3 LYS 9 11.512 -7.441 11.390
60 1HG LYS 9 HG2 LYS 9 12.734 -5.155 10.008
61 2HG LYS 9 HG3 LYS 9 12.776 -6.592 9.006
62 1HD LYS 9 HD2 LYS 9 10.220 -5.857 10.463
63 2HD LYS 9 HD3 LYS 9 10.639 -5.025 8.978
64 1HE LYS 9 HE2 LYS 9 10.577 -8.068 9.177
65 2HE LYS 9 HE3 LYS 9 9.163 -7.131 8.740
66 1HZ LYS 9 HZ1 LYS 9 10.606 -6.134 6.928
67 2HZ LYS 9 HZ2 LYS 9 11.720 -7.277 7.251
68 H GLY 10 HN GLY 10 13.695 -3.716 11.736
69 1HA GLY 10 HA1 GLY 10 15.661 -2.596 12.091
70 2HA GLY 10 HA2 GLY 10 16.479 -4.103 12.452
71 H CYS 11 HN CYS 11 16.665 -5.693 10.469
72 HA CYS 11 HA CYS 11 16.784 -4.182 7.973
73 1HB CYS 11 HB2 CYS 11 18.927 -6.071 8.969
74 2HB CYS 11 HB3 CYS 11 18.851 -5.394 7.355
75 H LYS 12 HN LYS 12 17.055 -5.963 6.081
76 HA LYS 12 HA LYS 12 14.606 -7.388 6.419
77 1HB LYS 12 HB2 LYS 12 15.556 -6.046 4.367
78 2HB LYS 12 HB3 LYS 12 16.334 -7.564 3.967
79 1HG LYS 12 HG2 LYS 12 14.354 -8.591 3.409
80 2HG LYS 12 HG3 LYS 12 13.477 -7.852 4.734
81 1HD LYS 12 HD2 LYS 12 12.630 -7.024 2.561
82 2HD LYS 12 HD3 LYS 12 13.330 -5.713 3.489
83 1HE LYS 12 HE2 LYS 12 15.398 -6.983 1.866
84 2HE LYS 12 HE3 LYS 12 14.039 -6.541 0.852
85 1HZ LYS 12 HZ1 LYS 12 14.167 -4.279 1.865
86 2HZ LYS 12 HZ2 LYS 12 15.517 -4.712 2.665
87 H LEU 13 HN LEU 13 14.357 -9.729 5.757
88 HA LEU 13 HA LEU 13 16.249 -11.071 7.492
89 1HB LEU 13 HB2 LEU 13 13.564 -11.911 6.392
90 2HB LEU 13 HB3 LEU 13 14.534 -12.853 7.506
91 HG LEU 13 HG LEU 13 12.997 -11.855 8.908
92 1HD1 LEU 13 HD11 LEU 13 14.162 -10.311 10.300
93 2HD1 LEU 13 HD12 LEU 13 15.371 -11.415 9.602
94 3HD1 LEU 13 HD13 LEU 13 15.188 -9.768 8.951
95 1HD2 LEU 13 HD21 LEU 13 12.009 -9.732 8.701
96 2HD2 LEU 13 HD22 LEU 13 13.288 -9.145 7.612
97 3HD2 LEU 13 HD23 LEU 13 12.120 -10.359 7.039
98 H SER 14 HN SER 14 15.628 -10.633 4.123
99 HA SER 14 HA SER 14 16.261 -11.641 2.308
100 1HB SER 14 HB2 SER 14 18.458 -12.869 4.033
101 2HB SER 14 HB3 SER 14 18.476 -12.772 2.283
102 HG SER 14 HG SER 14 18.829 -10.709 4.220
103 H CYS 15 HN CYS 15 14.317 -12.954 2.185
104 HA CYS 15 HA CYS 15 14.077 -15.408 3.485
105 1HB CYS 15 HB2 CYS 15 12.231 -15.834 1.954
106 2HB CYS 15 HB3 CYS 15 12.153 -14.225 2.644
107 H VAL 16 HN VAL 16 14.473 -17.579 2.700
108 HA VAL 16 HA VAL 16 15.690 -17.721 0.032
109 HB VAL 16 HB VAL 16 16.395 -19.623 2.246
110 1HG1 VAL 16 HG11 VAL 16 16.983 -20.285 -0.022
111 2HG1 VAL 16 HG12 VAL 16 17.812 -18.732 -0.289
112 3HG1 VAL 16 HG13 VAL 16 18.456 -19.893 0.897
113 1HG2 VAL 16 HG21 VAL 16 18.455 -18.226 2.628
114 2HG2 VAL 16 HG22 VAL 16 17.670 -16.925 1.700
115 3HG2 VAL 16 HG23 VAL 16 16.941 -17.500 3.219
116 H ALA 17 HN ALA 17 12.862 -17.957 1.267
117 HA ALA 17 HA ALA 17 12.091 -20.302 -0.149
118 1HB ALA 17 HB1 ALA 17 12.019 -20.311 2.895
119 2HB ALA 17 HB2 ALA 17 11.144 -21.467 1.862
120 3HB ALA 17 HB3 ALA 17 12.923 -21.425 1.840
121 H ASN 18 HN ASN 18 9.681 -20.523 -0.151
122 HA ASN 18 HA ASN 18 8.746 -17.876 -0.463
123 1HB ASN 18 HB2 ASN 18 7.329 -20.574 -0.797
124 2HB ASN 18 HB3 ASN 18 6.658 -19.040 -1.314
125 1HD2 ASN 18 HD21 ASN 18 8.770 -18.570 -4.111
126 2HD2 ASN 18 HD22 ASN 18 7.789 -17.797 -2.911
127 H ASN 19 HN ASN 19 7.902 -20.770 1.564
128 HA ASN 19 HA ASN 19 5.650 -19.653 2.714
129 1HB ASN 19 HB2 ASN 19 5.978 -21.464 4.466
130 2HB ASN 19 HB3 ASN 19 6.054 -22.065 2.821
131 1HD2 ASN 19 HD21 ASN 19 8.901 -23.248 5.096
132 2HD2 ASN 19 HD22 ASN 19 7.191 -23.094 5.324
133 H TYR 20 HN TYR 20 9.147 -19.555 3.484
134 HA TYR 20 HA TYR 20 9.007 -18.711 6.129
135 1HB TYR 20 HB2 TYR 20 11.042 -19.502 4.880
136 2HB TYR 20 HB3 TYR 20 10.921 -18.141 3.782
137 HD1 TYR 20 HD1 TYR 20 11.674 -15.919 4.438
138 HD2 TYR 20 HD2 TYR 20 11.867 -19.195 7.183
139 HE1 TYR 20 HE1 TYR 20 13.206 -14.569 5.953
140 HE2 TYR 20 HE2 TYR 20 13.398 -17.834 8.688
141 HH TYR 20 HH TYR 20 14.416 -15.960 8.994
142 H CYS 21 HN CYS 21 8.939 -16.858 3.032
143 HA CYS 21 HA CYS 21 8.985 -14.349 4.336
144 1HB CYS 21 HB2 CYS 21 9.770 -14.502 2.089
145 2HB CYS 21 HB3 CYS 21 8.262 -15.200 1.532
146 H ASP 22 HN ASP 22 6.434 -16.497 2.897
147 HA ASP 22 HA ASP 22 4.447 -14.668 2.816
148 1HB ASP 22 HB2 ASP 22 4.239 -16.880 1.801
149 2HB ASP 22 HB3 ASP 22 4.345 -17.666 3.364
150 HD2 ASP 22 HD2 ASP 22 2.699 -17.570 4.647
151 H ASN 23 HN ASN 23 5.121 -17.133 5.427
152 HA ASN 23 HA ASN 23 2.936 -16.408 6.953
153 1HB ASN 23 HB2 ASN 23 3.753 -17.982 8.516
154 2HB ASN 23 HB3 ASN 23 4.535 -18.519 7.043
155 1HD2 ASN 23 HD21 ASN 23 7.809 -17.473 7.892
156 2HD2 ASN 23 HD22 ASN 23 6.718 -17.989 6.649
157 H GLN 24 HN GLN 24 6.291 -15.212 6.720
158 HA GLN 24 HA GLN 24 6.324 -14.049 9.286
159 1HB GLN 24 HB2 GLN 24 8.387 -14.771 8.140
160 2HB GLN 24 HB3 GLN 24 8.112 -13.614 6.853
161 1HG GLN 24 HG2 GLN 24 8.474 -11.734 8.314
162 2HG GLN 24 HG3 GLN 24 8.330 -12.721 9.754
163 1HE2 GLN 24 HE21 GLN 24 11.717 -13.132 7.380
164 2HE2 GLN 24 HE22 GLN 24 10.199 -12.624 6.718
165 H CYS 25 HN CYS 25 5.295 -13.032 6.053
166 HA CYS 25 HA CYS 25 5.262 -10.256 6.707
167 1HB CYS 25 HB2 CYS 25 4.073 -11.820 4.410
168 2HB CYS 25 HB3 CYS 25 3.962 -10.078 4.565
169 H LYS 26 HN LYS 26 2.855 -12.988 6.465
170 HA LYS 26 HA LYS 26 0.732 -11.083 6.401
171 1HB LYS 26 HB2 LYS 26 -0.690 -13.021 6.054
172 2HB LYS 26 HB3 LYS 26 0.717 -13.103 5.013
173 1HG LYS 26 HG2 LYS 26 1.409 -15.051 5.957
174 2HG LYS 26 HG3 LYS 26 1.294 -14.386 7.574
175 1HD LYS 26 HD2 LYS 26 -1.181 -15.273 6.037
176 2HD LYS 26 HD3 LYS 26 -0.243 -16.402 6.994
177 1HE LYS 26 HE2 LYS 26 -0.550 -14.904 9.005
178 2HE LYS 26 HE3 LYS 26 -1.555 -13.845 8.036
179 1HZ LYS 26 HZ1 LYS 26 -2.138 -16.698 8.627
180 2HZ LYS 26 HZ2 LYS 26 -2.935 -15.415 9.236
181 H MET 27 HN MET 27 2.510 -12.732 8.876
182 HA MET 27 HA MET 27 0.415 -13.348 10.588
183 1HB MET 27 HB2 MET 27 2.213 -13.678 12.245
184 2HB MET 27 HB3 MET 27 2.791 -14.237 10.688
185 1HG MET 27 HG2 MET 27 3.840 -11.911 10.359
186 2HG MET 27 HG3 MET 27 3.436 -11.572 12.030
187 1HE MET 27 HE1 MET 27 5.821 -11.241 12.963
188 2HE MET 27 HE2 MET 27 7.212 -12.217 12.432
189 3HE MET 27 HE3 MET 27 6.299 -11.250 11.249
190 H LYS 28 HN LYS 28 2.008 -10.309 9.833
191 HA LYS 28 HA LYS 28 0.461 -8.887 11.766
192 1HB LYS 28 HB2 LYS 28 2.211 -9.786 13.236
193 2HB LYS 28 HB3 LYS 28 3.454 -9.113 12.201
194 1HG LYS 28 HG2 LYS 28 1.416 -7.118 13.004
195 2HG LYS 28 HG3 LYS 28 2.263 -7.816 14.370
196 1HD LYS 28 HD2 LYS 28 4.450 -7.235 13.351
197 2HD LYS 28 HD3 LYS 28 3.645 -6.614 11.924
198 1HE LYS 28 HE2 LYS 28 4.220 -4.731 13.376
199 2HE LYS 28 HE3 LYS 28 2.476 -4.900 13.349
200 1HZ LYS 28 HZ1 LYS 28 4.260 -5.916 15.497
201 2HZ LYS 28 HZ2 LYS 28 3.255 -4.641 15.620
202 H LYS 29 HN LYS 29 3.419 -8.833 9.649
203 HA LYS 29 HA LYS 29 3.494 -6.052 9.563
204 1HB LYS 29 HB2 LYS 29 4.700 -8.171 7.766
205 2HB LYS 29 HB3 LYS 29 5.051 -6.462 7.608
206 1HG LYS 29 HG2 LYS 29 5.346 -7.839 10.299
207 2HG LYS 29 HG3 LYS 29 6.620 -7.962 9.101
208 1HD LYS 29 HD2 LYS 29 6.927 -5.553 9.046
209 2HD LYS 29 HD3 LYS 29 5.464 -5.279 9.971
210 1HE LYS 29 HE2 LYS 29 6.508 -6.501 11.922
211 2HE LYS 29 HE3 LYS 29 7.985 -6.671 10.994
212 1HZ LYS 29 HZ1 LYS 29 8.069 -4.710 12.428
213 2HZ LYS 29 HZ2 LYS 29 8.117 -4.233 10.872
214 H ALA 30 HN ALA 30 1.874 -8.480 7.448
215 HA ALA 30 HA ALA 30 0.770 -6.279 5.882
216 1HB ALA 30 HB1 ALA 30 3.050 -7.181 4.983
217 2HB ALA 30 HB2 ALA 30 2.108 -8.614 4.505
218 3HB ALA 30 HB3 ALA 30 1.688 -7.013 3.849
219 H SER 31 HN SER 31 -0.717 -7.438 4.054
220 HA SER 31 HA SER 31 -2.348 -9.325 5.444
221 1HB SER 31 HB2 SER 31 -3.761 -9.212 3.384
222 2HB SER 31 HB3 SER 31 -3.433 -7.631 4.067
223 HG SER 31 HG SER 31 -2.187 -8.850 1.760
224 H GLY 32 HN GLY 32 0.074 -9.250 2.811
225 1HA GLY 32 HA1 GLY 32 0.249 -12.163 2.924
226 2HA GLY 32 HA2 GLY 32 -0.181 -11.453 1.381
227 H GLY 33 HN GLY 33 2.022 -12.703 0.988
228 1HA GLY 33 HA1 GLY 33 3.892 -10.758 0.283
229 2HA GLY 33 HA2 GLY 33 4.439 -11.483 1.782
230 H HIS 34 HN HIS 34 5.791 -11.712 -0.779
231 HA HIS 34 HA HIS 34 5.863 -14.608 -0.819
232 1HB HIS 34 HB2 HIS 34 5.411 -12.894 -3.270
233 2HB HIS 34 HB3 HIS 34 6.056 -14.521 -3.359
234 HD1 HIS 34 HD1 HIS 34 4.431 -16.505 -2.850
235 HD2 HIS 34 HD2 HIS 34 2.656 -12.710 -2.627
236 HE1 HIS 34 HE1 HIS 34 1.911 -16.897 -2.787
237 H CYS 35 HN CYS 35 7.929 -15.414 -1.831
238 HA CYS 35 HA CYS 35 10.000 -13.646 -0.881
239 1HB CYS 35 HB2 CYS 35 9.945 -15.964 -0.116
240 2HB CYS 35 HB3 CYS 35 10.087 -16.538 -1.766
241 H TYR 36 HN TYR 36 10.309 -12.060 -2.517
242 HA TYR 36 HA TYR 36 10.862 -12.878 -5.210
243 1HB TYR 36 HB2 TYR 36 9.964 -10.614 -4.282
244 2HB TYR 36 HB3 TYR 36 11.560 -10.337 -3.614
245 HD1 TYR 36 HD1 TYR 36 12.983 -8.979 -4.837
246 HD2 TYR 36 HD2 TYR 36 10.038 -11.280 -6.921
247 HE1 TYR 36 HE1 TYR 36 13.716 -7.937 -7.038
248 HE2 TYR 36 HE2 TYR 36 10.781 -10.230 -9.115
249 HH TYR 36 HH TYR 36 13.415 -7.841 -9.168
250 H ALA 37 HN ALA 37 13.041 -12.323 -6.251
251 HA ALA 37 HA ALA 37 14.684 -14.265 -5.183
252 1HB ALA 37 HB1 ALA 37 15.292 -12.056 -7.191
253 2HB ALA 37 HB2 ALA 37 16.276 -13.518 -6.943
254 3HB ALA 37 HB3 ALA 37 14.612 -13.660 -7.558
255 H MET 38 HN MET 38 14.669 -10.712 -4.766
256 HA MET 38 HA MET 38 17.306 -10.660 -3.751
257 1HB MET 38 HB2 MET 38 14.980 -8.663 -3.750
258 2HB MET 38 HB3 MET 38 16.562 -8.256 -3.116
259 1HG MET 38 HG2 MET 38 16.748 -9.479 -5.792
260 2HG MET 38 HG3 MET 38 15.736 -8.049 -5.804
261 1HE MET 38 HE1 MET 38 20.168 -8.273 -4.604
262 2HE MET 38 HE2 MET 38 18.922 -9.016 -3.573
263 3HE MET 38 HE3 MET 38 19.160 -9.596 -5.239
264 H SER 39 HN SER 39 14.011 -10.868 -2.341
265 HA SER 39 HA SER 39 14.837 -11.436 0.217
266 1HB SER 39 HB2 SER 39 14.788 -8.527 -0.459
267 2HB SER 39 HB3 SER 39 13.981 -8.964 1.034
268 HG SER 39 HG SER 39 16.704 -9.670 0.332
269 H CYS 40 HN CYS 40 12.886 -10.764 1.856
270 HA CYS 40 HA CYS 40 10.612 -11.932 0.691
271 1HB CYS 40 HB2 CYS 40 11.135 -12.304 3.006
272 2HB CYS 40 HB3 CYS 40 11.056 -10.590 3.361
273 H TYR 41 HN TYR 41 9.232 -10.874 -0.697
274 HA TYR 41 HA TYR 41 8.903 -7.991 -0.385
275 1HB TYR 41 HB2 TYR 41 9.342 -9.053 -2.632
276 2HB TYR 41 HB3 TYR 41 7.983 -10.135 -2.399
277 HD1 TYR 41 HD1 TYR 41 8.372 -6.420 -1.977
278 HD2 TYR 41 HD2 TYR 41 6.303 -9.626 -3.913
279 HE1 TYR 41 HE1 TYR 41 6.836 -4.748 -3.121
280 HE2 TYR 41 HE2 TYR 41 4.775 -7.942 -5.051
281 HH TYR 41 HH TYR 41 5.302 -4.464 -4.640
282 H CYS 42 HN CYS 42 7.504 -7.578 1.308
283 HA CYS 42 HA CYS 42 5.245 -9.306 1.697
284 1HB CYS 42 HB2 CYS 42 6.145 -6.799 3.130
285 2HB CYS 42 HB3 CYS 42 4.739 -7.743 3.581
286 H GLU 43 HN GLU 43 2.975 -8.468 1.645
287 HA GLU 43 HA GLU 43 2.733 -6.352 -0.328
288 1HB GLU 43 HB2 GLU 43 1.808 -9.231 -0.649
289 2HB GLU 43 HB3 GLU 43 1.118 -7.926 -1.593
290 1HG GLU 43 HG2 GLU 43 3.443 -7.319 -2.382
291 2HG GLU 43 HG3 GLU 43 4.074 -8.697 -1.503
292 HE2 GLU 43 HE2 GLU 43 3.336 -10.814 -4.111
293 H GLY 44 HN GLY 44 0.731 -5.223 -0.254
294 1HA GLY 44 HA1 GLY 44 -1.109 -4.415 0.768
295 2HA GLY 44 HA2 GLY 44 -1.414 -6.005 1.439
296 H LEU 45 HN LEU 45 0.864 -3.197 1.811
297 HA LEU 45 HA LEU 45 1.126 -3.910 4.632
298 1HB LEU 45 HB2 LEU 45 2.739 -2.155 2.786
299 2HB LEU 45 HB3 LEU 45 2.975 -2.179 4.522
300 HG LEU 45 HG LEU 45 3.100 -4.746 2.960
301 1HD1 LEU 45 HD11 LEU 45 5.469 -4.450 2.557
302 2HD1 LEU 45 HD12 LEU 45 4.553 -3.138 1.776
303 3HD1 LEU 45 HD13 LEU 45 5.425 -2.832 3.298
304 1HD2 LEU 45 HD21 LEU 45 4.596 -5.432 4.756
305 2HD2 LEU 45 HD22 LEU 45 4.496 -3.810 5.483
306 3HD2 LEU 45 HD23 LEU 45 3.049 -4.845 5.412
307 HA PRO 46 HA PRO 46 -0.900 -0.103 5.734
308 1HB PRO 46 HB2 PRO 46 0.149 0.259 8.231
309 2HB PRO 46 HB3 PRO 46 -1.275 -0.714 7.922
310 1HG PRO 46 HG2 PRO 46 1.476 -1.600 8.543
311 2HG PRO 46 HG3 PRO 46 -0.020 -2.507 8.650
312 1HD PRO 46 HD2 PRO 46 1.971 -2.716 6.596
313 2HD PRO 46 HD3 PRO 46 0.423 -3.537 6.643
314 H GLU 47 HN GLU 47 -0.430 2.199 6.137
315 HA GLU 47 HA GLU 47 1.705 2.576 4.292
316 1HB GLU 47 HB2 GLU 47 -0.344 4.474 5.508
317 2HB GLU 47 HB3 GLU 47 0.857 4.989 4.341
318 1HG GLU 47 HG2 GLU 47 -0.005 3.295 2.709
319 2HG GLU 47 HG3 GLU 47 -1.209 2.785 3.876
320 HE2 GLU 47 HE2 GLU 47 -0.046 5.413 2.154
321 H ASN 48 HN ASN 48 1.396 2.567 7.701
322 HA ASN 48 HA ASN 48 2.957 4.819 8.284
323 1HB ASN 48 HB2 ASN 48 3.021 3.867 10.589
324 2HB ASN 48 HB3 ASN 48 1.398 3.791 9.932
325 1HD2 ASN 48 HD21 ASN 48 2.594 0.542 11.548
326 2HD2 ASN 48 HD22 ASN 48 2.684 2.207 12.017
327 H ALA 49 HN ALA 49 3.581 1.472 7.352
328 HA ALA 49 HA ALA 49 6.252 1.425 8.435
329 1HB ALA 49 HB1 ALA 49 4.710 -0.487 6.633
330 2HB ALA 49 HB2 ALA 49 6.303 -0.816 7.357
331 3HB ALA 49 HB3 ALA 49 4.878 -0.605 8.402
332 H LYS 50 HN LYS 50 7.973 2.350 7.445
333 HA LYS 50 HA LYS 50 7.788 3.186 4.717
334 1HB LYS 50 HB2 LYS 50 9.785 4.301 5.096
335 2HB LYS 50 HB3 LYS 50 9.030 4.321 6.676
336 1HG LYS 50 HG2 LYS 50 11.040 3.484 7.391
337 2HG LYS 50 HG3 LYS 50 10.393 1.949 6.846
338 1HD LYS 50 HD2 LYS 50 11.391 2.598 4.505
339 2HD LYS 50 HD3 LYS 50 12.314 3.798 5.388
340 1HE LYS 50 HE2 LYS 50 13.253 2.007 6.858
341 2HE LYS 50 HE3 LYS 50 12.316 0.802 5.997
342 1HZ LYS 50 HZ1 LYS 50 14.630 1.019 5.168
343 2HZ LYS 50 HZ2 LYS 50 13.544 1.303 3.988
344 H VAL 51 HN VAL 51 9.214 2.445 2.970
345 HA VAL 51 HA VAL 51 9.920 -0.375 3.299
346 HB VAL 51 HB VAL 51 8.704 -0.793 1.129
347 1HG1 VAL 51 HG11 VAL 51 6.486 -1.027 2.233
348 2HG1 VAL 51 HG12 VAL 51 7.831 -1.626 3.233
349 3HG1 VAL 51 HG13 VAL 51 7.090 -0.048 3.591
350 1HG2 VAL 51 HG21 VAL 51 8.457 1.590 0.473
351 2HG2 VAL 51 HG22 VAL 51 6.911 0.708 0.476
352 3HG2 VAL 51 HG23 VAL 51 7.307 1.815 1.813
353 H SER 52 HN SER 52 11.689 -1.026 1.991
354 HA SER 52 HA SER 52 12.767 0.899 0.181
355 1HB SER 52 HB2 SER 52 14.423 -0.495 1.101
356 2HB SER 52 HB3 SER 52 13.429 -1.934 0.986
357 HG SER 52 HG SER 52 15.308 -1.151 -0.729
358 H ASP 53 HN ASP 53 12.873 0.584 -2.185
359 HA ASP 53 HA ASP 53 11.286 -1.561 -3.236
360 1HB ASP 53 HB2 ASP 53 9.999 -0.004 -4.738
361 2HB ASP 53 HB3 ASP 53 9.577 0.159 -3.045
362 HD2 ASP 53 HD2 ASP 53 11.235 1.513 -5.607
363 H SER 54 HN SER 54 14.111 -1.066 -3.229
364 HA SER 54 HA SER 54 14.596 -0.659 -6.021
365 1HB SER 54 HB2 SER 54 16.463 1.036 -5.462
366 2HB SER 54 HB3 SER 54 14.814 1.629 -5.448
367 HG SER 54 HG SER 54 16.139 2.279 -3.567
368 H ALA 55 HN ALA 55 14.878 -3.066 -5.070
369 HA ALA 55 HA ALA 55 16.300 -4.742 -4.812
370 1HB ALA 55 HB1 ALA 55 18.354 -2.715 -5.786
371 2HB ALA 55 HB2 ALA 55 18.519 -4.486 -5.831
372 3HB ALA 55 HB3 ALA 55 17.285 -3.682 -6.830
373 H THR 56 HN THR 56 15.644 -3.621 -2.408
374 HA THR 56 HA THR 56 16.284 -4.192 -0.341
375 HB THR 56 HB THR 56 19.118 -4.710 -1.330
376 HG1 THR 56 HG1 THR 56 18.238 -6.697 -2.155
377 1HG2 THR 56 HG21 THR 56 17.283 -6.250 0.578
378 2HG2 THR 56 HG22 THR 56 19.011 -6.558 0.281
379 3HG2 THR 56 HG23 THR 56 18.503 -5.072 1.121
380 H ASN 57 HN ASN 57 19.202 -2.604 -1.827
381 HA ASN 57 HA ASN 57 20.617 -1.266 -0.801
382 1HB ASN 57 HB2 ASN 57 19.619 1.033 -0.358
383 2HB ASN 57 HB3 ASN 57 19.184 0.368 -1.920
384 1HD2 ASN 57 HD21 ASN 57 16.412 1.143 0.979
385 2HD2 ASN 57 HD22 ASN 57 18.114 1.150 1.299
386 H ILE 58 HN ILE 58 19.875 -3.234 1.067
387 HA ILE 58 HA ILE 58 19.689 -1.757 3.559
388 HB ILE 58 HB ILE 58 17.524 -3.395 2.402
389 1HG1 ILE 58 HG12 ILE 58 17.390 -1.383 4.648
390 2HG1 ILE 58 HG13 ILE 58 17.552 -0.878 2.977
391 1HG2 ILE 58 HG21 ILE 58 18.335 -4.926 4.126
392 2HG2 ILE 58 HG22 ILE 58 18.243 -3.625 5.337
393 3HG2 ILE 58 HG23 ILE 58 16.757 -4.230 4.567
394 1HD1 ILE 58 HD11 ILE 58 15.506 -2.232 2.400
395 2HD1 ILE 58 HD12 ILE 58 15.321 -2.615 4.128
396 3HD1 ILE 58 HD13 ILE 58 15.178 -0.931 3.570
397 H CYS 59 HN CYS 59 20.214 -3.183 5.453
398 HA CYS 59 HA CYS 59 22.680 -4.100 5.096
399 1HB CYS 59 HB2 CYS 59 20.997 -5.564 7.088
400 2HB CYS 59 HB3 CYS 59 22.630 -4.947 7.241
401 H GLY 60 HN GLY 60 19.725 -6.230 5.271
402 1HA GLY 60 HA1 GLY 60 19.202 -8.032 3.983
403 2HA GLY 60 HA2 GLY 60 20.711 -7.862 3.109
Start of MODEL 9
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 0.702 -0.767
3 1HB LYS 1 HB2 LYS 1 1.446 1.409 1.633
4 2HB LYS 1 HB3 LYS 1 1.813 -0.235 2.114
5 1HG LYS 1 HG2 LYS 1 3.917 0.835 2.250
6 2HG LYS 1 HG3 LYS 1 3.990 0.027 0.697
7 1HD LYS 1 HD2 LYS 1 3.566 2.061 -0.512
8 2HD LYS 1 HD3 LYS 1 3.008 2.897 0.924
9 1HE LYS 1 HE2 LYS 1 5.277 2.878 1.883
10 2HE LYS 1 HE3 LYS 1 5.869 1.886 0.566
11 1HZ LYS 1 HZ1 LYS 1 6.322 4.293 0.260
12 2HZ LYS 1 HZ2 LYS 1 5.438 3.691 -0.968
13 H ASP 2 HN ASP 2 2.379 -0.781 -2.292
14 HA ASP 2 HA ASP 2 3.155 -3.364 -1.271
15 1HB ASP 2 HB2 ASP 2 1.455 -3.117 -3.788
16 2HB ASP 2 HB3 ASP 2 1.951 -4.595 -2.990
17 HD2 ASP 2 HD2 ASP 2 -1.295 -2.678 -1.722
18 H GLY 3 HN GLY 3 4.865 -4.309 -2.594
19 1HA GLY 3 HA1 GLY 3 5.687 -3.905 -5.074
20 2HA GLY 3 HA2 GLY 3 6.163 -2.379 -4.356
21 H TYR 4 HN TYR 4 8.426 -2.867 -4.679
22 HA TYR 4 HA TYR 4 9.444 -5.093 -3.073
23 1HB TYR 4 HB2 TYR 4 10.985 -3.174 -4.892
24 2HB TYR 4 HB3 TYR 4 11.375 -4.845 -4.534
25 HD1 TYR 4 HD1 TYR 4 9.613 -6.630 -5.384
26 HD2 TYR 4 HD2 TYR 4 9.969 -2.655 -6.925
27 HE1 TYR 4 HE1 TYR 4 8.461 -7.352 -7.533
28 HE2 TYR 4 HE2 TYR 4 8.816 -3.390 -9.068
29 HH TYR 4 HH TYR 4 7.295 -6.487 -9.325
30 HA PRO 5 HA PRO 5 10.523 -2.020 -0.142
31 1HB PRO 5 HB2 PRO 5 11.269 -3.718 1.864
32 2HB PRO 5 HB3 PRO 5 9.611 -3.215 1.602
33 1HG PRO 5 HG2 PRO 5 10.879 -5.813 0.982
34 2HG PRO 5 HG3 PRO 5 9.175 -5.430 1.128
35 1HD PRO 5 HD2 PRO 5 10.645 -5.821 -1.304
36 2HD PRO 5 HD3 PRO 5 8.970 -5.325 -1.160
37 H VAL 6 HN VAL 6 12.336 -0.885 0.506
38 HA VAL 6 HA VAL 6 14.849 -2.176 -0.159
39 HB VAL 6 HB VAL 6 15.334 -0.072 -1.600
40 1HG1 VAL 6 HG11 VAL 6 15.294 -2.411 -2.412
41 2HG1 VAL 6 HG12 VAL 6 13.539 -2.274 -2.677
42 3HG1 VAL 6 HG13 VAL 6 14.663 -1.263 -3.617
43 1HG2 VAL 6 HG21 VAL 6 13.199 1.073 -1.058
44 2HG2 VAL 6 HG22 VAL 6 13.430 0.836 -2.807
45 3HG2 VAL 6 HG23 VAL 6 12.316 -0.220 -1.905
46 H ASP 7 HN ASP 7 15.620 -1.921 1.929
47 HA ASP 7 HA ASP 7 16.366 0.748 2.572
48 1HB ASP 7 HB2 ASP 7 15.412 0.101 5.051
49 2HB ASP 7 HB3 ASP 7 14.540 1.103 3.908
50 HD2 ASP 7 HD2 ASP 7 11.979 -1.172 3.581
51 H SER 8 HN SER 8 15.757 -2.342 4.421
52 HA SER 8 HA SER 8 18.339 -2.198 5.565
53 1HB SER 8 HB2 SER 8 17.682 -4.378 6.626
54 2HB SER 8 HB3 SER 8 16.508 -3.102 6.876
55 HG SER 8 HG SER 8 15.474 -5.092 6.259
56 H LYS 9 HN LYS 9 16.832 -3.777 2.777
57 HA LYS 9 HA LYS 9 19.053 -5.642 2.530
58 1HB LYS 9 HB2 LYS 9 17.676 -6.655 0.750
59 2HB LYS 9 HB3 LYS 9 16.845 -6.583 2.291
60 1HG LYS 9 HG2 LYS 9 16.415 -4.163 0.637
61 2HG LYS 9 HG3 LYS 9 15.853 -5.629 -0.141
62 1HD LYS 9 HD2 LYS 9 15.152 -5.149 2.765
63 2HD LYS 9 HD3 LYS 9 14.264 -4.289 1.524
64 1HE LYS 9 HE2 LYS 9 14.574 -7.326 1.692
65 2HE LYS 9 HE3 LYS 9 13.138 -6.427 2.142
66 1HZ LYS 9 HZ1 LYS 9 12.837 -7.188 -0.087
67 2HZ LYS 9 HZ2 LYS 9 13.110 -5.588 -0.220
68 H GLY 10 HN GLY 10 17.896 -2.556 1.357
69 1HA GLY 10 HA1 GLY 10 19.030 -1.034 0.118
70 2HA GLY 10 HA2 GLY 10 20.333 -2.184 -0.111
71 H CYS 11 HN CYS 11 19.824 -4.106 -1.651
72 HA CYS 11 HA CYS 11 18.501 -2.868 -3.953
73 1HB CYS 11 HB2 CYS 11 21.041 -4.427 -3.681
74 2HB CYS 11 HB3 CYS 11 20.139 -4.529 -5.180
75 H LYS 12 HN LYS 12 16.709 -4.118 -2.421
76 HA LYS 12 HA LYS 12 15.162 -5.692 -2.433
77 1HB LYS 12 HB2 LYS 12 16.273 -5.940 -5.214
78 2HB LYS 12 HB3 LYS 12 15.064 -7.083 -4.664
79 1HG LYS 12 HG2 LYS 12 13.552 -5.502 -5.323
80 2HG LYS 12 HG3 LYS 12 13.944 -4.711 -3.809
81 1HD LYS 12 HD2 LYS 12 15.596 -3.279 -4.891
82 2HD LYS 12 HD3 LYS 12 15.494 -4.190 -6.385
83 1HE LYS 12 HE2 LYS 12 13.149 -3.470 -6.712
84 2HE LYS 12 HE3 LYS 12 13.153 -2.651 -5.163
85 1HZ LYS 12 HZ1 LYS 12 14.386 -0.938 -6.005
86 2HZ LYS 12 HZ2 LYS 12 15.267 -1.868 -7.009
87 H LEU 13 HN LEU 13 14.864 -8.307 -2.824
88 HA LEU 13 HA LEU 13 17.474 -9.593 -2.872
89 1HB LEU 13 HB2 LEU 13 16.342 -11.293 -1.205
90 2HB LEU 13 HB3 LEU 13 17.284 -9.920 -0.657
91 HG LEU 13 HG LEU 13 15.100 -8.645 -0.423
92 1HD1 LEU 13 HD11 LEU 13 13.076 -10.146 -0.105
93 2HD1 LEU 13 HD12 LEU 13 13.598 -9.855 -1.782
94 3HD1 LEU 13 HD13 LEU 13 13.988 -11.397 -0.984
95 1HD2 LEU 13 HD21 LEU 13 15.606 -11.093 1.287
96 2HD2 LEU 13 HD22 LEU 13 16.256 -9.453 1.521
97 3HD2 LEU 13 HD23 LEU 13 14.514 -9.757 1.726
98 H SER 14 HN SER 14 17.392 -11.773 -3.776
99 HA SER 14 HA SER 14 15.356 -11.732 -5.800
100 1HB SER 14 HB2 SER 14 16.786 -13.475 -6.889
101 2HB SER 14 HB3 SER 14 17.664 -12.002 -6.529
102 HG SER 14 HG SER 14 17.667 -14.379 -4.869
103 H CYS 15 HN CYS 15 13.431 -12.667 -5.129
104 HA CYS 15 HA CYS 15 13.301 -14.753 -3.276
105 1HB CYS 15 HB2 CYS 15 10.959 -14.942 -3.940
106 2HB CYS 15 HB3 CYS 15 11.432 -13.282 -3.636
107 H VAL 16 HN VAL 16 13.109 -17.027 -3.585
108 HA VAL 16 HA VAL 16 14.002 -17.923 -6.217
109 HB VAL 16 HB VAL 16 13.895 -19.351 -3.552
110 1HG1 VAL 16 HG11 VAL 16 15.490 -20.934 -4.706
111 2HG1 VAL 16 HG12 VAL 16 13.814 -20.975 -5.304
112 3HG1 VAL 16 HG13 VAL 16 15.072 -20.128 -6.237
113 1HG2 VAL 16 HG21 VAL 16 16.197 -17.984 -4.985
114 2HG2 VAL 16 HG22 VAL 16 15.470 -17.520 -3.428
115 3HG2 VAL 16 HG23 VAL 16 16.372 -19.048 -3.569
116 H ALA 17 HN ALA 17 11.160 -17.572 -4.300
117 HA ALA 17 HA ALA 17 9.551 -19.232 -5.909
118 1HB ALA 17 HB1 ALA 17 9.095 -20.998 -4.210
119 2HB ALA 17 HB2 ALA 17 10.768 -21.050 -4.815
120 3HB ALA 17 HB3 ALA 17 10.422 -20.352 -3.214
121 H ASN 18 HN ASN 18 7.288 -19.415 -4.894
122 HA ASN 18 HA ASN 18 6.561 -16.842 -4.261
123 1HB ASN 18 HB2 ASN 18 5.057 -19.480 -3.852
124 2HB ASN 18 HB3 ASN 18 4.299 -17.905 -3.720
125 1HD2 ASN 18 HD21 ASN 18 3.608 -19.122 -7.115
126 2HD2 ASN 18 HD22 ASN 18 3.237 -19.545 -5.477
127 H ASN 19 HN ASN 19 6.909 -19.842 -2.249
128 HA ASN 19 HA ASN 19 5.871 -18.742 0.072
129 1HB ASN 19 HB2 ASN 19 7.099 -20.677 1.195
130 2HB ASN 19 HB3 ASN 19 6.085 -21.161 -0.150
131 1HD2 ASN 19 HD21 ASN 19 10.018 -21.977 -0.101
132 2HD2 ASN 19 HD22 ASN 19 9.100 -21.359 1.231
133 H TYR 20 HN TYR 20 9.118 -18.785 -1.440
134 HA TYR 20 HA TYR 20 10.609 -18.212 0.870
135 1HB TYR 20 HB2 TYR 20 11.294 -19.114 -1.476
136 2HB TYR 20 HB3 TYR 20 11.087 -17.484 -2.085
137 HD1 TYR 20 HD1 TYR 20 13.296 -19.771 -0.363
138 HD2 TYR 20 HD2 TYR 20 12.586 -15.637 -1.207
139 HE1 TYR 20 HE1 TYR 20 15.697 -19.222 0.267
140 HE2 TYR 20 HE2 TYR 20 14.989 -15.102 -0.574
141 HH TYR 20 HH TYR 20 17.199 -17.691 0.461
142 H CYS 21 HN CYS 21 8.982 -16.149 -1.587
143 HA CYS 21 HA CYS 21 9.973 -13.736 -0.490
144 1HB CYS 21 HB2 CYS 21 9.240 -13.733 -2.751
145 2HB CYS 21 HB3 CYS 21 7.670 -14.386 -2.327
146 H ASP 22 HN ASP 22 6.885 -15.659 -0.189
147 HA ASP 22 HA ASP 22 5.503 -13.553 0.902
148 1HB ASP 22 HB2 ASP 22 4.579 -15.698 -0.129
149 2HB ASP 22 HB3 ASP 22 4.973 -16.524 1.365
150 HD2 ASP 22 HD2 ASP 22 1.650 -15.826 2.101
151 H ASN 23 HN ASN 23 7.184 -16.397 2.401
152 HA ASN 23 HA ASN 23 6.244 -15.979 4.962
153 1HB ASN 23 HB2 ASN 23 7.714 -17.715 5.567
154 2HB ASN 23 HB3 ASN 23 7.592 -17.988 3.840
155 1HD2 ASN 23 HD21 ASN 23 10.833 -16.781 3.007
156 2HD2 ASN 23 HD22 ASN 23 9.221 -17.075 2.444
157 H GLN 24 HN GLN 24 8.875 -14.542 3.050
158 HA GLN 24 HA GLN 24 10.285 -13.600 5.339
159 1HB GLN 24 HB2 GLN 24 11.383 -14.260 3.162
160 2HB GLN 24 HB3 GLN 24 10.648 -12.864 2.401
161 1HG GLN 24 HG2 GLN 24 11.861 -11.329 3.861
162 2HG GLN 24 HG3 GLN 24 12.430 -12.646 4.868
163 1HE2 GLN 24 HE21 GLN 24 15.419 -12.643 3.112
164 2HE2 GLN 24 HE22 GLN 24 14.570 -12.349 4.593
165 H CYS 25 HN CYS 25 7.920 -12.356 2.966
166 HA CYS 25 HA CYS 25 8.245 -9.645 3.653
167 1HB CYS 25 HB2 CYS 25 5.948 -11.116 2.348
168 2HB CYS 25 HB3 CYS 25 6.028 -9.375 2.524
169 H LYS 26 HN LYS 26 6.018 -12.316 4.683
170 HA LYS 26 HA LYS 26 4.361 -10.540 6.156
171 1HB LYS 26 HB2 LYS 26 3.029 -12.415 6.583
172 2HB LYS 26 HB3 LYS 26 3.705 -12.720 4.995
173 1HG LYS 26 HG2 LYS 26 5.443 -14.186 5.974
174 2HG LYS 26 HG3 LYS 26 4.882 -13.817 7.593
175 1HD LYS 26 HD2 LYS 26 3.949 -15.971 6.938
176 2HD LYS 26 HD3 LYS 26 2.639 -14.809 7.016
177 1HE LYS 26 HE2 LYS 26 2.509 -14.615 4.628
178 2HE LYS 26 HE3 LYS 26 4.087 -15.340 4.394
179 1HZ LYS 26 HZ1 LYS 26 2.353 -16.954 3.931
180 2HZ LYS 26 HZ2 LYS 26 3.152 -17.447 5.261
181 H MET 27 HN MET 27 7.403 -12.077 6.743
182 HA MET 27 HA MET 27 7.312 -12.684 9.377
183 1HB MET 27 HB2 MET 27 9.259 -12.860 7.681
184 2HB MET 27 HB3 MET 27 9.591 -11.168 7.995
185 1HG MET 27 HG2 MET 27 9.597 -11.954 10.550
186 2HG MET 27 HG3 MET 27 9.897 -13.535 9.856
187 1HE MET 27 HE1 MET 27 11.577 -12.671 7.143
188 2HE MET 27 HE2 MET 27 13.167 -13.049 7.848
189 3HE MET 27 HE3 MET 27 11.763 -14.080 8.214
190 H LYS 28 HN LYS 28 7.439 -9.439 7.848
191 HA LYS 28 HA LYS 28 7.106 -8.081 10.311
192 1HB LYS 28 HB2 LYS 28 9.429 -8.819 10.640
193 2HB LYS 28 HB3 LYS 28 9.897 -8.077 9.123
194 1HG LYS 28 HG2 LYS 28 8.430 -6.264 10.979
195 2HG LYS 28 HG3 LYS 28 9.983 -6.813 11.579
196 1HD LYS 28 HD2 LYS 28 9.716 -5.739 8.749
197 2HD LYS 28 HD3 LYS 28 9.891 -4.641 10.104
198 1HE LYS 28 HE2 LYS 28 12.019 -5.730 10.758
199 2HE LYS 28 HE3 LYS 28 11.829 -6.923 9.489
200 1HZ LYS 28 HZ1 LYS 28 12.129 -4.001 9.038
201 2HZ LYS 28 HZ2 LYS 28 13.282 -5.120 8.769
202 H LYS 29 HN LYS 29 8.449 -7.943 6.944
203 HA LYS 29 HA LYS 29 8.280 -5.180 6.752
204 1HB LYS 29 HB2 LYS 29 8.342 -7.350 4.640
205 2HB LYS 29 HB3 LYS 29 8.443 -5.641 4.269
206 1HG LYS 29 HG2 LYS 29 10.297 -6.434 6.429
207 2HG LYS 29 HG3 LYS 29 10.593 -7.311 4.941
208 1HD LYS 29 HD2 LYS 29 11.925 -5.302 4.830
209 2HD LYS 29 HD3 LYS 29 10.598 -5.082 3.708
210 1HE LYS 29 HE2 LYS 29 9.372 -3.703 5.332
211 2HE LYS 29 HE3 LYS 29 10.554 -4.044 6.580
212 1HZ LYS 29 HZ1 LYS 29 11.013 -1.904 5.563
213 2HZ LYS 29 HZ2 LYS 29 12.233 -2.913 5.180
214 H ALA 30 HN ALA 30 5.847 -7.757 6.130
215 HA ALA 30 HA ALA 30 3.952 -5.715 5.285
216 1HB ALA 30 HB1 ALA 30 3.691 -6.531 3.109
217 2HB ALA 30 HB2 ALA 30 5.453 -6.633 3.337
218 3HB ALA 30 HB3 ALA 30 4.449 -8.094 3.495
219 H SER 31 HN SER 31 1.793 -7.049 4.606
220 HA SER 31 HA SER 31 1.315 -8.908 6.726
221 1HB SER 31 HB2 SER 31 -0.466 -7.975 4.430
222 2HB SER 31 HB3 SER 31 -1.003 -8.974 5.766
223 HG SER 31 HG SER 31 -1.461 -6.681 6.074
224 H GLY 32 HN GLY 32 1.892 -8.885 3.196
225 1HA GLY 32 HA1 GLY 32 2.410 -11.745 3.285
226 2HA GLY 32 HA2 GLY 32 1.082 -11.244 2.256
227 H GLY 33 HN GLY 33 2.731 -12.311 0.651
228 1HA GLY 33 HA1 GLY 33 3.640 -10.180 -0.973
229 2HA GLY 33 HA2 GLY 33 5.008 -10.972 -0.217
230 H HIS 34 HN HIS 34 4.706 -11.052 -3.007
231 HA HIS 34 HA HIS 34 4.577 -13.942 -3.238
232 1HB HIS 34 HB2 HIS 34 2.388 -12.963 -4.028
233 2HB HIS 34 HB3 HIS 34 3.277 -12.133 -5.289
234 HD1 HIS 34 HD1 HIS 34 4.499 -13.694 -7.110
235 HD2 HIS 34 HD2 HIS 34 1.809 -15.631 -4.540
236 HE1 HIS 34 HE1 HIS 34 3.984 -15.951 -8.183
237 H CYS 35 HN CYS 35 5.796 -14.714 -5.210
238 HA CYS 35 HA CYS 35 8.193 -13.108 -5.289
239 1HB CYS 35 HB2 CYS 35 8.397 -15.457 -4.735
240 2HB CYS 35 HB3 CYS 35 7.606 -15.922 -6.228
241 H TYR 36 HN TYR 36 7.951 -11.431 -6.813
242 HA TYR 36 HA TYR 36 7.158 -12.166 -9.509
243 1HB TYR 36 HB2 TYR 36 6.658 -9.944 -8.281
244 2HB TYR 36 HB3 TYR 36 8.381 -9.629 -8.256
245 HD1 TYR 36 HD1 TYR 36 9.285 -8.306 -9.940
246 HD2 TYR 36 HD2 TYR 36 5.665 -10.451 -10.716
247 HE1 TYR 36 HE1 TYR 36 9.109 -7.198 -12.221
248 HE2 TYR 36 HE2 TYR 36 5.501 -9.335 -12.995
249 HH TYR 36 HH TYR 36 6.367 -7.918 -14.368
250 H ALA 37 HN ALA 37 8.678 -11.568 -11.365
251 HA ALA 37 HA ALA 37 10.634 -13.499 -11.089
252 1HB ALA 37 HB1 ALA 37 11.308 -12.768 -13.369
253 2HB ALA 37 HB2 ALA 37 9.542 -12.923 -13.207
254 3HB ALA 37 HB3 ALA 37 10.300 -11.313 -13.183
255 H MET 38 HN MET 38 10.767 -9.942 -10.729
256 HA MET 38 HA MET 38 13.600 -9.916 -10.974
257 1HB MET 38 HB2 MET 38 11.547 -7.806 -10.108
258 2HB MET 38 HB3 MET 38 13.244 -7.452 -10.360
259 1HG MET 38 HG2 MET 38 11.430 -8.647 -12.510
260 2HG MET 38 HG3 MET 38 11.753 -6.931 -12.357
261 1HE MET 38 HE1 MET 38 14.580 -6.292 -11.854
262 2HE MET 38 HE2 MET 38 15.309 -6.425 -13.472
263 3HE MET 38 HE3 MET 38 13.671 -5.754 -13.286
264 H SER 39 HN SER 39 11.182 -9.817 -8.312
265 HA SER 39 HA SER 39 13.160 -10.168 -6.344
266 1HB SER 39 HB2 SER 39 11.899 -7.397 -6.552
267 2HB SER 39 HB3 SER 39 12.877 -7.957 -5.210
268 HG SER 39 HG SER 39 14.534 -8.427 -7.050
269 H CYS 40 HN CYS 40 12.106 -9.985 -4.068
270 HA CYS 40 HA CYS 40 9.594 -11.200 -4.068
271 1HB CYS 40 HB2 CYS 40 11.121 -11.548 -2.257
272 2HB CYS 40 HB3 CYS 40 11.177 -9.836 -1.888
273 H TYR 41 HN TYR 41 7.756 -10.166 -4.800
274 HA TYR 41 HA TYR 41 7.439 -7.325 -4.345
275 1HB TYR 41 HB2 TYR 41 6.748 -8.558 -6.458
276 2HB TYR 41 HB3 TYR 41 5.692 -9.584 -5.507
277 HD1 TYR 41 HD1 TYR 41 6.224 -6.069 -6.615
278 HD2 TYR 41 HD2 TYR 41 3.474 -8.914 -4.988
279 HE1 TYR 41 HE1 TYR 41 4.313 -4.425 -6.950
280 HE2 TYR 41 HE2 TYR 41 1.573 -7.261 -5.328
281 HH TYR 41 HH TYR 41 0.986 -5.326 -6.076
282 H CYS 42 HN CYS 42 7.048 -6.835 -2.196
283 HA CYS 42 HA CYS 42 5.524 -8.731 -0.651
284 1HB CYS 42 HB2 CYS 42 7.005 -6.205 0.097
285 2HB CYS 42 HB3 CYS 42 6.094 -7.170 1.241
286 H GLU 43 HN GLU 43 3.664 -7.884 0.759
287 HA GLU 43 HA GLU 43 2.166 -5.945 -0.795
288 1HB GLU 43 HB2 GLU 43 1.436 -8.868 -0.383
289 2HB GLU 43 HB3 GLU 43 0.225 -7.663 -0.774
290 1HG GLU 43 HG2 GLU 43 1.446 -7.063 -2.849
291 2HG GLU 43 HG3 GLU 43 2.729 -8.186 -2.445
292 HE2 GLU 43 HE2 GLU 43 -0.607 -9.557 -4.102
293 H GLY 44 HN GLY 44 0.987 -4.607 0.521
294 1HA GLY 44 HA1 GLY 44 -0.294 -3.962 2.281
295 2HA GLY 44 HA2 GLY 44 -0.246 -5.591 2.925
296 H LEU 45 HN LEU 45 2.010 -2.799 2.318
297 HA LEU 45 HA LEU 45 3.387 -3.505 4.794
298 1HB LEU 45 HB2 LEU 45 4.094 -1.697 2.485
299 2HB LEU 45 HB3 LEU 45 5.016 -1.756 3.974
300 HG LEU 45 HG LEU 45 5.032 -4.379 3.394
301 1HD1 LEU 45 HD11 LEU 45 5.403 -4.642 0.938
302 2HD1 LEU 45 HD12 LEU 45 3.722 -4.273 1.391
303 3HD1 LEU 45 HD13 LEU 45 4.761 -2.997 0.713
304 1HD2 LEU 45 HD21 LEU 45 7.248 -3.973 2.279
305 2HD2 LEU 45 HD22 LEU 45 6.882 -2.231 2.335
306 3HD2 LEU 45 HD23 LEU 45 7.026 -3.160 3.847
307 HA PRO 46 HA PRO 46 2.038 0.394 6.547
308 1HB PRO 46 HB2 PRO 46 4.079 0.833 8.309
309 2HB PRO 46 HB3 PRO 46 2.651 -0.100 8.710
310 1HG PRO 46 HG2 PRO 46 5.384 -1.058 8.118
311 2HG PRO 46 HG3 PRO 46 4.075 -1.902 8.920
312 1HD PRO 46 HD2 PRO 46 4.962 -2.281 6.218
313 2HD PRO 46 HD3 PRO 46 3.581 -3.041 6.985
314 H GLU 47 HN GLU 47 2.652 2.692 6.551
315 HA GLU 47 HA GLU 47 3.601 2.936 3.920
316 1HB GLU 47 HB2 GLU 47 2.931 5.243 4.093
317 2HB GLU 47 HB3 GLU 47 1.749 4.301 4.981
318 1HG GLU 47 HG2 GLU 47 3.135 4.785 7.101
319 2HG GLU 47 HG3 GLU 47 4.050 5.931 6.142
320 HE2 GLU 47 HE2 GLU 47 0.325 6.849 7.260
321 H ASN 48 HN ASN 48 5.134 2.981 7.024
322 HA ASN 48 HA ASN 48 7.066 4.929 6.498
323 1HB ASN 48 HB2 ASN 48 8.218 3.977 8.488
324 2HB ASN 48 HB3 ASN 48 6.501 4.135 8.796
325 1HD2 ASN 48 HD21 ASN 48 8.007 0.738 9.743
326 2HD2 ASN 48 HD22 ASN 48 8.556 2.367 9.948
327 H ALA 49 HN ALA 49 6.647 1.502 5.705
328 HA ALA 49 HA ALA 49 9.436 1.122 5.046
329 1HB ALA 49 HB1 ALA 49 6.974 -0.640 4.715
330 2HB ALA 49 HB2 ALA 49 8.653 -1.148 4.417
331 3HB ALA 49 HB3 ALA 49 8.138 -0.700 6.060
332 H LYS 50 HN LYS 50 10.058 2.381 3.313
333 HA LYS 50 HA LYS 50 8.283 3.000 1.208
334 1HB LYS 50 HB2 LYS 50 10.162 4.437 1.945
335 2HB LYS 50 HB3 LYS 50 11.303 3.248 1.349
336 1HG LYS 50 HG2 LYS 50 9.195 4.114 -0.596
337 2HG LYS 50 HG3 LYS 50 10.368 5.338 -0.153
338 1HD LYS 50 HD2 LYS 50 12.229 3.794 -0.772
339 2HD LYS 50 HD3 LYS 50 11.069 2.548 -1.186
340 1HE LYS 50 HE2 LYS 50 10.060 4.162 -2.891
341 2HE LYS 50 HE3 LYS 50 11.382 5.262 -2.552
342 1HZ LYS 50 HZ1 LYS 50 12.935 3.484 -3.228
343 2HZ LYS 50 HZ2 LYS 50 11.693 2.489 -3.576
344 H VAL 51 HN VAL 51 7.944 2.050 -0.779
345 HA VAL 51 HA VAL 51 9.681 -0.227 -1.423
346 HB VAL 51 HB VAL 51 7.811 -1.483 -2.182
347 1HG1 VAL 51 HG11 VAL 51 8.339 -1.408 0.304
348 2HG1 VAL 51 HG12 VAL 51 6.935 -0.327 0.478
349 3HG1 VAL 51 HG13 VAL 51 6.712 -1.984 -0.134
350 1HG2 VAL 51 HG21 VAL 51 6.399 0.155 -3.176
351 2HG2 VAL 51 HG22 VAL 51 5.455 -0.594 -1.867
352 3HG2 VAL 51 HG23 VAL 51 6.183 1.013 -1.631
353 H SER 52 HN SER 52 10.209 -0.452 -3.658
354 HA SER 52 HA SER 52 9.358 1.725 -5.338
355 1HB SER 52 HB2 SER 52 11.665 1.085 -5.589
356 2HB SER 52 HB3 SER 52 11.261 -0.615 -5.719
357 HG SER 52 HG SER 52 10.759 1.479 -7.646
358 H ASP 53 HN ASP 53 7.922 1.477 -7.150
359 HA ASP 53 HA ASP 53 7.241 -1.293 -7.745
360 1HB ASP 53 HB2 ASP 53 5.028 -0.494 -8.556
361 2HB ASP 53 HB3 ASP 53 5.250 -0.165 -6.849
362 HD2 ASP 53 HD2 ASP 53 5.899 3.351 -7.980
363 H SER 54 HN SER 54 9.507 0.199 -8.805
364 HA SER 54 HA SER 54 8.473 1.243 -11.325
365 1HB SER 54 HB2 SER 54 10.430 2.919 -11.127
366 2HB SER 54 HB3 SER 54 9.041 3.183 -10.091
367 HG SER 54 HG SER 54 10.941 3.379 -8.834
368 H ALA 55 HN ALA 55 9.350 -1.447 -11.075
369 HA ALA 55 HA ALA 55 10.507 -2.831 -12.357
370 1HB ALA 55 HB1 ALA 55 11.162 -0.322 -13.954
371 2HB ALA 55 HB2 ALA 55 11.222 -2.000 -14.545
372 3HB ALA 55 HB3 ALA 55 9.661 -1.267 -14.102
373 H THR 56 HN THR 56 11.810 -1.925 -9.996
374 HA THR 56 HA THR 56 13.811 -2.114 -9.038
375 HB THR 56 HB THR 56 14.504 -3.588 -11.633
376 HG1 THR 56 HG1 THR 56 12.517 -4.337 -10.637
377 1HG2 THR 56 HG21 THR 56 16.451 -3.353 -10.102
378 2HG2 THR 56 HG22 THR 56 15.451 -3.899 -8.735
379 3HG2 THR 56 HG23 THR 56 15.839 -5.024 -10.058
380 H ASN 57 HN ASN 57 13.785 0.333 -9.412
381 HA ASN 57 HA ASN 57 15.647 1.186 -11.403
382 1HB ASN 57 HB2 ASN 57 15.090 3.439 -10.660
383 2HB ASN 57 HB3 ASN 57 13.596 2.525 -10.684
384 1HD2 ASN 57 HD21 ASN 57 13.061 2.451 -7.210
385 2HD2 ASN 57 HD22 ASN 57 12.573 1.952 -8.795
386 H ILE 58 HN ILE 58 15.523 0.375 -7.943
387 HA ILE 58 HA ILE 58 18.262 1.248 -7.563
388 HB ILE 58 HB ILE 58 16.404 -0.296 -5.749
389 1HG1 ILE 58 HG12 ILE 58 17.038 2.669 -5.828
390 2HG1 ILE 58 HG13 ILE 58 15.521 1.931 -6.302
391 1HG2 ILE 58 HG21 ILE 58 18.639 -0.734 -5.081
392 2HG2 ILE 58 HG22 ILE 58 19.115 0.967 -5.299
393 3HG2 ILE 58 HG23 ILE 58 18.009 0.514 -3.980
394 1HD1 ILE 58 HD11 ILE 58 15.052 2.543 -4.093
395 2HD1 ILE 58 HD12 ILE 58 15.604 0.866 -3.867
396 3HD1 ILE 58 HD13 ILE 58 16.714 2.219 -3.543
397 H CYS 59 HN CYS 59 19.903 -0.557 -6.728
398 HA CYS 59 HA CYS 59 20.366 -1.254 -9.344
399 1HB CYS 59 HB2 CYS 59 22.473 -1.927 -8.677
400 2HB CYS 59 HB3 CYS 59 22.020 -0.746 -7.464
401 H GLY 60 HN GLY 60 18.990 -3.063 -6.607
402 1HA GLY 60 HA1 GLY 60 17.885 -5.022 -6.543
403 2HA GLY 60 HA2 GLY 60 17.856 -5.023 -8.295
Start of MODEL 10
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 -1.034 0.108
3 1HB LYS 1 HB2 LYS 1 1.387 0.100 -2.154
4 2HB LYS 1 HB3 LYS 1 1.897 1.591 -1.387
5 1HG LYS 1 HG2 LYS 1 4.084 0.682 -0.858
6 2HG LYS 1 HG3 LYS 1 3.583 -0.946 -1.271
7 1HD LYS 1 HD2 LYS 1 3.218 -0.180 -3.659
8 2HD LYS 1 HD3 LYS 1 3.845 1.395 -3.216
9 1HE LYS 1 HE2 LYS 1 5.636 0.032 -4.223
10 2HE LYS 1 HE3 LYS 1 6.013 0.361 -2.544
11 1HZ LYS 1 HZ1 LYS 1 4.835 -2.164 -3.576
12 2HZ LYS 1 HZ2 LYS 1 6.354 -1.977 -3.018
13 H ASP 2 HN ASP 2 3.388 -0.626 1.619
14 HA ASP 2 HA ASP 2 3.179 1.802 3.133
15 1HB ASP 2 HB2 ASP 2 2.730 -0.904 4.470
16 2HB ASP 2 HB3 ASP 2 2.708 0.660 5.259
17 HD2 ASP 2 HD2 ASP 2 -0.527 1.400 4.021
18 H GLY 3 HN GLY 3 5.066 2.012 4.625
19 1HA GLY 3 HA1 GLY 3 6.706 0.475 5.800
20 2HA GLY 3 HA2 GLY 3 7.159 -0.024 4.182
21 H TYR 4 HN TYR 4 9.119 0.883 3.680
22 HA TYR 4 HA TYR 4 9.613 3.581 4.743
23 1HB TYR 4 HB2 TYR 4 11.470 1.230 4.015
24 2HB TYR 4 HB3 TYR 4 12.007 2.730 4.745
25 HD1 TYR 4 HD1 TYR 4 10.079 -0.377 5.340
26 HD2 TYR 4 HD2 TYR 4 11.812 3.111 7.110
27 HE1 TYR 4 HE1 TYR 4 9.730 -1.369 7.655
28 HE2 TYR 4 HE2 TYR 4 11.457 2.107 9.418
29 HH TYR 4 HH TYR 4 9.913 -1.075 9.782
30 HA PRO 5 HA PRO 5 9.527 4.266 0.432
31 1HB PRO 5 HB2 PRO 5 9.235 6.983 0.484
32 2HB PRO 5 HB3 PRO 5 7.888 5.871 0.633
33 1HG PRO 5 HG2 PRO 5 9.198 7.486 2.734
34 2HG PRO 5 HG3 PRO 5 7.624 6.716 2.762
35 1HD PRO 5 HD2 PRO 5 10.007 5.799 4.069
36 2HD PRO 5 HD3 PRO 5 8.464 4.971 4.001
37 H VAL 6 HN VAL 6 10.906 4.689 -1.262
38 HA VAL 6 HA VAL 6 13.155 6.408 -0.584
39 HB VAL 6 HB VAL 6 14.583 4.628 -1.843
40 1HG1 VAL 6 HG11 VAL 6 15.225 3.617 0.299
41 2HG1 VAL 6 HG12 VAL 6 14.954 5.368 0.471
42 3HG1 VAL 6 HG13 VAL 6 13.722 4.216 1.041
43 1HG2 VAL 6 HG21 VAL 6 12.452 2.831 -0.639
44 2HG2 VAL 6 HG22 VAL 6 12.631 3.167 -2.378
45 3HG2 VAL 6 HG23 VAL 6 13.929 2.327 -1.495
46 H ASP 7 HN ASP 7 13.555 7.836 -2.244
47 HA ASP 7 HA ASP 7 13.728 6.743 -4.823
48 1HB ASP 7 HB2 ASP 7 12.199 8.863 -5.626
49 2HB ASP 7 HB3 ASP 7 11.586 7.229 -5.470
50 HD2 ASP 7 HD2 ASP 7 10.552 9.890 -2.643
51 H SER 8 HN SER 8 12.935 10.026 -3.430
52 HA SER 8 HA SER 8 15.078 11.207 -4.835
53 1HB SER 8 HB2 SER 8 14.413 13.265 -3.552
54 2HB SER 8 HB3 SER 8 13.080 12.510 -4.402
55 HG SER 8 HG SER 8 12.529 13.111 -2.198
56 H LYS 9 HN LYS 9 14.517 9.936 -1.547
57 HA LYS 9 HA LYS 9 16.939 11.152 -0.544
58 1HB LYS 9 HB2 LYS 9 16.268 10.243 1.589
59 2HB LYS 9 HB3 LYS 9 14.900 11.041 0.840
60 1HG LYS 9 HG2 LYS 9 14.657 8.439 -0.129
61 2HG LYS 9 HG3 LYS 9 15.287 8.171 1.484
62 1HD LYS 9 HD2 LYS 9 12.952 8.230 1.841
63 2HD LYS 9 HD3 LYS 9 13.450 9.852 2.280
64 1HE LYS 9 HE2 LYS 9 12.893 10.593 -0.094
65 2HE LYS 9 HE3 LYS 9 12.250 8.991 -0.394
66 1HZ LYS 9 HZ1 LYS 9 10.542 10.619 0.338
67 2HZ LYS 9 HZ2 LYS 9 10.616 9.335 1.337
68 H GLY 10 HN GLY 10 15.889 8.196 -2.098
69 1HA GLY 10 HA1 GLY 10 17.354 6.810 -3.186
70 2HA GLY 10 HA2 GLY 10 18.689 7.448 -2.246
71 H CYS 11 HN CYS 11 18.363 6.974 0.314
72 HA CYS 11 HA CYS 11 17.738 4.114 0.438
73 1HB CYS 11 HB2 CYS 11 20.233 5.569 1.215
74 2HB CYS 11 HB3 CYS 11 19.732 4.189 2.172
75 H LYS 12 HN LYS 12 17.674 3.455 2.937
76 HA LYS 12 HA LYS 12 15.514 4.756 4.023
77 1HB LYS 12 HB2 LYS 12 17.149 2.522 4.629
78 2HB LYS 12 HB3 LYS 12 17.079 3.490 6.088
79 1HG LYS 12 HG2 LYS 12 15.106 2.340 6.401
80 2HG LYS 12 HG3 LYS 12 14.460 3.626 5.402
81 1HD LYS 12 HD2 LYS 12 15.554 1.066 4.171
82 2HD LYS 12 HD3 LYS 12 13.898 1.170 4.735
83 1HE LYS 12 HE2 LYS 12 13.690 3.300 3.263
84 2HE LYS 12 HE3 LYS 12 15.218 2.830 2.546
85 1HZ LYS 12 HZ1 LYS 12 13.320 1.934 1.301
86 2HZ LYS 12 HZ2 LYS 12 14.208 0.709 1.903
87 H LEU 13 HN LEU 13 15.193 6.369 5.570
88 HA LEU 13 HA LEU 13 17.572 8.030 5.986
89 1HB LEU 13 HB2 LEU 13 16.162 9.906 6.024
90 2HB LEU 13 HB3 LEU 13 15.688 8.942 4.640
91 HG LEU 13 HG LEU 13 13.980 8.015 6.598
92 1HD1 LEU 13 HD11 LEU 13 14.350 10.994 7.016
93 2HD1 LEU 13 HD12 LEU 13 13.003 10.020 7.654
94 3HD1 LEU 13 HD13 LEU 13 14.668 9.701 8.197
95 1HD2 LEU 13 HD21 LEU 13 13.552 10.225 4.569
96 2HD2 LEU 13 HD22 LEU 13 13.346 8.475 4.314
97 3HD2 LEU 13 HD23 LEU 13 12.257 9.348 5.418
98 H SER 14 HN SER 14 18.308 8.451 8.030
99 HA SER 14 HA SER 14 17.140 6.768 10.025
100 1HB SER 14 HB2 SER 14 19.155 7.394 11.356
101 2HB SER 14 HB3 SER 14 19.569 6.778 9.768
102 HG SER 14 HG SER 14 19.429 9.575 10.517
103 H CYS 15 HN CYS 15 15.112 7.909 10.430
104 HA CYS 15 HA CYS 15 15.052 10.554 11.333
105 1HB CYS 15 HB2 CYS 15 12.849 9.981 12.244
106 2HB CYS 15 HB3 CYS 15 13.050 9.475 10.579
107 H VAL 16 HN VAL 16 15.062 11.386 13.514
108 HA VAL 16 HA VAL 16 15.876 9.440 15.557
109 HB VAL 16 HB VAL 16 16.865 12.275 15.510
110 1HG1 VAL 16 HG11 VAL 16 17.120 11.050 17.595
111 2HG1 VAL 16 HG12 VAL 16 17.911 9.703 16.741
112 3HG1 VAL 16 HG13 VAL 16 18.713 11.289 16.838
113 1HG2 VAL 16 HG21 VAL 16 18.072 9.905 14.052
114 2HG2 VAL 16 HG22 VAL 16 17.574 11.472 13.369
115 3HG2 VAL 16 HG23 VAL 16 18.978 11.382 14.460
116 H ALA 17 HN ALA 17 13.266 10.837 14.566
117 HA ALA 17 HA ALA 17 12.220 11.372 17.146
118 1HB ALA 17 HB1 ALA 17 12.855 13.693 15.295
119 2HB ALA 17 HB2 ALA 17 11.601 13.789 16.554
120 3HB ALA 17 HB3 ALA 17 13.297 13.494 17.008
121 H ASN 18 HN ASN 18 9.865 11.691 17.046
122 HA ASN 18 HA ASN 18 8.918 9.981 15.044
123 1HB ASN 18 HB2 ASN 18 7.356 11.695 17.049
124 2HB ASN 18 HB3 ASN 18 6.697 10.336 16.159
125 1HD2 ASN 18 HD21 ASN 18 8.295 7.790 18.021
126 2HD2 ASN 18 HD22 ASN 18 7.611 8.226 16.491
127 H ASN 19 HN ASN 19 8.544 13.500 15.829
128 HA ASN 19 HA ASN 19 6.622 14.030 13.913
129 1HB ASN 19 HB2 ASN 19 7.429 16.443 14.192
130 2HB ASN 19 HB3 ASN 19 7.027 15.635 15.694
131 1HD2 ASN 19 HD21 ASN 19 10.205 15.730 17.097
132 2HD2 ASN 19 HD22 ASN 19 8.538 15.273 17.209
133 H TYR 20 HN TYR 20 10.144 13.630 13.811
134 HA TYR 20 HA TYR 20 10.524 15.200 11.444
135 1HB TYR 20 HB2 TYR 20 12.185 14.823 13.349
136 2HB TYR 20 HB3 TYR 20 12.210 13.114 12.966
137 HD1 TYR 20 HD1 TYR 20 13.247 16.470 11.827
138 HD2 TYR 20 HD2 TYR 20 13.484 12.262 11.091
139 HE1 TYR 20 HE1 TYR 20 15.161 16.855 10.198
140 HE2 TYR 20 HE2 TYR 20 15.398 12.661 9.465
141 HH TYR 20 HH TYR 20 16.670 14.112 8.509
142 H CYS 21 HN CYS 21 9.523 11.931 12.149
143 HA CYS 21 HA CYS 21 10.109 11.100 9.443
144 1HB CYS 21 HB2 CYS 21 10.309 9.386 11.065
145 2HB CYS 21 HB3 CYS 21 8.759 9.769 11.787
146 H ASP 22 HN ASP 22 7.292 11.954 11.585
147 HA ASP 22 HA ASP 22 5.423 10.991 9.805
148 1HB ASP 22 HB2 ASP 22 5.117 11.505 12.281
149 2HB ASP 22 HB3 ASP 22 5.045 13.207 11.872
150 HD2 ASP 22 HD2 ASP 22 1.622 12.683 11.847
151 H ASN 23 HN ASN 23 6.984 14.188 10.251
152 HA ASN 23 HA ASN 23 5.156 15.692 8.823
153 1HB ASN 23 HB2 ASN 23 7.030 17.354 8.643
154 2HB ASN 23 HB3 ASN 23 6.890 16.710 10.267
155 1HD2 ASN 23 HD21 ASN 23 10.460 16.744 8.970
156 2HD2 ASN 23 HD22 ASN 23 9.176 17.906 9.010
157 H GLN 24 HN GLN 24 7.988 13.687 7.913
158 HA GLN 24 HA GLN 24 8.089 14.704 5.266
159 1HB GLN 24 HB2 GLN 24 10.130 13.894 6.325
160 2HB GLN 24 HB3 GLN 24 9.419 12.320 6.620
161 1HG GLN 24 HG2 GLN 24 9.382 11.776 4.270
162 2HG GLN 24 HG3 GLN 24 9.680 13.438 3.800
163 1HE2 GLN 24 HE21 GLN 24 12.930 12.099 3.251
164 2HE2 GLN 24 HE22 GLN 24 11.344 12.161 2.556
165 H CYS 25 HN CYS 25 6.610 11.925 6.959
166 HA CYS 25 HA CYS 25 5.953 10.439 4.696
167 1HB CYS 25 HB2 CYS 25 4.593 10.608 7.393
168 2HB CYS 25 HB3 CYS 25 4.218 9.416 6.165
169 H LYS 26 HN LYS 26 4.119 12.933 6.619
170 HA LYS 26 HA LYS 26 1.790 12.519 5.035
171 1HB LYS 26 HB2 LYS 26 0.725 13.982 6.533
172 2HB LYS 26 HB3 LYS 26 1.890 13.107 7.506
173 1HG LYS 26 HG2 LYS 26 3.486 15.002 7.354
174 2HG LYS 26 HG3 LYS 26 2.387 15.871 6.301
175 1HD LYS 26 HD2 LYS 26 2.043 16.775 8.502
176 2HD LYS 26 HD3 LYS 26 0.647 15.768 8.174
177 1HE LYS 26 HE2 LYS 26 1.565 13.935 9.516
178 2HE LYS 26 HE3 LYS 26 3.097 14.765 9.695
179 1HZ LYS 26 HZ1 LYS 26 1.950 16.509 10.950
180 2HZ LYS 26 HZ2 LYS 26 0.510 15.773 10.756
181 H MET 27 HN MET 27 4.684 14.382 4.702
182 HA MET 27 HA MET 27 3.882 16.653 3.499
183 1HB MET 27 HB2 MET 27 6.262 15.775 3.957
184 2HB MET 27 HB3 MET 27 6.127 14.819 2.494
185 1HG MET 27 HG2 MET 27 5.399 17.264 1.500
186 2HG MET 27 HG3 MET 27 6.449 17.785 2.802
187 1HE MET 27 HE1 MET 27 8.478 15.232 2.973
188 2HE MET 27 HE2 MET 27 9.792 15.954 2.014
189 3HE MET 27 HE3 MET 27 8.869 16.959 3.157
190 H LYS 28 HN LYS 28 4.020 13.338 2.036
191 HA LYS 28 HA LYS 28 2.622 14.043 -0.289
192 1HB LYS 28 HB2 LYS 28 4.751 15.448 -0.524
193 2HB LYS 28 HB3 LYS 28 5.609 13.936 -0.745
194 1HG LYS 28 HG2 LYS 28 3.123 14.389 -2.392
195 2HG LYS 28 HG3 LYS 28 4.561 15.292 -2.824
196 1HD LYS 28 HD2 LYS 28 4.981 12.374 -2.305
197 2HD LYS 28 HD3 LYS 28 4.026 12.757 -3.723
198 1HE LYS 28 HE2 LYS 28 6.365 12.642 -4.398
199 2HE LYS 28 HE3 LYS 28 5.854 14.315 -4.500
200 1HZ LYS 28 HZ1 LYS 28 8.042 13.852 -3.306
201 2HZ LYS 28 HZ2 LYS 28 7.007 14.831 -2.518
202 H LYS 29 HN LYS 29 5.301 12.086 1.144
203 HA LYS 29 HA LYS 29 5.147 9.972 -0.618
204 1HB LYS 29 HB2 LYS 29 5.973 10.064 2.296
205 2HB LYS 29 HB3 LYS 29 6.215 8.674 1.257
206 1HG LYS 29 HG2 LYS 29 7.246 11.461 0.560
207 2HG LYS 29 HG3 LYS 29 8.203 10.287 1.442
208 1HD LYS 29 HD2 LYS 29 8.797 9.281 -0.498
209 2HD LYS 29 HD3 LYS 29 7.117 8.938 -0.855
210 1HE LYS 29 HE2 LYS 29 6.833 11.103 -1.962
211 2HE LYS 29 HE3 LYS 29 8.414 11.641 -1.432
212 1HZ LYS 29 HZ1 LYS 29 8.025 9.290 -3.204
213 2HZ LYS 29 HZ2 LYS 29 8.357 10.784 -3.762
214 H ALA 30 HN ALA 30 3.208 10.680 2.342
215 HA ALA 30 HA ALA 30 1.542 8.375 1.776
216 1HB ALA 30 HB1 ALA 30 2.861 8.550 4.487
217 2HB ALA 30 HB2 ALA 30 2.103 7.150 3.689
218 3HB ALA 30 HB3 ALA 30 3.691 7.737 3.138
219 H SER 31 HN SER 31 -0.108 8.230 3.816
220 HA SER 31 HA SER 31 -1.213 10.809 4.134
221 1HB SER 31 HB2 SER 31 -1.866 8.220 5.612
222 2HB SER 31 HB3 SER 31 -2.873 9.654 5.569
223 HG SER 31 HG SER 31 -3.086 9.378 3.251
224 H GLY 32 HN GLY 32 0.891 8.627 6.027
225 1HA GLY 32 HA1 GLY 32 2.011 10.650 7.567
226 2HA GLY 32 HA2 GLY 32 0.692 9.980 8.507
227 H GLY 33 HN GLY 33 2.793 9.476 9.863
228 1HA GLY 33 HA1 GLY 33 2.962 6.737 10.068
229 2HA GLY 33 HA2 GLY 33 4.326 7.204 9.071
230 H HIS 34 HN HIS 34 5.708 6.433 10.877
231 HA HIS 34 HA HIS 34 6.144 8.469 12.851
232 1HB HIS 34 HB2 HIS 34 4.454 6.227 13.447
233 2HB HIS 34 HB3 HIS 34 5.937 6.065 14.366
234 HD1 HIS 34 HD1 HIS 34 3.905 9.218 13.532
235 HD2 HIS 34 HD2 HIS 34 5.337 7.063 16.834
236 HE1 HIS 34 HE1 HIS 34 3.274 10.574 15.599
237 H CYS 35 HN CYS 35 8.090 7.823 14.278
238 HA CYS 35 HA CYS 35 10.028 6.875 12.376
239 1HB CYS 35 HB2 CYS 35 10.443 8.948 13.575
240 2HB CYS 35 HB3 CYS 35 10.332 8.120 15.115
241 H TYR 36 HN TYR 36 9.861 4.581 12.288
242 HA TYR 36 HA TYR 36 10.071 3.018 14.667
243 1HB TYR 36 HB2 TYR 36 9.214 2.410 12.276
244 2HB TYR 36 HB3 TYR 36 10.884 2.461 11.748
245 HD1 TYR 36 HD1 TYR 36 12.183 0.518 11.824
246 HD2 TYR 36 HD2 TYR 36 8.676 0.773 14.261
247 HE1 TYR 36 HE1 TYR 36 12.463 -1.919 12.494
248 HE2 TYR 36 HE2 TYR 36 8.967 -1.664 14.922
249 HH TYR 36 HH TYR 36 11.688 -3.566 13.645
250 H ALA 37 HN ALA 37 12.033 1.529 15.041
251 HA ALA 37 HA ALA 37 13.819 3.385 16.031
252 1HB ALA 37 HB1 ALA 37 14.101 0.373 15.678
253 2HB ALA 37 HB2 ALA 37 15.106 1.380 16.747
254 3HB ALA 37 HB3 ALA 37 13.363 1.209 17.064
255 H MET 38 HN MET 38 13.911 1.389 13.055
256 HA MET 38 HA MET 38 16.698 1.840 12.723
257 1HB MET 38 HB2 MET 38 14.530 0.635 10.915
258 2HB MET 38 HB3 MET 38 16.235 0.617 10.514
259 1HG MET 38 HG2 MET 38 16.429 -0.462 12.985
260 2HG MET 38 HG3 MET 38 14.770 -0.920 12.654
261 1HE MET 38 HE1 MET 38 15.000 -3.101 9.487
262 2HE MET 38 HE2 MET 38 14.004 -2.597 10.873
263 3HE MET 38 HE3 MET 38 14.521 -1.396 9.666
264 H SER 39 HN SER 39 13.651 3.263 11.510
265 HA SER 39 HA SER 39 14.880 5.380 10.219
266 1HB SER 39 HB2 SER 39 14.529 2.886 8.598
267 2HB SER 39 HB3 SER 39 14.035 4.380 7.828
268 HG SER 39 HG SER 39 16.625 3.958 9.059
269 H CYS 40 HN CYS 40 13.166 6.401 8.542
270 HA CYS 40 HA CYS 40 10.842 6.694 10.100
271 1HB CYS 40 HB2 CYS 40 11.686 8.580 8.927
272 2HB CYS 40 HB3 CYS 40 11.655 7.740 7.390
273 H TYR 41 HN TYR 41 9.171 5.221 10.145
274 HA TYR 41 HA TYR 41 8.602 3.707 7.714
275 1HB TYR 41 HB2 TYR 41 8.713 2.538 9.915
276 2HB TYR 41 HB3 TYR 41 7.653 3.729 10.642
277 HD1 TYR 41 HD1 TYR 41 7.796 0.872 8.289
278 HD2 TYR 41 HD2 TYR 41 5.262 3.563 10.443
279 HE1 TYR 41 HE1 TYR 41 5.782 -0.583 7.751
280 HE2 TYR 41 HE2 TYR 41 3.256 2.099 9.898
281 HH TYR 41 HH TYR 41 2.546 0.313 8.926
282 H CYS 42 HN CYS 42 7.115 4.439 6.287
283 HA CYS 42 HA CYS 42 5.126 6.318 7.326
284 1HB CYS 42 HB2 CYS 42 6.157 5.956 4.505
285 2HB CYS 42 HB3 CYS 42 4.874 7.053 4.974
286 H GLU 43 HN GLU 43 2.888 6.060 6.408
287 HA GLU 43 HA GLU 43 2.389 3.331 5.560
288 1HB GLU 43 HB2 GLU 43 2.195 3.836 8.180
289 2HB GLU 43 HB3 GLU 43 0.639 4.499 7.721
290 1HG GLU 43 HG2 GLU 43 0.021 2.352 6.627
291 2HG GLU 43 HG3 GLU 43 1.595 1.684 7.013
292 HE2 GLU 43 HE2 GLU 43 0.592 0.785 10.183
293 H GLY 44 HN GLY 44 0.707 3.155 4.078
294 1HA GLY 44 HA1 GLY 44 -1.208 3.755 2.978
295 2HA GLY 44 HA2 GLY 44 -1.288 5.250 3.889
296 H LEU 45 HN LEU 45 0.829 3.609 1.428
297 HA LEU 45 HA LEU 45 1.279 6.256 0.250
298 1HB LEU 45 HB2 LEU 45 2.858 3.689 0.136
299 2HB LEU 45 HB3 LEU 45 3.171 5.052 -0.920
300 HG LEU 45 HG LEU 45 3.244 6.304 1.487
301 1HD1 LEU 45 HD11 LEU 45 2.870 4.231 2.739
302 2HD1 LEU 45 HD12 LEU 45 4.331 3.524 2.009
303 3HD1 LEU 45 HD13 LEU 45 4.468 4.932 3.088
304 1HD2 LEU 45 HD21 LEU 45 5.697 6.190 1.305
305 2HD2 LEU 45 HD22 LEU 45 5.537 4.882 0.108
306 3HD2 LEU 45 HD23 LEU 45 4.915 6.508 -0.262
307 HA PRO 46 HA PRO 46 -0.571 4.684 -3.487
308 1HB PRO 46 HB2 PRO 46 0.616 6.337 -5.311
309 2HB PRO 46 HB3 PRO 46 -0.854 6.755 -4.453
310 1HG PRO 46 HG2 PRO 46 1.893 7.753 -4.016
311 2HG PRO 46 HG3 PRO 46 0.375 8.447 -3.482
312 1HD PRO 46 HD2 PRO 46 2.250 6.980 -1.881
313 2HD PRO 46 HD3 PRO 46 0.680 7.573 -1.377
314 H GLU 47 HN GLU 47 0.056 3.616 -5.581
315 HA GLU 47 HA GLU 47 1.922 1.766 -4.520
316 1HB GLU 47 HB2 GLU 47 0.248 1.803 -7.064
317 2HB GLU 47 HB3 GLU 47 1.304 0.468 -6.646
318 1HG GLU 47 HG2 GLU 47 0.079 0.191 -4.473
319 2HG GLU 47 HG3 GLU 47 -0.988 1.510 -4.913
320 HE2 GLU 47 HE2 GLU 47 -2.089 1.270 -6.787
321 H ASN 48 HN ASN 48 2.178 4.549 -6.484
322 HA ASN 48 HA ASN 48 4.075 3.575 -8.320
323 1HB ASN 48 HB2 ASN 48 4.380 5.981 -8.893
324 2HB ASN 48 HB3 ASN 48 2.676 5.590 -8.770
325 1HD2 ASN 48 HD21 ASN 48 3.777 8.749 -6.878
326 2HD2 ASN 48 HD22 ASN 48 4.190 8.114 -8.435
327 H ALA 49 HN ALA 49 4.094 4.697 -4.993
328 HA ALA 49 HA ALA 49 6.815 5.634 -5.044
329 1HB ALA 49 HB1 ALA 49 6.406 6.045 -2.648
330 2HB ALA 49 HB2 ALA 49 5.080 6.697 -3.639
331 3HB ALA 49 HB3 ALA 49 4.861 5.169 -2.754
332 H LYS 50 HN LYS 50 8.628 4.458 -4.579
333 HA LYS 50 HA LYS 50 8.226 1.623 -4.185
334 1HB LYS 50 HB2 LYS 50 10.166 3.299 -5.471
335 2HB LYS 50 HB3 LYS 50 10.988 2.327 -4.267
336 1HG LYS 50 HG2 LYS 50 9.008 1.137 -6.259
337 2HG LYS 50 HG3 LYS 50 10.723 1.266 -6.599
338 1HD LYS 50 HD2 LYS 50 9.566 -0.176 -4.166
339 2HD LYS 50 HD3 LYS 50 10.027 -0.979 -5.654
340 1HE LYS 50 HE2 LYS 50 12.068 -1.213 -4.641
341 2HE LYS 50 HE3 LYS 50 12.323 0.446 -5.144
342 1HZ LYS 50 HZ1 LYS 50 11.290 -0.418 -2.496
343 2HZ LYS 50 HZ2 LYS 50 12.743 0.257 -2.788
344 H VAL 51 HN VAL 51 8.515 0.526 -2.297
345 HA VAL 51 HA VAL 51 9.783 2.013 -0.108
346 HB VAL 51 HB VAL 51 8.107 1.354 1.405
347 1HG1 VAL 51 HG11 VAL 51 7.546 3.270 -0.101
348 2HG1 VAL 51 HG12 VAL 51 6.621 2.142 -1.121
349 3HG1 VAL 51 HG13 VAL 51 6.122 2.434 0.562
350 1HG2 VAL 51 HG21 VAL 51 7.624 -0.885 0.885
351 2HG2 VAL 51 HG22 VAL 51 6.100 -0.025 0.559
352 3HG2 VAL 51 HG23 VAL 51 7.163 -0.495 -0.789
353 H SER 52 HN SER 52 10.902 0.590 1.492
354 HA SER 52 HA SER 52 10.903 -2.202 0.751
355 1HB SER 52 HB2 SER 52 13.026 -1.466 1.552
356 2HB SER 52 HB3 SER 52 12.318 -0.572 2.882
357 HG SER 52 HG SER 52 12.954 -3.305 2.687
358 H ASP 53 HN ASP 53 9.912 -3.852 2.083
359 HA ASP 53 HA ASP 53 8.605 -2.861 4.473
360 1HB ASP 53 HB2 ASP 53 6.633 -4.319 4.011
361 2HB ASP 53 HB3 ASP 53 6.812 -3.053 2.813
362 HD2 ASP 53 HD2 ASP 53 6.140 -6.268 1.163
363 H SER 54 HN SER 54 11.160 -4.258 4.010
364 HA SER 54 HA SER 54 10.619 -6.699 5.424
365 1HB SER 54 HB2 SER 54 12.115 -7.983 3.769
366 2HB SER 54 HB3 SER 54 10.482 -7.627 3.241
367 HG SER 54 HG SER 54 12.156 -7.158 1.621
368 H ALA 55 HN ALA 55 11.740 -4.593 6.636
369 HA ALA 55 HA ALA 55 13.507 -3.954 7.804
370 1HB ALA 55 HB1 ALA 55 14.640 -6.676 7.043
371 2HB ALA 55 HB2 ALA 55 15.127 -5.672 8.430
372 3HB ALA 55 HB3 ALA 55 13.496 -6.384 8.375
373 H THR 56 HN THR 56 13.457 -2.753 5.349
374 HA THR 56 HA THR 56 14.869 -1.196 4.583
375 HB THR 56 HB THR 56 17.170 -2.708 5.907
376 HG1 THR 56 HG1 THR 56 16.446 -1.552 7.813
377 1HG2 THR 56 HG21 THR 56 18.256 -0.625 5.966
378 2HG2 THR 56 HG22 THR 56 17.354 -0.456 4.442
379 3HG2 THR 56 HG23 THR 56 16.726 0.283 5.934
380 H ASN 57 HN ASN 57 16.942 -4.172 4.516
381 HA ASN 57 HA ASN 57 18.212 -4.873 2.865
382 1HB ASN 57 HB2 ASN 57 16.871 -5.763 0.907
383 2HB ASN 57 HB3 ASN 57 16.176 -6.180 2.461
384 1HD2 ASN 57 HD21 ASN 57 14.240 -3.797 -0.238
385 2HD2 ASN 57 HD22 ASN 57 15.912 -4.218 -0.402
386 H ILE 58 HN ILE 58 18.185 -1.965 2.986
387 HA ILE 58 HA ILE 58 18.953 -1.436 0.251
388 HB ILE 58 HB ILE 58 16.648 -0.101 1.612
389 1HG1 ILE 58 HG12 ILE 58 17.215 -1.188 -1.151
390 2HG1 ILE 58 HG13 ILE 58 16.040 -1.757 0.019
391 1HG2 ILE 58 HG21 ILE 58 16.847 1.837 0.155
392 2HG2 ILE 58 HG22 ILE 58 18.277 1.694 1.205
393 3HG2 ILE 58 HG23 ILE 58 18.377 1.210 -0.505
394 1HD1 ILE 58 HD11 ILE 58 15.974 0.812 -1.603
395 2HD1 ILE 58 HD12 ILE 58 14.763 -0.490 -1.543
396 3HD1 ILE 58 HD13 ILE 58 14.965 0.602 -0.152
397 H CYS 59 HN CYS 59 20.728 -0.026 0.160
398 HA CYS 59 HA CYS 59 22.734 0.249 1.060
399 1HB CYS 59 HB2 CYS 59 21.019 2.187 2.599
400 2HB CYS 59 HB3 CYS 59 22.752 2.109 2.849
401 H GLY 60 HN GLY 60 21.841 -2.159 1.954
402 1HA GLY 60 HA1 GLY 60 21.985 -3.680 3.611
403 2HA GLY 60 HA2 GLY 60 22.823 -2.498 4.597
Start of MODEL 11
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 -0.936 0.453
3 1HB LYS 1 HB2 LYS 1 3.048 -0.237 -1.433
4 2HB LYS 1 HB3 LYS 1 1.477 -0.737 -2.027
5 1HG LYS 1 HG2 LYS 1 0.781 1.753 -1.874
6 2HG LYS 1 HG3 LYS 1 2.477 2.113 -1.618
7 1HD LYS 1 HD2 LYS 1 1.396 0.574 -4.026
8 2HD LYS 1 HD3 LYS 1 1.752 2.290 -4.035
9 1HE LYS 1 HE2 LYS 1 3.874 1.739 -4.635
10 2HE LYS 1 HE3 LYS 1 4.103 1.166 -2.994
11 1HZ LYS 1 HZ1 LYS 1 4.598 -0.554 -4.676
12 2HZ LYS 1 HZ2 LYS 1 3.391 -1.038 -3.696
13 H ASP 2 HN ASP 2 3.862 0.375 0.883
14 HA ASP 2 HA ASP 2 3.196 2.944 2.025
15 1HB ASP 2 HB2 ASP 2 4.671 0.844 3.661
16 2HB ASP 2 HB3 ASP 2 4.031 2.377 4.219
17 HD2 ASP 2 HD2 ASP 2 0.697 1.034 4.238
18 H GLY 3 HN GLY 3 5.209 4.214 2.504
19 1HA GLY 3 HA1 GLY 3 7.750 3.600 2.640
20 2HA GLY 3 HA2 GLY 3 7.504 3.298 0.932
21 H TYR 4 HN TYR 4 9.095 5.080 0.601
22 HA TYR 4 HA TYR 4 8.009 7.737 1.116
23 1HB TYR 4 HB2 TYR 4 10.575 6.999 -0.368
24 2HB TYR 4 HB3 TYR 4 10.296 8.390 0.660
25 HD1 TYR 4 HD1 TYR 4 9.952 7.914 3.208
26 HD2 TYR 4 HD2 TYR 4 11.701 5.125 0.475
27 HE1 TYR 4 HE1 TYR 4 11.051 6.691 5.148
28 HE2 TYR 4 HE2 TYR 4 12.794 3.912 2.424
29 HH TYR 4 HH TYR 4 11.932 4.596 5.684
30 HA PRO 5 HA PRO 5 6.451 7.667 -2.952
31 1HB PRO 5 HB2 PRO 5 5.128 10.057 -2.875
32 2HB PRO 5 HB3 PRO 5 4.439 8.561 -2.278
33 1HG PRO 5 HG2 PRO 5 5.534 10.839 -0.745
34 2HG PRO 5 HG3 PRO 5 4.476 9.554 -0.196
35 1HD PRO 5 HD2 PRO 5 7.290 9.791 0.304
36 2HD PRO 5 HD3 PRO 5 6.255 8.450 0.751
37 H VAL 6 HN VAL 6 7.205 8.146 -4.948
38 HA VAL 6 HA VAL 6 8.899 10.518 -5.068
39 HB VAL 6 HB VAL 6 10.565 8.962 -6.310
40 1HG1 VAL 6 HG11 VAL 6 11.785 8.553 -4.209
41 2HG1 VAL 6 HG12 VAL 6 11.083 10.188 -4.256
42 3HG1 VAL 6 HG13 VAL 6 10.308 8.914 -3.283
43 1HG2 VAL 6 HG21 VAL 6 10.668 6.678 -5.558
44 2HG2 VAL 6 HG22 VAL 6 9.292 6.924 -4.456
45 3HG2 VAL 6 HG23 VAL 6 9.041 6.972 -6.217
46 H ASP 7 HN ASP 7 7.210 11.420 -6.379
47 HA ASP 7 HA ASP 7 7.422 10.577 -9.088
48 1HB ASP 7 HB2 ASP 7 4.694 10.707 -9.034
49 2HB ASP 7 HB3 ASP 7 5.592 9.204 -8.962
50 HD2 ASP 7 HD2 ASP 7 4.256 10.499 -5.405
51 H SER 8 HN SER 8 5.040 12.321 -6.930
52 HA SER 8 HA SER 8 4.633 14.324 -8.822
53 1HB SER 8 HB2 SER 8 3.300 15.418 -7.064
54 2HB SER 8 HB3 SER 8 2.960 13.699 -7.110
55 HG SER 8 HG SER 8 3.439 14.872 -4.940
56 H LYS 9 HN LYS 9 6.689 14.050 -5.878
57 HA LYS 9 HA LYS 9 7.688 16.746 -6.311
58 1HB LYS 9 HB2 LYS 9 8.721 16.530 -4.167
59 2HB LYS 9 HB3 LYS 9 7.073 15.950 -4.030
60 1HG LYS 9 HG2 LYS 9 8.337 13.607 -4.688
61 2HG LYS 9 HG3 LYS 9 9.644 14.427 -3.858
62 1HD LYS 9 HD2 LYS 9 8.631 13.462 -2.016
63 2HD LYS 9 HD3 LYS 9 7.708 14.951 -2.062
64 1HE LYS 9 HE2 LYS 9 6.763 12.528 -3.630
65 2HE LYS 9 HE3 LYS 9 6.431 12.647 -1.914
66 1HZ LYS 9 HZ1 LYS 9 5.533 14.977 -2.525
67 2HZ LYS 9 HZ2 LYS 9 5.485 14.435 -4.060
68 H GLY 10 HN GLY 10 8.386 13.424 -7.098
69 1HA GLY 10 HA1 GLY 10 10.022 12.782 -8.614
70 2HA GLY 10 HA2 GLY 10 10.933 14.241 -8.280
71 H CYS 11 HN CYS 11 11.648 14.416 -5.789
72 HA CYS 11 HA CYS 11 12.740 11.794 -5.104
73 1HB CYS 11 HB2 CYS 11 14.276 14.312 -5.707
74 2HB CYS 11 HB3 CYS 11 14.933 13.073 -4.656
75 H LYS 12 HN LYS 12 10.847 12.208 -3.416
76 HA LYS 12 HA LYS 12 10.933 11.758 -1.246
77 1HB LYS 12 HB2 LYS 12 13.781 12.778 -1.421
78 2HB LYS 12 HB3 LYS 12 13.069 12.125 0.041
79 1HG LYS 12 HG2 LYS 12 13.112 10.592 -2.596
80 2HG LYS 12 HG3 LYS 12 14.392 10.462 -1.406
81 1HD LYS 12 HD2 LYS 12 12.210 10.052 0.205
82 2HD LYS 12 HD3 LYS 12 11.590 9.416 -1.305
83 1HE LYS 12 HE2 LYS 12 14.254 8.581 -0.063
84 2HE LYS 12 HE3 LYS 12 12.760 7.687 0.127
85 1HZ LYS 12 HZ1 LYS 12 12.690 7.538 -2.362
86 2HZ LYS 12 HZ2 LYS 12 14.178 8.196 -2.430
87 H LEU 13 HN LEU 13 10.634 12.935 0.874
88 HA LEU 13 HA LEU 13 11.617 15.662 0.817
89 1HB LEU 13 HB2 LEU 13 9.631 16.645 1.672
90 2HB LEU 13 HB3 LEU 13 9.253 15.830 0.168
91 HG LEU 13 HG LEU 13 8.807 14.260 2.653
92 1HD1 LEU 13 HD11 LEU 13 8.027 16.447 3.381
93 2HD1 LEU 13 HD12 LEU 13 7.035 16.605 1.911
94 3HD1 LEU 13 HD13 LEU 13 6.652 15.348 3.112
95 1HD2 LEU 13 HD21 LEU 13 7.133 14.678 0.161
96 2HD2 LEU 13 HD22 LEU 13 8.313 13.369 0.410
97 3HD2 LEU 13 HD23 LEU 13 6.863 13.466 1.437
98 H SER 14 HN SER 14 12.160 16.457 2.950
99 HA SER 14 HA SER 14 13.003 14.189 4.488
100 1HB SER 14 HB2 SER 14 14.631 15.946 3.894
101 2HB SER 14 HB3 SER 14 13.661 17.159 4.706
102 HG SER 14 HG SER 14 14.892 14.866 5.982
103 H CYS 15 HN CYS 15 10.426 16.482 4.493
104 HA CYS 15 HA CYS 15 8.919 17.105 5.968
105 1HB CYS 15 HB2 CYS 15 8.204 15.633 7.478
106 2HB CYS 15 HB3 CYS 15 9.436 14.583 6.807
107 H VAL 16 HN VAL 16 8.817 18.863 7.453
108 HA VAL 16 HA VAL 16 11.446 19.831 8.272
109 HB VAL 16 HB VAL 16 9.746 21.120 6.829
110 1HG1 VAL 16 HG11 VAL 16 7.816 20.621 8.374
111 2HG1 VAL 16 HG12 VAL 16 8.546 21.748 9.543
112 3HG1 VAL 16 HG13 VAL 16 8.016 22.338 7.949
113 1HG2 VAL 16 HG21 VAL 16 10.969 22.394 9.300
114 2HG2 VAL 16 HG22 VAL 16 11.777 22.121 7.737
115 3HG2 VAL 16 HG23 VAL 16 10.420 23.268 7.850
116 H ALA 17 HN ALA 17 8.753 18.122 9.485
117 HA ALA 17 HA ALA 17 9.671 18.428 12.173
118 1HB ALA 17 HB1 ALA 17 8.333 20.472 12.000
119 2HB ALA 17 HB2 ALA 17 6.952 19.542 11.372
120 3HB ALA 17 HB3 ALA 17 7.505 19.294 13.046
121 H ASN 18 HN ASN 18 8.389 16.943 13.655
122 HA ASN 18 HA ASN 18 8.538 14.503 12.432
123 1HB ASN 18 HB2 ASN 18 7.127 15.320 15.025
124 2HB ASN 18 HB3 ASN 18 7.433 13.653 14.580
125 1HD2 ASN 18 HD21 ASN 18 10.325 16.050 16.163
126 2HD2 ASN 18 HD22 ASN 18 8.681 16.531 15.905
127 H ASN 19 HN ASN 19 5.762 16.676 13.150
128 HA ASN 19 HA ASN 19 3.819 14.689 12.697
129 1HB ASN 19 HB2 ASN 19 2.223 16.654 12.761
130 2HB ASN 19 HB3 ASN 19 3.308 16.612 14.137
131 1HD2 ASN 19 HD21 ASN 19 3.220 19.744 11.571
132 2HD2 ASN 19 HD22 ASN 19 2.204 18.348 11.433
133 H TYR 20 HN TYR 20 5.718 16.897 10.694
134 HA TYR 20 HA TYR 20 3.716 17.892 9.060
135 1HB TYR 20 HB2 TYR 20 6.135 18.676 9.415
136 2HB TYR 20 HB3 TYR 20 6.688 17.279 8.513
137 HD1 TYR 20 HD1 TYR 20 5.020 20.556 8.273
138 HD2 TYR 20 HD2 TYR 20 6.501 17.190 6.087
139 HE1 TYR 20 HE1 TYR 20 4.851 21.878 6.108
140 HE2 TYR 20 HE2 TYR 20 6.328 18.524 3.929
141 HH TYR 20 HH TYR 20 5.125 21.871 3.972
142 H CYS 21 HN CYS 21 5.672 14.898 8.820
143 HA CYS 21 HA CYS 21 5.279 14.385 6.144
144 1HB CYS 21 HB2 CYS 21 6.898 13.160 7.394
145 2HB CYS 21 HB3 CYS 21 5.685 12.534 8.493
146 H ASP 22 HN ASP 22 3.228 13.726 9.048
147 HA ASP 22 HA ASP 22 1.826 11.662 7.872
148 1HB ASP 22 HB2 ASP 22 1.996 12.269 10.352
149 2HB ASP 22 HB3 ASP 22 0.830 13.544 10.060
150 HD2 ASP 22 HD2 ASP 22 -0.063 12.310 11.705
151 H ASN 23 HN ASN 23 1.038 15.176 8.388
152 HA ASN 23 HA ASN 23 -1.490 14.998 7.218
153 1HB ASN 23 HB2 ASN 23 -1.169 17.583 7.046
154 2HB ASN 23 HB3 ASN 23 -1.118 16.877 8.650
155 1HD2 ASN 23 HD21 ASN 23 2.194 18.557 6.883
156 2HD2 ASN 23 HD22 ASN 23 0.692 18.316 6.055
157 H GLN 24 HN GLN 24 1.834 15.704 6.060
158 HA GLN 24 HA GLN 24 1.110 16.781 3.601
159 1HB GLN 24 HB2 GLN 24 3.356 17.036 4.610
160 2HB GLN 24 HB3 GLN 24 3.653 15.317 4.437
161 1HG GLN 24 HG2 GLN 24 2.887 16.922 1.988
162 2HG GLN 24 HG3 GLN 24 4.526 17.037 2.596
163 1HE2 GLN 24 HE21 GLN 24 4.134 14.294 0.025
164 2HE2 GLN 24 HE22 GLN 24 3.687 15.965 0.098
165 H CYS 25 HN CYS 25 1.431 13.451 4.806
166 HA CYS 25 HA CYS 25 1.466 12.296 2.202
167 1HB CYS 25 HB2 CYS 25 1.009 11.087 4.936
168 2HB CYS 25 HB3 CYS 25 1.109 10.163 3.450
169 H LYS 26 HN LYS 26 -0.974 12.848 4.854
170 HA LYS 26 HA LYS 26 -2.713 10.934 3.660
171 1HB LYS 26 HB2 LYS 26 -4.074 11.254 5.591
172 2HB LYS 26 HB3 LYS 26 -2.404 11.259 6.119
173 1HG LYS 26 HG2 LYS 26 -2.939 13.207 7.182
174 2HG LYS 26 HG3 LYS 26 -2.789 13.945 5.600
175 1HD LYS 26 HD2 LYS 26 -5.245 13.511 5.200
176 2HD LYS 26 HD3 LYS 26 -5.371 12.863 6.823
177 1HE LYS 26 HE2 LYS 26 -4.615 15.053 7.764
178 2HE LYS 26 HE3 LYS 26 -4.467 15.703 6.143
179 1HZ LYS 26 HZ1 LYS 26 -6.863 15.319 5.838
180 2HZ LYS 26 HZ2 LYS 26 -7.000 14.719 7.345
181 H MET 27 HN MET 27 -2.150 14.349 3.307
182 HA MET 27 HA MET 27 -4.762 15.176 2.882
183 1HB MET 27 HB2 MET 27 -3.708 17.203 1.994
184 2HB MET 27 HB3 MET 27 -2.690 16.619 3.296
185 1HG MET 27 HG2 MET 27 -1.311 15.378 1.502
186 2HG MET 27 HG3 MET 27 -2.226 16.265 0.300
187 1HE MET 27 HE1 MET 27 1.076 18.254 0.177
188 2HE MET 27 HE2 MET 27 0.748 16.504 0.190
189 3HE MET 27 HE3 MET 27 -0.278 17.594 -0.772
190 H LYS 28 HN LYS 28 -2.572 13.305 0.899
191 HA LYS 28 HA LYS 28 -4.414 13.425 -1.325
192 1HB LYS 28 HB2 LYS 28 -3.089 15.335 -1.869
193 2HB LYS 28 HB3 LYS 28 -1.594 14.506 -1.487
194 1HG LYS 28 HG2 LYS 28 -1.884 14.556 -3.921
195 2HG LYS 28 HG3 LYS 28 -2.005 12.899 -3.363
196 1HD LYS 28 HD2 LYS 28 -4.405 12.887 -3.572
197 2HD LYS 28 HD3 LYS 28 -4.483 14.632 -3.710
198 1HE LYS 28 HE2 LYS 28 -4.785 13.632 -5.932
199 2HE LYS 28 HE3 LYS 28 -3.271 14.513 -5.899
200 1HZ LYS 28 HZ1 LYS 28 -3.159 12.199 -6.861
201 2HZ LYS 28 HZ2 LYS 28 -2.067 12.481 -5.687
202 H LYS 29 HN LYS 29 -1.111 12.317 -0.230
203 HA LYS 29 HA LYS 29 -1.059 10.442 -2.339
204 1HB LYS 29 HB2 LYS 29 0.731 10.983 0.035
205 2HB LYS 29 HB3 LYS 29 1.054 9.685 -1.096
206 1HG LYS 29 HG2 LYS 29 0.538 12.505 -2.103
207 2HG LYS 29 HG3 LYS 29 2.128 12.049 -1.526
208 1HD LYS 29 HD2 LYS 29 2.189 10.162 -3.163
209 2HD LYS 29 HD3 LYS 29 0.590 10.598 -3.732
210 1HE LYS 29 HE2 LYS 29 1.956 11.683 -5.305
211 2HE LYS 29 HE3 LYS 29 1.646 12.977 -4.165
212 1HZ LYS 29 HZ1 LYS 29 4.024 12.769 -4.691
213 2HZ LYS 29 HZ2 LYS 29 3.779 12.497 -3.104
214 H ALA 30 HN ALA 30 -1.849 10.223 1.195
215 HA ALA 30 HA ALA 30 -1.917 7.312 0.869
216 1HB ALA 30 HB1 ALA 30 -0.247 6.951 2.449
217 2HB ALA 30 HB2 ALA 30 0.373 8.398 1.619
218 3HB ALA 30 HB3 ALA 30 -0.452 8.557 3.189
219 H SER 31 HN SER 31 -2.484 6.432 3.323
220 HA SER 31 HA SER 31 -4.801 7.919 4.132
221 1HB SER 31 HB2 SER 31 -4.940 5.470 4.035
222 2HB SER 31 HB3 SER 31 -3.581 5.309 5.129
223 HG SER 31 HG SER 31 -6.157 6.480 5.756
224 H GLY 32 HN GLY 32 -1.474 7.167 5.217
225 1HA GLY 32 HA1 GLY 32 -1.607 9.391 7.083
226 2HA GLY 32 HA2 GLY 32 -1.342 7.815 7.803
227 H GLY 33 HN GLY 33 0.749 9.117 8.405
228 1HA GLY 33 HA1 GLY 33 2.821 7.790 7.027
229 2HA GLY 33 HA2 GLY 33 2.805 9.476 6.551
230 H HIS 34 HN HIS 34 5.011 8.437 7.941
231 HA HIS 34 HA HIS 34 4.873 10.307 10.142
232 1HB HIS 34 HB2 HIS 34 6.003 8.786 11.699
233 2HB HIS 34 HB3 HIS 34 4.402 8.222 11.263
234 HD1 HIS 34 HD1 HIS 34 8.070 7.514 10.492
235 HD2 HIS 34 HD2 HIS 34 4.310 5.683 10.167
236 HE1 HIS 34 HE1 HIS 34 8.508 5.103 9.778
237 H CYS 35 HN CYS 35 6.999 11.164 10.721
238 HA CYS 35 HA CYS 35 8.617 11.268 8.357
239 1HB CYS 35 HB2 CYS 35 8.033 13.307 9.572
240 2HB CYS 35 HB3 CYS 35 8.854 12.715 11.003
241 H TYR 36 HN TYR 36 9.490 9.063 8.336
242 HA TYR 36 HA TYR 36 11.228 8.223 10.429
243 1HB TYR 36 HB2 TYR 36 10.042 6.859 8.566
244 2HB TYR 36 HB3 TYR 36 11.135 7.598 7.412
245 HD1 TYR 36 HD1 TYR 36 13.080 6.460 6.837
246 HD2 TYR 36 HD2 TYR 36 11.246 5.641 10.614
247 HE1 TYR 36 HE1 TYR 36 14.773 4.612 7.266
248 HE2 TYR 36 HE2 TYR 36 12.945 3.796 11.031
249 HH TYR 36 HH TYR 36 15.436 3.058 8.602
250 H ALA 37 HN ALA 37 13.652 7.898 10.063
251 HA ALA 37 HA ALA 37 14.531 10.526 10.194
252 1HB ALA 37 HB1 ALA 37 15.509 8.672 11.468
253 2HB ALA 37 HB2 ALA 37 16.091 7.921 9.963
254 3HB ALA 37 HB3 ALA 37 16.764 9.479 10.498
255 H MET 38 HN MET 38 14.576 8.122 7.548
256 HA MET 38 HA MET 38 16.572 9.537 6.115
257 1HB MET 38 HB2 MET 38 14.656 7.261 5.362
258 2HB MET 38 HB3 MET 38 15.945 7.816 4.313
259 1HG MET 38 HG2 MET 38 16.423 6.824 7.163
260 2HG MET 38 HG3 MET 38 16.519 5.782 5.757
261 1HE MET 38 HE1 MET 38 17.952 6.752 3.524
262 2HE MET 38 HE2 MET 38 19.676 6.712 3.963
263 3HE MET 38 HE3 MET 38 18.594 5.399 4.486
264 H SER 39 HN SER 39 12.998 9.352 6.112
265 HA SER 39 HA SER 39 12.700 11.653 4.605
266 1HB SER 39 HB2 SER 39 12.856 9.094 3.062
267 2HB SER 39 HB3 SER 39 11.539 10.167 2.631
268 HG SER 39 HG SER 39 14.348 10.879 2.721
269 H CYS 40 HN CYS 40 10.293 11.945 3.962
270 HA CYS 40 HA CYS 40 8.647 11.135 6.046
271 1HB CYS 40 HB2 CYS 40 8.107 13.113 4.877
272 2HB CYS 40 HB3 CYS 40 8.092 12.301 3.324
273 H TYR 41 HN TYR 41 8.246 8.962 6.428
274 HA TYR 41 HA TYR 41 7.791 7.177 4.200
275 1HB TYR 41 HB2 TYR 41 9.008 6.651 6.408
276 2HB TYR 41 HB3 TYR 41 7.501 6.924 7.260
277 HD1 TYR 41 HD1 TYR 41 9.342 4.635 5.046
278 HD2 TYR 41 HD2 TYR 41 5.687 5.289 7.171
279 HE1 TYR 41 HE1 TYR 41 8.713 2.192 4.730
280 HE2 TYR 41 HE2 TYR 41 5.069 2.844 6.847
281 HH TYR 41 HH TYR 41 5.757 0.889 6.190
282 H CYS 42 HN CYS 42 5.859 7.401 3.146
283 HA CYS 42 HA CYS 42 3.554 8.207 4.688
284 1HB CYS 42 HB2 CYS 42 3.991 7.808 1.724
285 2HB CYS 42 HB3 CYS 42 2.444 8.233 2.428
286 H GLU 43 HN GLU 43 1.453 6.912 4.383
287 HA GLU 43 HA GLU 43 2.141 4.090 4.367
288 1HB GLU 43 HB2 GLU 43 2.236 5.385 6.715
289 2HB GLU 43 HB3 GLU 43 0.501 5.146 6.662
290 1HG GLU 43 HG2 GLU 43 0.862 2.686 6.303
291 2HG GLU 43 HG3 GLU 43 2.594 2.936 6.389
292 HE2 GLU 43 HE2 GLU 43 3.312 3.932 8.229
293 H GLY 44 HN GLY 44 0.636 2.974 3.203
294 1HA GLY 44 HA1 GLY 44 -1.436 2.247 2.608
295 2HA GLY 44 HA2 GLY 44 -2.171 3.503 3.583
296 H LEU 45 HN LEU 45 -0.086 3.219 0.610
297 HA LEU 45 HA LEU 45 -1.596 5.434 -0.543
298 1HB LEU 45 HB2 LEU 45 0.949 4.044 -1.387
299 2HB LEU 45 HB3 LEU 45 0.161 5.305 -2.315
300 HG LEU 45 HG LEU 45 0.380 6.640 -0.015
301 1HD1 LEU 45 HD11 LEU 45 2.614 6.107 1.008
302 2HD1 LEU 45 HD12 LEU 45 1.326 4.923 1.336
303 3HD1 LEU 45 HD13 LEU 45 2.577 4.564 0.122
304 1HD2 LEU 45 HD21 LEU 45 2.500 7.593 -0.873
305 2HD2 LEU 45 HD22 LEU 45 2.596 6.258 -2.046
306 3HD2 LEU 45 HD23 LEU 45 1.249 7.420 -2.128
307 HA PRO 46 HA PRO 46 -3.328 2.640 -3.566
308 1HB PRO 46 HB2 PRO 46 -3.850 4.427 -5.567
309 2HB PRO 46 HB3 PRO 46 -4.977 4.086 -4.269
310 1HG PRO 46 HG2 PRO 46 -3.258 6.460 -4.654
311 2HG PRO 46 HG3 PRO 46 -4.669 6.281 -3.631
312 1HD PRO 46 HD2 PRO 46 -1.927 6.280 -2.789
313 2HD PRO 46 HD3 PRO 46 -3.332 5.986 -1.784
314 H GLU 47 HN GLU 47 -2.856 1.819 -5.804
315 HA GLU 47 HA GLU 47 -0.032 1.524 -5.508
316 1HB GLU 47 HB2 GLU 47 -2.091 0.076 -7.225
317 2HB GLU 47 HB3 GLU 47 -0.391 -0.347 -7.203
318 1HG GLU 47 HG2 GLU 47 -0.520 -0.751 -4.737
319 2HG GLU 47 HG3 GLU 47 -2.219 -0.321 -4.754
320 HE2 GLU 47 HE2 GLU 47 -1.105 -3.934 -6.001
321 H ASN 48 HN ASN 48 -1.975 3.641 -7.228
322 HA ASN 48 HA ASN 48 -0.592 3.651 -9.675
323 1HB ASN 48 HB2 ASN 48 -1.695 5.872 -9.991
324 2HB ASN 48 HB3 ASN 48 -2.841 4.679 -9.413
325 1HD2 ASN 48 HD21 ASN 48 -2.921 8.017 -7.536
326 2HD2 ASN 48 HD22 ASN 48 -2.814 7.607 -9.216
327 H ALA 49 HN ALA 49 -0.062 4.913 -6.416
328 HA ALA 49 HA ALA 49 1.845 6.906 -7.286
329 1HB ALA 49 HB1 ALA 49 1.987 7.401 -4.876
330 2HB ALA 49 HB2 ALA 49 0.290 7.335 -5.408
331 3HB ALA 49 HB3 ALA 49 0.996 5.967 -4.515
332 H LYS 50 HN LYS 50 4.073 6.715 -7.207
333 HA LYS 50 HA LYS 50 4.990 3.973 -6.793
334 1HB LYS 50 HB2 LYS 50 5.286 5.280 -8.997
335 2HB LYS 50 HB3 LYS 50 6.518 6.195 -8.152
336 1HG LYS 50 HG2 LYS 50 6.623 3.182 -7.985
337 2HG LYS 50 HG3 LYS 50 7.113 3.941 -9.486
338 1HD LYS 50 HD2 LYS 50 8.777 5.327 -8.288
339 2HD LYS 50 HD3 LYS 50 8.238 4.691 -6.746
340 1HE LYS 50 HE2 LYS 50 8.802 2.331 -7.795
341 2HE LYS 50 HE3 LYS 50 9.738 3.249 -8.957
342 1HZ LYS 50 HZ1 LYS 50 10.888 4.293 -7.008
343 2HZ LYS 50 HZ2 LYS 50 10.111 3.265 -6.012
344 H VAL 51 HN VAL 51 6.365 3.419 -5.159
345 HA VAL 51 HA VAL 51 7.417 5.651 -3.565
346 HB VAL 51 HB VAL 51 6.796 4.590 -1.575
347 1HG1 VAL 51 HG11 VAL 51 4.932 5.687 -2.839
348 2HG1 VAL 51 HG12 VAL 51 4.455 4.080 -3.438
349 3HG1 VAL 51 HG13 VAL 51 4.395 4.434 -1.694
350 1HG2 VAL 51 HG21 VAL 51 5.679 2.305 -1.579
351 2HG2 VAL 51 HG22 VAL 51 6.243 2.133 -3.259
352 3HG2 VAL 51 HG23 VAL 51 7.422 2.327 -1.940
353 H SER 52 HN SER 52 9.446 5.120 -2.371
354 HA SER 52 HA SER 52 10.545 2.546 -3.188
355 1HB SER 52 HB2 SER 52 12.121 4.240 -3.771
356 2HB SER 52 HB3 SER 52 11.858 5.127 -2.283
357 HG SER 52 HG SER 52 13.291 2.658 -2.671
358 H ASP 53 HN ASP 53 11.464 1.164 -1.465
359 HA ASP 53 HA ASP 53 11.054 2.245 1.208
360 1HB ASP 53 HB2 ASP 53 10.646 -0.082 2.011
361 2HB ASP 53 HB3 ASP 53 9.422 0.446 0.872
362 HD2 ASP 53 HD2 ASP 53 10.585 -2.956 0.054
363 H SER 54 HN SER 54 13.419 2.435 -0.550
364 HA SER 54 HA SER 54 15.096 0.274 0.464
365 1HB SER 54 HB2 SER 54 16.301 0.502 -1.810
366 2HB SER 54 HB3 SER 54 14.737 -0.289 -1.810
367 HG SER 54 HG SER 54 14.905 1.279 -3.526
368 H ALA 55 HN ALA 55 14.880 2.803 1.789
369 HA ALA 55 HA ALA 55 16.329 4.105 2.840
370 1HB ALA 55 HB1 ALA 55 18.387 2.216 1.625
371 2HB ALA 55 HB2 ALA 55 18.628 3.262 3.045
372 3HB ALA 55 HB3 ALA 55 17.465 1.916 3.118
373 H THR 56 HN THR 56 15.397 5.211 0.478
374 HA THR 56 HA THR 56 15.821 6.925 -0.877
375 HB THR 56 HB THR 56 18.228 7.354 0.970
376 HG1 THR 56 HG1 THR 56 16.089 6.950 2.013
377 1HG2 THR 56 HG21 THR 56 17.812 9.730 0.558
378 2HG2 THR 56 HG22 THR 56 17.967 8.934 -1.027
379 3HG2 THR 56 HG23 THR 56 16.356 9.355 -0.396
380 H ASN 57 HN ASN 57 16.460 4.675 -2.159
381 HA ASN 57 HA ASN 57 19.014 5.057 -3.350
382 1HB ASN 57 HB2 ASN 57 18.456 3.196 -4.684
383 2HB ASN 57 HB3 ASN 57 17.452 2.903 -3.278
384 1HD2 ASN 57 HD21 ASN 57 14.355 3.772 -4.795
385 2HD2 ASN 57 HD22 ASN 57 15.227 3.481 -3.327
386 H ILE 58 HN ILE 58 15.734 6.347 -3.631
387 HA ILE 58 HA ILE 58 16.713 7.988 -5.861
388 HB ILE 58 HB ILE 58 13.920 7.341 -4.931
389 1HG1 ILE 58 HG12 ILE 58 14.990 7.009 -7.719
390 2HG1 ILE 58 HG13 ILE 58 15.373 5.813 -6.497
391 1HG2 ILE 58 HG21 ILE 58 13.169 8.828 -6.795
392 2HG2 ILE 58 HG22 ILE 58 13.907 9.684 -5.420
393 3HG2 ILE 58 HG23 ILE 58 14.838 9.435 -6.916
394 1HD1 ILE 58 HD11 ILE 58 13.331 5.156 -7.703
395 2HD1 ILE 58 HD12 ILE 58 12.932 5.534 -6.010
396 3HD1 ILE 58 HD13 ILE 58 12.566 6.710 -7.295
397 H CYS 59 HN CYS 59 15.765 11.030 -4.557
398 HA CYS 59 HA CYS 59 17.101 9.943 -6.578
399 1HB CYS 59 HB2 CYS 59 17.603 12.391 -4.943
400 2HB CYS 59 HB3 CYS 59 18.806 11.928 -6.130
401 H GLY 60 HN GLY 60 18.393 10.480 -3.226
402 1HA GLY 60 HA1 GLY 60 20.061 9.474 -2.099
403 2HA GLY 60 HA2 GLY 60 20.021 8.170 -3.269
Start of MODEL 12
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 -1.031 -0.137
3 1HB LYS 1 HB2 LYS 1 1.399 0.586 -2.075
4 2HB LYS 1 HB3 LYS 1 1.878 1.871 -0.985
5 1HG LYS 1 HG2 LYS 1 3.959 1.353 -1.871
6 2HG LYS 1 HG3 LYS 1 3.961 0.253 -0.507
7 1HD LYS 1 HD2 LYS 1 3.016 -1.547 -2.032
8 2HD LYS 1 HD3 LYS 1 3.187 -0.440 -3.379
9 1HE LYS 1 HE2 LYS 1 5.203 -1.638 -3.507
10 2HE LYS 1 HE3 LYS 1 5.697 -0.232 -2.584
11 1HZ LYS 1 HZ1 LYS 1 6.440 -2.291 -1.523
12 2HZ LYS 1 HZ2 LYS 1 5.382 -1.536 -0.542
13 H ASP 2 HN ASP 2 3.324 -1.044 1.457
14 HA ASP 2 HA ASP 2 3.330 1.188 3.287
15 1HB ASP 2 HB2 ASP 2 3.237 -1.681 4.307
16 2HB ASP 2 HB3 ASP 2 3.134 -0.214 5.259
17 HD2 ASP 2 HD2 ASP 2 -0.272 0.276 4.338
18 H GLY 3 HN GLY 3 5.419 1.352 4.424
19 1HA GLY 3 HA1 GLY 3 7.310 -0.430 4.933
20 2HA GLY 3 HA2 GLY 3 7.568 -0.207 3.214
21 H TYR 4 HN TYR 4 9.728 0.646 3.895
22 HA TYR 4 HA TYR 4 9.602 3.322 5.060
23 1HB TYR 4 HB2 TYR 4 11.930 1.491 4.209
24 2HB TYR 4 HB3 TYR 4 12.083 2.917 5.216
25 HD1 TYR 4 HD1 TYR 4 11.157 2.902 7.550
26 HD2 TYR 4 HD2 TYR 4 11.290 -0.627 5.135
27 HE1 TYR 4 HE1 TYR 4 10.850 1.462 9.623
28 HE2 TYR 4 HE2 TYR 4 10.982 -2.055 7.216
29 HH TYR 4 HH TYR 4 10.679 -2.079 9.350
30 HA PRO 5 HA PRO 5 9.687 4.675 0.942
31 1HB PRO 5 HB2 PRO 5 9.275 7.338 1.398
32 2HB PRO 5 HB3 PRO 5 7.975 6.164 1.339
33 1HG PRO 5 HG2 PRO 5 9.168 7.491 3.696
34 2HG PRO 5 HG3 PRO 5 7.629 6.663 3.564
35 1HD PRO 5 HD2 PRO 5 10.022 5.653 4.782
36 2HD PRO 5 HD3 PRO 5 8.519 4.784 4.547
37 H VAL 6 HN VAL 6 10.979 5.668 -0.649
38 HA VAL 6 HA VAL 6 13.222 7.178 0.356
39 HB VAL 6 HB VAL 6 14.306 5.181 0.647
40 1HG1 VAL 6 HG11 VAL 6 12.726 4.123 -1.712
41 2HG1 VAL 6 HG12 VAL 6 14.080 3.236 -0.972
42 3HG1 VAL 6 HG13 VAL 6 12.635 3.620 -0.007
43 1HG2 VAL 6 HG21 VAL 6 14.826 5.559 -2.314
44 2HG2 VAL 6 HG22 VAL 6 15.435 6.677 -1.070
45 3HG2 VAL 6 HG23 VAL 6 15.947 4.972 -1.062
46 H ASP 7 HN ASP 7 13.683 8.793 -1.069
47 HA ASP 7 HA ASP 7 13.538 8.344 -3.837
48 1HB ASP 7 HB2 ASP 7 11.831 10.464 -3.930
49 2HB ASP 7 HB3 ASP 7 11.299 8.798 -4.046
50 HD2 ASP 7 HD2 ASP 7 10.585 10.769 -0.620
51 H SER 8 HN SER 8 12.743 11.272 -1.779
52 HA SER 8 HA SER 8 14.450 12.686 -3.590
53 1HB SER 8 HB2 SER 8 13.402 14.708 -2.622
54 2HB SER 8 HB3 SER 8 12.189 13.541 -3.111
55 HG SER 8 HG SER 8 12.947 14.389 -0.507
56 H LYS 9 HN LYS 9 14.140 12.059 -0.046
57 HA LYS 9 HA LYS 9 16.657 13.465 0.391
58 1HB LYS 9 HB2 LYS 9 16.091 13.291 2.767
59 2HB LYS 9 HB3 LYS 9 14.808 14.060 1.854
60 1HG LYS 9 HG2 LYS 9 14.437 11.150 1.923
61 2HG LYS 9 HG3 LYS 9 14.573 11.799 3.546
62 1HD LYS 9 HD2 LYS 9 12.743 13.076 1.474
63 2HD LYS 9 HD3 LYS 9 12.205 11.735 2.465
64 1HE LYS 9 HE2 LYS 9 12.639 13.016 4.527
65 2HE LYS 9 HE3 LYS 9 13.352 14.326 3.608
66 1HZ LYS 9 HZ1 LYS 9 10.524 13.449 3.351
67 2HZ LYS 9 HZ2 LYS 9 11.017 14.772 4.163
68 H GLY 10 HN GLY 10 15.410 10.327 -0.263
69 1HA GLY 10 HA1 GLY 10 16.742 8.543 -0.795
70 2HA GLY 10 HA2 GLY 10 18.106 9.295 0.009
71 H CYS 11 HN CYS 11 17.906 9.463 2.535
72 HA CYS 11 HA CYS 11 17.455 6.658 3.158
73 1HB CYS 11 HB2 CYS 11 19.260 8.736 4.409
74 2HB CYS 11 HB3 CYS 11 19.053 7.113 5.038
75 H LYS 12 HN LYS 12 15.016 7.394 3.380
76 HA LYS 12 HA LYS 12 13.469 6.966 4.904
77 1HB LYS 12 HB2 LYS 12 15.610 7.132 7.041
78 2HB LYS 12 HB3 LYS 12 14.039 6.368 7.171
79 1HG LYS 12 HG2 LYS 12 16.063 5.507 5.065
80 2HG LYS 12 HG3 LYS 12 16.077 4.833 6.682
81 1HD LYS 12 HD2 LYS 12 14.137 3.622 6.352
82 2HD LYS 12 HD3 LYS 12 13.402 4.861 5.355
83 1HE LYS 12 HE2 LYS 12 15.761 3.238 4.329
84 2HE LYS 12 HE3 LYS 12 14.127 2.613 4.219
85 1HZ LYS 12 HZ1 LYS 12 13.538 4.721 3.031
86 2HZ LYS 12 HZ2 LYS 12 15.112 5.141 3.014
87 H LEU 13 HN LEU 13 12.285 8.060 6.834
88 HA LEU 13 HA LEU 13 12.706 10.936 6.552
89 1HB LEU 13 HB2 LEU 13 10.349 9.585 7.840
90 2HB LEU 13 HB3 LEU 13 10.465 11.213 7.202
91 HG LEU 13 HG LEU 13 10.425 8.648 5.588
92 1HD1 LEU 13 HD11 LEU 13 8.252 9.308 4.848
93 2HD1 LEU 13 HD12 LEU 13 8.265 9.376 6.627
94 3HD1 LEU 13 HD13 LEU 13 8.379 10.877 5.678
95 1HD2 LEU 13 HD21 LEU 13 10.295 10.176 3.610
96 2HD2 LEU 13 HD22 LEU 13 10.729 11.523 4.689
97 3HD2 LEU 13 HD23 LEU 13 11.866 10.176 4.446
98 H SER 14 HN SER 14 13.629 8.375 8.566
99 HA SER 14 HA SER 14 15.185 8.658 10.098
100 1HB SER 14 HB2 SER 14 15.261 11.144 9.250
101 2HB SER 14 HB3 SER 14 14.328 11.507 10.689
102 HG SER 14 HG SER 14 16.044 10.491 11.965
103 H CYS 15 HN CYS 15 12.219 10.612 10.916
104 HA CYS 15 HA CYS 15 11.190 10.869 12.867
105 1HB CYS 15 HB2 CYS 15 10.080 8.851 13.687
106 2HB CYS 15 HB3 CYS 15 9.992 9.004 11.944
107 H VAL 16 HN VAL 16 12.974 11.798 14.092
108 HA VAL 16 HA VAL 16 14.816 10.087 15.434
109 HB VAL 16 HB VAL 16 14.164 13.029 15.672
110 1HG1 VAL 16 HG11 VAL 16 16.335 11.369 16.977
111 2HG1 VAL 16 HG12 VAL 16 16.459 13.133 16.773
112 3HG1 VAL 16 HG13 VAL 16 15.143 12.441 17.752
113 1HG2 VAL 16 HG21 VAL 16 16.267 13.328 14.406
114 2HG2 VAL 16 HG22 VAL 16 16.414 11.561 14.255
115 3HG2 VAL 16 HG23 VAL 16 15.051 12.410 13.487
116 H ALA 17 HN ALA 17 11.554 11.158 15.991
117 HA ALA 17 HA ALA 17 11.746 9.929 18.652
118 1HB ALA 17 HB1 ALA 17 10.048 12.299 17.774
119 2HB ALA 17 HB2 ALA 17 9.903 11.469 19.342
120 3HB ALA 17 HB3 ALA 17 11.404 12.331 18.926
121 H ASN 18 HN ASN 18 9.589 8.895 19.320
122 HA ASN 18 HA ASN 18 9.464 6.951 17.346
123 1HB ASN 18 HB2 ASN 18 7.771 7.352 19.869
124 2HB ASN 18 HB3 ASN 18 7.761 5.880 18.918
125 1HD2 ASN 18 HD21 ASN 18 10.926 4.692 19.921
126 2HD2 ASN 18 HD22 ASN 18 9.708 4.666 18.689
127 H ASN 19 HN ASN 19 7.304 9.621 18.381
128 HA ASN 19 HA ASN 19 5.030 8.522 17.101
129 1HB ASN 19 HB2 ASN 19 4.001 10.769 17.695
130 2HB ASN 19 HB3 ASN 19 4.715 9.945 19.067
131 1HD2 ASN 19 HD21 ASN 19 7.221 12.277 19.726
132 2HD2 ASN 19 HD22 ASN 19 6.454 10.770 20.100
133 H TYR 20 HN TYR 20 7.836 10.293 16.073
134 HA TYR 20 HA TYR 20 6.528 12.452 14.804
135 1HB TYR 20 HB2 TYR 20 8.945 12.123 15.819
136 2HB TYR 20 HB3 TYR 20 9.335 11.290 14.327
137 HD1 TYR 20 HD1 TYR 20 9.644 12.506 12.248
138 HD2 TYR 20 HD2 TYR 20 8.493 14.556 15.823
139 HE1 TYR 20 HE1 TYR 20 10.200 14.734 11.158
140 HE2 TYR 20 HE2 TYR 20 9.053 16.777 14.720
141 HH TYR 20 HH TYR 20 10.247 16.877 11.371
142 H CYS 21 HN CYS 21 7.322 9.182 13.816
143 HA CYS 21 HA CYS 21 7.696 9.566 11.107
144 1HB CYS 21 HB2 CYS 21 8.203 7.461 12.063
145 2HB CYS 21 HB3 CYS 21 6.582 7.260 12.697
146 H ASP 22 HN ASP 22 4.681 9.202 13.108
147 HA ASP 22 HA ASP 22 3.184 8.306 10.977
148 1HB ASP 22 HB2 ASP 22 2.632 8.035 13.419
149 2HB ASP 22 HB3 ASP 22 2.237 9.741 13.504
150 HD2 ASP 22 HD2 ASP 22 -1.017 9.002 12.749
151 H ASN 23 HN ASN 23 3.432 11.558 12.588
152 HA ASN 23 HA ASN 23 1.547 12.791 10.964
153 1HB ASN 23 HB2 ASN 23 2.783 14.933 11.754
154 2HB ASN 23 HB3 ASN 23 2.135 13.899 13.012
155 1HD2 ASN 23 HD21 ASN 23 6.153 14.529 12.548
156 2HD2 ASN 23 HD22 ASN 23 4.948 15.170 11.482
157 H GLN 24 HN GLN 24 5.043 12.106 10.687
158 HA GLN 24 HA GLN 24 5.501 14.060 8.697
159 1HB GLN 24 HB2 GLN 24 7.286 13.311 10.228
160 2HB GLN 24 HB3 GLN 24 7.171 11.676 9.607
161 1HG GLN 24 HG2 GLN 24 8.080 12.274 7.490
162 2HG GLN 24 HG3 GLN 24 7.714 13.975 7.703
163 1HE2 GLN 24 HE21 GLN 24 10.893 12.289 9.784
164 2HE2 GLN 24 HE22 GLN 24 9.401 11.437 9.562
165 H CYS 25 HN CYS 25 4.359 10.735 8.766
166 HA CYS 25 HA CYS 25 5.015 10.227 6.029
167 1HB CYS 25 HB2 CYS 25 3.301 8.735 8.022
168 2HB CYS 25 HB3 CYS 25 3.586 8.193 6.380
169 H LYS 26 HN LYS 26 2.103 11.069 8.020
170 HA LYS 26 HA LYS 26 0.369 10.805 5.765
171 1HB LYS 26 HB2 LYS 26 -1.378 11.146 7.283
172 2HB LYS 26 HB3 LYS 26 -0.165 10.281 8.206
173 1HG LYS 26 HG2 LYS 26 0.686 12.688 8.886
174 2HG LYS 26 HG3 LYS 26 -0.890 13.225 8.340
175 1HD LYS 26 HD2 LYS 26 -0.447 11.031 10.420
176 2HD LYS 26 HD3 LYS 26 -0.797 12.703 10.811
177 1HE LYS 26 HE2 LYS 26 -2.994 12.099 10.744
178 2HE LYS 26 HE3 LYS 26 -2.824 12.112 9.000
179 1HZ LYS 26 HZ1 LYS 26 -2.322 9.759 9.045
180 2HZ LYS 26 HZ2 LYS 26 -2.296 9.714 10.673
181 H MET 27 HN MET 27 2.507 13.238 6.934
182 HA MET 27 HA MET 27 1.368 15.554 6.180
183 1HB MET 27 HB2 MET 27 3.772 15.078 6.976
184 2HB MET 27 HB3 MET 27 4.161 14.605 5.334
185 1HG MET 27 HG2 MET 27 3.071 17.008 4.765
186 2HG MET 27 HG3 MET 27 3.531 17.347 6.422
187 1HE MET 27 HE1 MET 27 6.135 15.422 6.745
188 2HE MET 27 HE2 MET 27 7.357 16.679 6.437
189 3HE MET 27 HE3 MET 27 5.898 17.068 7.380
190 H LYS 28 HN LYS 28 2.459 12.867 4.047
191 HA LYS 28 HA LYS 28 1.523 14.194 1.698
192 1HB LYS 28 HB2 LYS 28 3.559 15.502 2.123
193 2HB LYS 28 HB3 LYS 28 4.514 14.034 2.172
194 1HG LYS 28 HG2 LYS 28 2.823 14.286 -0.261
195 2HG LYS 28 HG3 LYS 28 4.031 15.546 -0.106
196 1HD LYS 28 HD2 LYS 28 5.776 13.733 0.283
197 2HD LYS 28 HD3 LYS 28 4.543 12.535 -0.053
198 1HE LYS 28 HE2 LYS 28 5.696 12.870 -2.132
199 2HE LYS 28 HE3 LYS 28 4.163 13.701 -2.309
200 1HZ LYS 28 HZ1 LYS 28 6.739 15.002 -1.598
201 2HZ LYS 28 HZ2 LYS 28 5.981 15.121 -3.034
202 H LYS 29 HN LYS 29 3.807 11.710 3.056
203 HA LYS 29 HA LYS 29 3.941 10.358 0.601
204 1HB LYS 29 HB2 LYS 29 4.775 9.652 3.420
205 2HB LYS 29 HB3 LYS 29 5.027 8.562 2.072
206 1HG LYS 29 HG2 LYS 29 5.933 11.449 1.857
207 2HG LYS 29 HG3 LYS 29 6.918 10.294 2.732
208 1HD LYS 29 HD2 LYS 29 7.146 8.872 0.764
209 2HD LYS 29 HD3 LYS 29 5.942 9.794 -0.115
210 1HE LYS 29 HE2 LYS 29 8.078 10.547 -0.931
211 2HE LYS 29 HE3 LYS 29 7.475 11.833 0.096
212 1HZ LYS 29 HZ1 LYS 29 8.919 11.137 1.849
213 2HZ LYS 29 HZ2 LYS 29 9.312 9.738 1.113
214 H ALA 30 HN ALA 30 1.885 9.889 3.558
215 HA ALA 30 HA ALA 30 0.827 7.468 2.314
216 1HB ALA 30 HB1 ALA 30 1.660 6.030 3.935
217 2HB ALA 30 HB2 ALA 30 3.017 7.171 3.778
218 3HB ALA 30 HB3 ALA 30 1.873 7.329 5.132
219 H SER 31 HN SER 31 -0.653 6.454 4.379
220 HA SER 31 HA SER 31 -2.399 8.646 5.042
221 1HB SER 31 HB2 SER 31 -4.021 6.989 5.603
222 2HB SER 31 HB3 SER 31 -3.205 6.372 4.180
223 HG SER 31 HG SER 31 -1.835 5.086 5.643
224 H GLY 32 HN GLY 32 -0.092 6.353 6.520
225 1HA GLY 32 HA1 GLY 32 0.057 8.024 8.879
226 2HA GLY 32 HA2 GLY 32 -0.591 6.421 9.164
227 H GLY 33 HN GLY 33 1.441 6.247 10.546
228 1HA GLY 33 HA1 GLY 33 3.096 4.380 9.315
229 2HA GLY 33 HA2 GLY 33 3.966 5.901 9.319
230 H HIS 34 HN HIS 34 5.046 3.833 10.793
231 HA HIS 34 HA HIS 34 4.923 5.192 13.355
232 1HB HIS 34 HB2 HIS 34 3.550 3.266 13.758
233 2HB HIS 34 HB3 HIS 34 4.706 2.197 12.988
234 HD1 HIS 34 HD1 HIS 34 6.782 1.456 14.364
235 HD2 HIS 34 HD2 HIS 34 4.226 4.084 16.402
236 HE1 HIS 34 HE1 HIS 34 7.515 1.414 16.808
237 H CYS 35 HN CYS 35 6.959 4.996 14.581
238 HA CYS 35 HA CYS 35 9.137 4.939 12.696
239 1HB CYS 35 HB2 CYS 35 8.804 6.790 14.340
240 2HB CYS 35 HB3 CYS 35 9.162 5.661 15.633
241 H TYR 36 HN TYR 36 9.697 2.788 12.245
242 HA TYR 36 HA TYR 36 9.960 0.991 14.552
243 1HB TYR 36 HB2 TYR 36 8.437 0.607 12.428
244 2HB TYR 36 HB3 TYR 36 9.930 0.414 11.532
245 HD1 TYR 36 HD1 TYR 36 11.459 -1.509 12.052
246 HD2 TYR 36 HD2 TYR 36 7.576 -1.153 13.813
247 HE1 TYR 36 HE1 TYR 36 11.514 -3.969 12.690
248 HE2 TYR 36 HE2 TYR 36 7.644 -3.615 14.444
249 HH TYR 36 HH TYR 36 8.764 -5.454 14.386
250 H ALA 37 HN ALA 37 11.920 0.087 15.083
251 HA ALA 37 HA ALA 37 14.146 0.149 15.256
252 1HB ALA 37 HB1 ALA 37 15.275 -0.951 13.365
253 2HB ALA 37 HB2 ALA 37 13.707 -1.724 13.697
254 3HB ALA 37 HB3 ALA 37 13.875 -0.610 12.319
255 H MET 38 HN MET 38 13.237 2.745 15.080
256 HA MET 38 HA MET 38 13.926 4.773 14.695
257 1HB MET 38 HB2 MET 38 16.202 3.217 15.217
258 2HB MET 38 HB3 MET 38 16.663 4.058 13.751
259 1HG MET 38 HG2 MET 38 15.608 5.412 16.282
260 2HG MET 38 HG3 MET 38 17.296 5.331 15.818
261 1HE MET 38 HE1 MET 38 17.709 7.721 12.937
262 2HE MET 38 HE2 MET 38 18.445 6.943 14.358
263 3HE MET 38 HE3 MET 38 17.811 5.947 13.026
264 H SER 39 HN SER 39 12.650 3.483 12.452
265 HA SER 39 HA SER 39 13.437 5.529 10.637
266 1HB SER 39 HB2 SER 39 13.804 2.609 9.978
267 2HB SER 39 HB3 SER 39 13.265 3.685 8.704
268 HG SER 39 HG SER 39 15.601 4.199 10.335
269 H CYS 40 HN CYS 40 11.693 5.935 8.998
270 HA CYS 40 HA CYS 40 9.274 5.588 10.492
271 1HB CYS 40 HB2 CYS 40 9.885 7.792 9.701
272 2HB CYS 40 HB3 CYS 40 9.927 7.233 8.041
273 H TYR 41 HN TYR 41 8.502 3.452 10.154
274 HA TYR 41 HA TYR 41 8.119 2.446 7.506
275 1HB TYR 41 HB2 TYR 41 8.349 1.111 9.671
276 2HB TYR 41 HB3 TYR 41 6.871 1.845 10.261
277 HD1 TYR 41 HD1 TYR 41 8.200 -0.339 7.540
278 HD2 TYR 41 HD2 TYR 41 4.776 0.866 9.804
279 HE1 TYR 41 HE1 TYR 41 6.841 -2.218 6.498
280 HE2 TYR 41 HE2 TYR 41 3.429 -1.017 8.755
281 HH TYR 41 HH TYR 41 3.444 -2.714 7.426
282 H CYS 42 HN CYS 42 6.875 3.774 6.186
283 HA CYS 42 HA CYS 42 4.613 5.104 7.389
284 1HB CYS 42 HB2 CYS 42 5.884 5.307 4.654
285 2HB CYS 42 HB3 CYS 42 4.449 6.194 5.127
286 H GLU 43 HN GLU 43 2.425 4.976 6.267
287 HA GLU 43 HA GLU 43 2.060 2.259 5.302
288 1HB GLU 43 HB2 GLU 43 0.834 3.495 7.794
289 2HB GLU 43 HB3 GLU 43 0.095 2.124 6.992
290 1HG GLU 43 HG2 GLU 43 2.198 0.815 7.251
291 2HG GLU 43 HG3 GLU 43 2.977 2.192 8.005
292 HE2 GLU 43 HE2 GLU 43 1.286 1.736 11.043
293 H GLY 44 HN GLY 44 0.747 2.267 3.529
294 1HA GLY 44 HA1 GLY 44 -1.247 2.658 2.444
295 2HA GLY 44 HA2 GLY 44 -1.611 3.976 3.539
296 H LEU 45 HN LEU 45 1.135 3.189 1.276
297 HA LEU 45 HA LEU 45 1.058 5.947 0.359
298 1HB LEU 45 HB2 LEU 45 2.998 3.678 -0.089
299 2HB LEU 45 HB3 LEU 45 3.132 5.242 -0.868
300 HG LEU 45 HG LEU 45 2.989 6.067 1.692
301 1HD1 LEU 45 HD11 LEU 45 4.411 4.547 3.073
302 2HD1 LEU 45 HD12 LEU 45 2.792 3.906 2.706
303 3HD1 LEU 45 HD13 LEU 45 4.211 3.299 1.819
304 1HD2 LEU 45 HD21 LEU 45 5.482 6.155 1.656
305 2HD2 LEU 45 HD22 LEU 45 5.452 5.140 0.193
306 3HD2 LEU 45 HD23 LEU 45 4.708 6.757 0.170
307 HA PRO 46 HA PRO 46 -0.362 4.610 -3.670
308 1HB PRO 46 HB2 PRO 46 0.724 6.575 -5.227
309 2HB PRO 46 HB3 PRO 46 -0.840 6.723 -4.450
310 1HG PRO 46 HG2 PRO 46 1.725 7.988 -3.706
311 2HG PRO 46 HG3 PRO 46 0.100 8.437 -3.227
312 1HD PRO 46 HD2 PRO 46 2.036 7.042 -1.634
313 2HD PRO 46 HD3 PRO 46 0.374 7.388 -1.199
314 H GLU 47 HN GLU 47 0.479 3.688 -5.700
315 HA GLU 47 HA GLU 47 2.517 2.065 -4.620
316 1HB GLU 47 HB2 GLU 47 2.079 0.604 -6.480
317 2HB GLU 47 HB3 GLU 47 0.534 1.264 -5.983
318 1HG GLU 47 HG2 GLU 47 0.871 3.081 -7.784
319 2HG GLU 47 HG3 GLU 47 2.230 2.137 -8.362
320 HE2 GLU 47 HE2 GLU 47 -1.489 0.837 -9.044
321 H ASN 48 HN ASN 48 2.514 4.938 -6.502
322 HA ASN 48 HA ASN 48 4.626 4.311 -8.231
323 1HB ASN 48 HB2 ASN 48 4.617 6.700 -8.760
324 2HB ASN 48 HB3 ASN 48 2.952 6.199 -8.544
325 1HD2 ASN 48 HD21 ASN 48 4.722 8.971 -6.136
326 2HD2 ASN 48 HD22 ASN 48 5.556 8.119 -7.393
327 H ALA 49 HN ALA 49 4.355 5.151 -4.849
328 HA ALA 49 HA ALA 49 6.925 6.425 -4.653
329 1HB ALA 49 HB1 ALA 49 4.981 5.440 -2.525
330 2HB ALA 49 HB2 ALA 49 6.373 6.517 -2.259
331 3HB ALA 49 HB3 ALA 49 4.994 7.070 -3.238
332 H LYS 50 HN LYS 50 8.855 5.414 -4.386
333 HA LYS 50 HA LYS 50 8.874 2.553 -4.210
334 1HB LYS 50 HB2 LYS 50 10.491 4.398 -5.404
335 2HB LYS 50 HB3 LYS 50 11.411 4.057 -3.953
336 1HG LYS 50 HG2 LYS 50 10.285 1.845 -5.724
337 2HG LYS 50 HG3 LYS 50 11.871 2.541 -5.990
338 1HD LYS 50 HD2 LYS 50 11.121 1.507 -3.238
339 2HD LYS 50 HD3 LYS 50 11.628 0.382 -4.483
340 1HE LYS 50 HE2 LYS 50 13.794 1.421 -4.694
341 2HE LYS 50 HE3 LYS 50 13.285 2.848 -3.814
342 1HZ LYS 50 HZ1 LYS 50 13.504 0.136 -2.619
343 2HZ LYS 50 HZ2 LYS 50 14.587 1.334 -2.411
344 H VAL 51 HN VAL 51 8.765 1.415 -2.355
345 HA VAL 51 HA VAL 51 10.026 2.641 -0.001
346 HB VAL 51 HB VAL 51 8.332 1.819 1.394
347 1HG1 VAL 51 HG11 VAL 51 7.753 3.843 0.014
348 2HG1 VAL 51 HG12 VAL 51 6.834 2.769 -1.067
349 3HG1 VAL 51 HG13 VAL 51 6.352 2.940 0.638
350 1HG2 VAL 51 HG21 VAL 51 6.410 0.436 0.475
351 2HG2 VAL 51 HG22 VAL 51 7.396 0.197 -0.988
352 3HG2 VAL 51 HG23 VAL 51 7.982 -0.391 0.587
353 H SER 52 HN SER 52 11.378 1.270 1.229
354 HA SER 52 HA SER 52 11.829 -1.353 0.171
355 1HB SER 52 HB2 SER 52 13.793 -0.289 0.984
356 2HB SER 52 HB3 SER 52 13.001 0.277 2.441
357 HG SER 52 HG SER 52 13.921 -2.369 1.799
358 H ASP 53 HN ASP 53 11.166 -3.332 1.161
359 HA ASP 53 HA ASP 53 9.705 -2.993 3.661
360 1HB ASP 53 HB2 ASP 53 8.669 -5.205 3.150
361 2HB ASP 53 HB3 ASP 53 8.320 -4.014 1.913
362 HD2 ASP 53 HD2 ASP 53 10.901 -5.797 -0.107
363 H SER 54 HN SER 54 12.662 -3.071 3.331
364 HA SER 54 HA SER 54 13.229 -5.745 4.345
365 1HB SER 54 HB2 SER 54 15.463 -5.515 3.092
366 2HB SER 54 HB3 SER 54 14.043 -5.819 2.113
367 HG SER 54 HG SER 54 15.183 -4.138 1.119
368 H ALA 55 HN ALA 55 12.711 -3.288 5.887
369 HA ALA 55 HA ALA 55 13.487 -2.605 7.843
370 1HB ALA 55 HB1 ALA 55 15.036 -4.091 9.026
371 2HB ALA 55 HB2 ALA 55 13.847 -5.052 8.115
372 3HB ALA 55 HB3 ALA 55 15.502 -4.861 7.490
373 H THR 56 HN THR 56 14.303 -1.045 5.701
374 HA THR 56 HA THR 56 15.722 0.616 5.270
375 HB THR 56 HB THR 56 16.480 0.118 8.198
376 HG1 THR 56 HG1 THR 56 14.199 0.483 7.824
377 1HG2 THR 56 HG21 THR 56 16.816 2.639 8.160
378 2HG2 THR 56 HG22 THR 56 18.032 1.752 7.210
379 3HG2 THR 56 HG23 THR 56 16.688 2.578 6.386
380 H ASN 57 HN ASN 57 16.693 -1.158 3.808
381 HA ASN 57 HA ASN 57 19.352 -1.843 4.574
382 1HB ASN 57 HB2 ASN 57 19.514 -2.786 2.303
383 2HB ASN 57 HB3 ASN 57 17.974 -3.251 2.999
384 1HD2 ASN 57 HD21 ASN 57 15.929 -1.440 0.810
385 2HD2 ASN 57 HD22 ASN 57 16.079 -2.464 2.199
386 H ILE 58 HN ILE 58 17.617 0.840 3.140
387 HA ILE 58 HA ILE 58 19.865 1.933 1.741
388 HB ILE 58 HB ILE 58 17.163 3.042 2.499
389 1HG1 ILE 58 HG12 ILE 58 17.513 2.798 -0.301
390 2HG1 ILE 58 HG13 ILE 58 18.080 1.294 0.397
391 1HG2 ILE 58 HG21 ILE 58 19.342 4.272 0.791
392 2HG2 ILE 58 HG22 ILE 58 17.664 4.858 0.891
393 3HG2 ILE 58 HG23 ILE 58 18.706 4.891 2.334
394 1HD1 ILE 58 HD11 ILE 58 15.387 2.600 1.002
395 2HD1 ILE 58 HD12 ILE 58 15.643 1.209 -0.078
396 3HD1 ILE 58 HD13 ILE 58 15.962 1.052 1.667
397 H CYS 59 HN CYS 59 21.238 3.666 2.427
398 HA CYS 59 HA CYS 59 22.832 3.984 3.924
399 1HB CYS 59 HB2 CYS 59 20.399 5.135 5.258
400 2HB CYS 59 HB3 CYS 59 21.955 5.182 6.064
401 H GLY 60 HN GLY 60 22.032 1.289 3.877
402 1HA GLY 60 HA1 GLY 60 22.480 -0.577 5.046
403 2HA GLY 60 HA2 GLY 60 23.295 0.436 6.221
Start of MODEL 13
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 -1.025 -0.175
3 1HB LYS 1 HB2 LYS 1 1.415 0.643 -2.059
4 2HB LYS 1 HB3 LYS 1 1.855 1.906 -0.927
5 1HG LYS 1 HG2 LYS 1 3.937 1.422 -1.882
6 2HG LYS 1 HG3 LYS 1 3.980 0.403 -0.457
7 1HD LYS 1 HD2 LYS 1 3.340 -1.567 -1.747
8 2HD LYS 1 HD3 LYS 1 2.991 -0.597 -3.164
9 1HE LYS 1 HE2 LYS 1 5.393 0.058 -3.325
10 2HE LYS 1 HE3 LYS 1 5.754 -0.873 -1.885
11 1HZ LYS 1 HZ1 LYS 1 4.709 -1.994 -4.431
12 2HZ LYS 1 HZ2 LYS 1 6.223 -2.178 -3.862
13 H ASP 2 HN ASP 2 2.095 -1.513 2.004
14 HA ASP 2 HA ASP 2 3.146 0.718 3.513
15 1HB ASP 2 HB2 ASP 2 1.354 -1.314 4.877
16 2HB ASP 2 HB3 ASP 2 1.853 0.259 5.467
17 HD2 ASP 2 HD2 ASP 2 -0.686 1.927 3.704
18 H GLY 3 HN GLY 3 4.757 -0.005 5.109
19 1HA GLY 3 HA1 GLY 3 5.300 -2.342 6.206
20 2HA GLY 3 HA2 GLY 3 5.807 -2.675 4.562
21 H TYR 4 HN TYR 4 8.051 -2.821 4.968
22 HA TYR 4 HA TYR 4 9.254 -0.485 6.286
23 1HB TYR 4 HB2 TYR 4 10.349 -3.320 5.809
24 2HB TYR 4 HB3 TYR 4 10.976 -2.147 6.949
25 HD1 TYR 4 HD1 TYR 4 9.538 -1.519 8.969
26 HD2 TYR 4 HD2 TYR 4 8.663 -4.860 6.444
27 HE1 TYR 4 HE1 TYR 4 8.082 -2.525 10.793
28 HE2 TYR 4 HE2 TYR 4 7.209 -5.855 8.277
29 HH TYR 4 HH TYR 4 6.422 -5.627 10.269
30 HA PRO 5 HA PRO 5 10.757 0.153 2.230
31 1HB PRO 5 HB2 PRO 5 11.675 2.702 2.589
32 2HB PRO 5 HB3 PRO 5 10.008 2.330 2.197
33 1HG PRO 5 HG2 PRO 5 11.162 3.165 4.788
34 2HG PRO 5 HG3 PRO 5 9.488 3.201 4.268
35 1HD PRO 5 HD2 PRO 5 10.695 1.294 6.039
36 2HD PRO 5 HD3 PRO 5 9.052 1.265 5.428
37 H VAL 6 HN VAL 6 12.748 0.481 1.019
38 HA VAL 6 HA VAL 6 15.093 0.400 2.746
39 HB VAL 6 HB VAL 6 14.989 -1.855 2.528
40 1HG1 VAL 6 HG11 VAL 6 14.088 -3.029 0.476
41 2HG1 VAL 6 HG12 VAL 6 12.901 -2.069 1.391
42 3HG1 VAL 6 HG13 VAL 6 13.583 -1.432 -0.125
43 1HG2 VAL 6 HG21 VAL 6 16.583 -2.605 0.944
44 2HG2 VAL 6 HG22 VAL 6 16.169 -1.311 -0.206
45 3HG2 VAL 6 HG23 VAL 6 17.023 -0.918 1.305
46 H ASP 7 HN ASP 7 16.654 1.755 1.983
47 HA ASP 7 HA ASP 7 16.973 2.293 -0.741
48 1HB ASP 7 HB2 ASP 7 16.314 4.859 -0.264
49 2HB ASP 7 HB3 ASP 7 15.157 3.710 -0.904
50 HD2 ASP 7 HD2 ASP 7 15.505 5.982 1.287
51 H SER 8 HN SER 8 16.988 4.297 2.363
52 HA SER 8 HA SER 8 19.080 5.729 1.115
53 1HB SER 8 HB2 SER 8 18.918 7.084 3.334
54 2HB SER 8 HB3 SER 8 17.539 7.095 2.253
55 HG SER 8 HG SER 8 16.877 6.706 4.444
56 H LYS 9 HN LYS 9 18.729 3.622 4.026
57 HA LYS 9 HA LYS 9 21.664 3.532 4.146
58 1HB LYS 9 HB2 LYS 9 21.444 3.146 6.570
59 2HB LYS 9 HB3 LYS 9 20.834 4.714 6.082
60 1HG LYS 9 HG2 LYS 9 18.773 2.581 6.011
61 2HG LYS 9 HG3 LYS 9 19.443 2.842 7.609
62 1HD LYS 9 HD2 LYS 9 18.615 5.236 5.948
63 2HD LYS 9 HD3 LYS 9 17.381 4.295 6.763
64 1HE LYS 9 HE2 LYS 9 18.551 4.625 8.943
65 2HE LYS 9 HE3 LYS 9 19.813 5.537 8.138
66 1HZ LYS 9 HZ1 LYS 9 18.098 6.990 9.107
67 2HZ LYS 9 HZ2 LYS 9 18.153 7.187 7.491
68 H GLY 10 HN GLY 10 19.170 1.951 2.875
69 1HA GLY 10 HA1 GLY 10 19.165 -0.189 2.076
70 2HA GLY 10 HA2 GLY 10 20.484 -0.612 3.149
71 H CYS 11 HN CYS 11 19.879 -0.609 5.621
72 HA CYS 11 HA CYS 11 17.691 -2.494 5.649
73 1HB CYS 11 HB2 CYS 11 19.906 -1.879 7.607
74 2HB CYS 11 HB3 CYS 11 18.605 -2.999 7.959
75 H LYS 12 HN LYS 12 16.243 -0.380 5.342
76 HA LYS 12 HA LYS 12 14.378 0.361 6.272
77 1HB LYS 12 HB2 LYS 12 15.201 -0.794 8.939
78 2HB LYS 12 HB3 LYS 12 13.584 -0.486 8.339
79 1HG LYS 12 HG2 LYS 12 15.544 -2.603 7.349
80 2HG LYS 12 HG3 LYS 12 14.007 -2.874 8.148
81 1HD LYS 12 HD2 LYS 12 12.956 -1.566 6.134
82 2HD LYS 12 HD3 LYS 12 14.496 -1.821 5.337
83 1HE LYS 12 HE2 LYS 12 14.224 -4.328 5.854
84 2HE LYS 12 HE3 LYS 12 12.590 -3.968 6.373
85 1HZ LYS 12 HZ1 LYS 12 12.200 -3.002 4.129
86 2HZ LYS 12 HZ2 LYS 12 13.689 -3.466 3.660
87 H LEU 13 HN LEU 13 13.566 2.028 7.939
88 HA LEU 13 HA LEU 13 15.715 3.921 8.425
89 1HB LEU 13 HB2 LEU 13 12.774 4.325 8.922
90 2HB LEU 13 HB3 LEU 13 14.021 5.539 8.715
91 HG LEU 13 HG LEU 13 12.967 3.684 6.563
92 1HD1 LEU 13 HD11 LEU 13 11.975 5.674 5.583
93 2HD1 LEU 13 HD12 LEU 13 11.375 5.432 7.242
94 3HD1 LEU 13 HD13 LEU 13 12.608 6.673 6.913
95 1HD2 LEU 13 HD21 LEU 13 15.229 4.049 6.022
96 2HD2 LEU 13 HD22 LEU 13 14.312 5.222 5.046
97 3HD2 LEU 13 HD23 LEU 13 15.161 5.758 6.516
98 H SER 14 HN SER 14 14.109 1.350 10.027
99 HA SER 14 HA SER 14 14.798 0.460 11.906
100 1HB SER 14 HB2 SER 14 16.911 1.938 11.578
101 2HB SER 14 HB3 SER 14 16.188 3.032 12.740
102 HG SER 14 HG SER 14 17.619 1.514 13.775
103 H CYS 15 HN CYS 15 14.305 4.018 12.614
104 HA CYS 15 HA CYS 15 13.173 5.026 14.201
105 1HB CYS 15 HB2 CYS 15 11.017 4.505 14.503
106 2HB CYS 15 HB3 CYS 15 11.321 3.364 13.208
107 H VAL 16 HN VAL 16 13.784 5.365 16.347
108 HA VAL 16 HA VAL 16 14.254 2.965 17.963
109 HB VAL 16 HB VAL 16 16.152 4.146 19.021
110 1HG1 VAL 16 HG11 VAL 16 16.495 2.453 17.247
111 2HG1 VAL 16 HG12 VAL 16 16.481 3.749 16.028
112 3HG1 VAL 16 HG13 VAL 16 17.769 3.696 17.255
113 1HG2 VAL 16 HG21 VAL 16 17.166 6.085 17.963
114 2HG2 VAL 16 HG22 VAL 16 15.903 6.099 16.709
115 3HG2 VAL 16 HG23 VAL 16 15.480 6.452 18.401
116 H ALA 17 HN ALA 17 12.051 5.121 17.456
117 HA ALA 17 HA ALA 17 11.292 5.401 20.163
118 1HB ALA 17 HB1 ALA 17 12.904 7.149 20.334
119 2HB ALA 17 HB2 ALA 17 12.478 7.803 18.734
120 3HB ALA 17 HB3 ALA 17 11.340 7.964 20.094
121 H ASN 18 HN ASN 18 9.159 6.723 20.273
122 HA ASN 18 HA ASN 18 7.639 5.137 18.645
123 1HB ASN 18 HB2 ASN 18 6.825 7.660 20.184
124 2HB ASN 18 HB3 ASN 18 5.689 6.481 19.556
125 1HD2 ASN 18 HD21 ASN 18 6.207 4.023 21.997
126 2HD2 ASN 18 HD22 ASN 18 5.605 4.398 20.417
127 H ASN 19 HN ASN 19 8.573 8.614 18.438
128 HA ASN 19 HA ASN 19 6.605 9.136 16.452
129 1HB ASN 19 HB2 ASN 19 7.674 11.440 16.448
130 2HB ASN 19 HB3 ASN 19 7.166 10.914 18.040
131 1HD2 ASN 19 HD21 ASN 19 10.342 10.730 19.481
132 2HD2 ASN 19 HD22 ASN 19 8.631 10.494 19.618
133 H TYR 20 HN TYR 20 9.870 7.896 16.544
134 HA TYR 20 HA TYR 20 11.118 9.724 14.854
135 1HB TYR 20 HB2 TYR 20 12.000 7.938 16.567
136 2HB TYR 20 HB3 TYR 20 11.746 6.745 15.309
137 HD1 TYR 20 HD1 TYR 20 13.023 7.029 13.096
138 HD2 TYR 20 HD2 TYR 20 13.994 9.205 16.650
139 HE1 TYR 20 HE1 TYR 20 15.339 7.522 12.170
140 HE2 TYR 20 HE2 TYR 20 16.306 9.691 15.712
141 HH TYR 20 HH TYR 20 17.232 8.500 12.491
142 H CYS 21 HN CYS 21 9.418 6.632 14.201
143 HA CYS 21 HA CYS 21 10.341 6.332 11.583
144 1HB CYS 21 HB2 CYS 21 9.337 4.509 12.823
145 2HB CYS 21 HB3 CYS 21 7.806 5.357 12.912
146 H ASP 22 HN ASP 22 7.489 8.047 13.056
147 HA ASP 22 HA ASP 22 6.027 7.885 10.716
148 1HB ASP 22 HB2 ASP 22 5.163 8.262 13.082
149 2HB ASP 22 HB3 ASP 22 5.718 9.921 12.971
150 HD2 ASP 22 HD2 ASP 22 3.557 10.106 13.493
151 H ASN 23 HN ASN 23 7.982 10.529 12.246
152 HA ASN 23 HA ASN 23 7.185 12.495 10.447
153 1HB ASN 23 HB2 ASN 23 9.157 13.765 11.368
154 2HB ASN 23 HB3 ASN 23 8.175 13.057 12.635
155 1HD2 ASN 23 HD21 ASN 23 12.047 11.892 11.951
156 2HD2 ASN 23 HD22 ASN 23 11.187 12.994 10.928
157 H GLN 24 HN GLN 24 9.644 9.935 10.434
158 HA GLN 24 HA GLN 24 11.215 11.187 8.411
159 1HB GLN 24 HB2 GLN 24 12.054 9.621 10.284
160 2HB GLN 24 HB3 GLN 24 11.392 8.297 9.347
161 1HG GLN 24 HG2 GLN 24 12.796 9.011 7.384
162 2HG GLN 24 HG3 GLN 24 13.484 10.294 8.359
163 1HE2 GLN 24 HE21 GLN 24 15.867 7.491 8.427
164 2HE2 GLN 24 HE22 GLN 24 15.201 8.615 7.289
165 H CYS 25 HN CYS 25 8.587 8.806 8.648
166 HA CYS 25 HA CYS 25 8.940 7.796 6.021
167 1HB CYS 25 HB2 CYS 25 6.590 7.666 7.920
168 2HB CYS 25 HB3 CYS 25 6.670 6.828 6.383
169 H LYS 26 HN LYS 26 6.853 10.274 7.646
170 HA LYS 26 HA LYS 26 5.320 10.655 5.255
171 1HB LYS 26 HB2 LYS 26 3.894 11.941 6.569
172 2HB LYS 26 HB3 LYS 26 4.502 10.742 7.693
173 1HG LYS 26 HG2 LYS 26 6.383 12.546 8.191
174 2HG LYS 26 HG3 LYS 26 5.248 13.671 7.470
175 1HD LYS 26 HD2 LYS 26 4.685 11.842 9.852
176 2HD LYS 26 HD3 LYS 26 4.946 13.574 9.928
177 1HE LYS 26 HE2 LYS 26 2.648 12.187 8.464
178 2HE LYS 26 HE3 LYS 26 2.520 13.025 9.998
179 1HZ LYS 26 HZ1 LYS 26 3.432 15.031 8.706
180 2HZ LYS 26 HZ2 LYS 26 3.067 14.211 7.347
181 H MET 27 HN MET 27 8.371 11.685 6.333
182 HA MET 27 HA MET 27 8.572 14.274 5.658
183 1HB MET 27 HB2 MET 27 10.395 12.607 6.406
184 2HB MET 27 HB3 MET 27 10.506 12.077 4.740
185 1HG MET 27 HG2 MET 27 10.860 14.639 4.197
186 2HG MET 27 HG3 MET 27 11.227 14.788 5.904
187 1HE MET 27 HE1 MET 27 12.585 11.734 6.382
188 2HE MET 27 HE2 MET 27 14.231 12.411 6.406
189 3HE MET 27 HE3 MET 27 12.886 13.313 7.145
190 H LYS 28 HN LYS 28 8.305 11.460 3.428
191 HA LYS 28 HA LYS 28 7.535 13.036 1.238
192 1HB LYS 28 HB2 LYS 28 9.538 12.855 -0.160
193 2HB LYS 28 HB3 LYS 28 9.826 13.843 1.258
194 1HG LYS 28 HG2 LYS 28 10.757 11.725 2.397
195 2HG LYS 28 HG3 LYS 28 10.689 10.951 0.826
196 1HD LYS 28 HD2 LYS 28 12.165 12.740 -0.119
197 2HD LYS 28 HD3 LYS 28 12.234 13.512 1.452
198 1HE LYS 28 HE2 LYS 28 14.243 12.147 1.166
199 2HE LYS 28 HE3 LYS 28 13.252 11.425 2.418
200 1HZ LYS 28 HZ1 LYS 28 13.374 10.526 -0.411
201 2HZ LYS 28 HZ2 LYS 28 13.974 9.726 0.874
202 H LYS 29 HN LYS 29 9.178 10.057 2.431
203 HA LYS 29 HA LYS 29 8.701 8.487 0.212
204 1HB LYS 29 HB2 LYS 29 9.067 7.835 3.141
205 2HB LYS 29 HB3 LYS 29 8.876 6.586 1.928
206 1HG LYS 29 HG2 LYS 29 10.914 8.779 1.473
207 2HG LYS 29 HG3 LYS 29 11.300 7.474 2.577
208 1HD LYS 29 HD2 LYS 29 10.219 6.846 -0.188
209 2HD LYS 29 HD3 LYS 29 11.915 7.236 0.019
210 1HE LYS 29 HE2 LYS 29 12.043 5.414 1.801
211 2HE LYS 29 HE3 LYS 29 10.397 4.969 1.393
212 1HZ LYS 29 HZ1 LYS 29 12.234 3.724 0.186
213 2HZ LYS 29 HZ2 LYS 29 11.070 4.333 -0.776
214 H ALA 30 HN ALA 30 6.569 9.221 3.048
215 HA ALA 30 HA ALA 30 4.611 7.372 1.879
216 1HB ALA 30 HB1 ALA 30 5.241 7.462 4.839
217 2HB ALA 30 HB2 ALA 30 4.390 6.201 3.915
218 3HB ALA 30 HB3 ALA 30 6.148 6.404 3.732
219 H SER 31 HN SER 31 2.444 7.606 3.266
220 HA SER 31 HA SER 31 1.940 10.414 3.558
221 1HB SER 31 HB2 SER 31 0.086 8.044 4.061
222 2HB SER 31 HB3 SER 31 -0.400 9.723 3.925
223 HG SER 31 HG SER 31 0.817 8.121 1.837
224 H GLY 32 HN GLY 32 2.450 7.486 5.536
225 1HA GLY 32 HA1 GLY 32 2.877 9.170 7.863
226 2HA GLY 32 HA2 GLY 32 1.546 8.038 7.990
227 H GLY 33 HN GLY 33 3.165 7.336 9.828
228 1HA GLY 33 HA1 GLY 33 4.012 4.760 9.000
229 2HA GLY 33 HA2 GLY 33 5.402 5.787 9.289
230 H HIS 34 HN HIS 34 5.030 3.554 10.905
231 HA HIS 34 HA HIS 34 4.657 4.926 13.437
232 1HB HIS 34 HB2 HIS 34 2.553 3.911 13.310
233 2HB HIS 34 HB3 HIS 34 3.178 2.462 12.549
234 HD1 HIS 34 HD1 HIS 34 3.469 4.242 15.937
235 HD2 HIS 34 HD2 HIS 34 3.529 0.385 14.290
236 HE1 HIS 34 HE1 HIS 34 3.608 2.626 17.907
237 H CYS 35 HN CYS 35 6.024 4.134 15.111
238 HA CYS 35 HA CYS 35 8.306 2.739 14.078
239 1HB CYS 35 HB2 CYS 35 8.688 4.640 15.488
240 2HB CYS 35 HB3 CYS 35 7.691 3.974 16.765
241 H TYR 36 HN TYR 36 7.192 0.649 13.630
242 HA TYR 36 HA TYR 36 6.337 -0.930 15.847
243 1HB TYR 36 HB2 TYR 36 5.771 -1.160 13.337
244 2HB TYR 36 HB3 TYR 36 7.436 -1.625 13.052
245 HD1 TYR 36 HD1 TYR 36 7.909 -3.891 12.907
246 HD2 TYR 36 HD2 TYR 36 4.558 -2.630 15.250
247 HE1 TYR 36 HE1 TYR 36 7.302 -6.318 13.358
248 HE2 TYR 36 HE2 TYR 36 3.962 -5.062 15.692
249 HH TYR 36 HH TYR 36 5.934 -7.681 14.313
250 H ALA 37 HN ALA 37 7.483 -2.917 16.618
251 HA ALA 37 HA ALA 37 9.760 -1.851 17.808
252 1HB ALA 37 HB1 ALA 37 8.706 -4.707 17.729
253 2HB ALA 37 HB2 ALA 37 9.905 -4.083 18.887
254 3HB ALA 37 HB3 ALA 37 8.244 -3.445 18.896
255 H MET 38 HN MET 38 9.299 -3.879 14.930
256 HA MET 38 HA MET 38 11.954 -4.912 15.087
257 1HB MET 38 HB2 MET 38 9.735 -6.015 14.147
258 2HB MET 38 HB3 MET 38 10.069 -5.097 12.693
259 1HG MET 38 HG2 MET 38 12.238 -6.200 12.407
260 2HG MET 38 HG3 MET 38 12.111 -6.972 13.975
261 1HE MET 38 HE1 MET 38 11.583 -10.151 11.954
262 2HE MET 38 HE2 MET 38 12.825 -8.877 11.907
263 3HE MET 38 HE3 MET 38 12.197 -9.450 13.470
264 H SER 39 HN SER 39 10.196 -2.343 13.347
265 HA SER 39 HA SER 39 12.515 -1.092 12.508
266 1HB SER 39 HB2 SER 39 11.386 -3.122 10.631
267 2HB SER 39 HB3 SER 39 11.762 -1.567 9.915
268 HG SER 39 HG SER 39 13.598 -3.176 11.479
269 H CYS 40 HN CYS 40 11.924 0.718 10.814
270 HA CYS 40 HA CYS 40 9.603 1.995 11.724
271 1HB CYS 40 HB2 CYS 40 11.452 3.312 11.022
272 2HB CYS 40 HB3 CYS 40 11.496 2.553 9.443
273 H TYR 41 HN TYR 41 7.601 1.087 11.281
274 HA TYR 41 HA TYR 41 7.109 -0.081 8.680
275 1HB TYR 41 HB2 TYR 41 6.236 -0.948 10.924
276 2HB TYR 41 HB3 TYR 41 5.374 0.561 11.147
277 HD1 TYR 41 HD1 TYR 41 5.623 -2.342 8.796
278 HD2 TYR 41 HD2 TYR 41 3.161 0.764 10.406
279 HE1 TYR 41 HE1 TYR 41 3.602 -3.311 7.595
280 HE2 TYR 41 HE2 TYR 41 1.148 -0.215 9.200
281 HH TYR 41 HH TYR 41 0.393 -1.840 7.993
282 H CYS 42 HN CYS 42 7.093 1.517 7.092
283 HA CYS 42 HA CYS 42 5.791 4.012 7.680
284 1HB CYS 42 HB2 CYS 42 7.220 2.995 5.218
285 2HB CYS 42 HB3 CYS 42 6.497 4.586 5.343
286 H GLU 43 HN GLU 43 4.014 4.849 6.208
287 HA GLU 43 HA GLU 43 2.320 2.613 5.450
288 1HB GLU 43 HB2 GLU 43 1.719 4.723 7.556
289 2HB GLU 43 HB3 GLU 43 0.445 3.811 6.773
290 1HG GLU 43 HG2 GLU 43 1.472 1.677 7.536
291 2HG GLU 43 HG3 GLU 43 2.797 2.559 8.269
292 HE2 GLU 43 HE2 GLU 43 -0.530 2.171 8.262
293 H GLY 44 HN GLY 44 1.168 3.017 3.590
294 1HA GLY 44 HA1 GLY 44 -0.048 4.174 2.073
295 2HA GLY 44 HA2 GLY 44 0.073 5.609 3.071
296 H LEU 45 HN LEU 45 2.275 3.468 1.112
297 HA LEU 45 HA LEU 45 3.726 5.864 0.302
298 1HB LEU 45 HB2 LEU 45 4.327 2.916 0.065
299 2HB LEU 45 HB3 LEU 45 5.310 4.168 -0.669
300 HG LEU 45 HG LEU 45 5.253 5.070 1.889
301 1HD1 LEU 45 HD11 LEU 45 5.639 3.104 3.374
302 2HD1 LEU 45 HD12 LEU 45 3.964 3.259 2.791
303 3HD1 LEU 45 HD13 LEU 45 5.052 2.053 2.063
304 1HD2 LEU 45 HD21 LEU 45 7.491 3.970 2.138
305 2HD2 LEU 45 HD22 LEU 45 7.165 3.094 0.623
306 3HD2 LEU 45 HD23 LEU 45 7.266 4.872 0.620
307 HA PRO 46 HA PRO 46 2.354 5.214 -3.912
308 1HB PRO 46 HB2 PRO 46 4.458 6.313 -5.265
309 2HB PRO 46 HB3 PRO 46 3.086 7.248 -4.705
310 1HG PRO 46 HG2 PRO 46 5.822 7.123 -3.593
311 2HG PRO 46 HG3 PRO 46 4.584 8.335 -3.329
312 1HD PRO 46 HD2 PRO 46 5.356 6.248 -1.519
313 2HD PRO 46 HD3 PRO 46 4.042 7.387 -1.306
314 H GLU 47 HN GLU 47 2.898 3.917 -5.840
315 HA GLU 47 HA GLU 47 3.679 1.535 -4.573
316 1HB GLU 47 HB2 GLU 47 2.930 0.441 -6.584
317 2HB GLU 47 HB3 GLU 47 1.839 1.782 -6.296
318 1HG GLU 47 HG2 GLU 47 3.298 3.176 -7.886
319 2HG GLU 47 HG3 GLU 47 4.149 1.698 -8.287
320 HE2 GLU 47 HE2 GLU 47 1.123 3.130 -8.145
321 H ASN 48 HN ASN 48 5.389 3.976 -6.329
322 HA ASN 48 HA ASN 48 7.225 2.324 -7.639
323 1HB ASN 48 HB2 ASN 48 8.524 4.426 -7.949
324 2HB ASN 48 HB3 ASN 48 6.824 4.704 -8.273
325 1HD2 ASN 48 HD21 ASN 48 8.482 7.281 -5.962
326 2HD2 ASN 48 HD22 ASN 48 9.002 6.503 -7.419
327 H ALA 49 HN ALA 49 6.857 3.606 -4.358
328 HA ALA 49 HA ALA 49 9.622 3.133 -3.659
329 1HB ALA 49 HB1 ALA 49 7.183 4.005 -2.056
330 2HB ALA 49 HB2 ALA 49 8.843 3.916 -1.420
331 3HB ALA 49 HB3 ALA 49 8.450 5.063 -2.723
332 H LYS 50 HN LYS 50 10.079 0.939 -3.799
333 HA LYS 50 HA LYS 50 8.253 -1.051 -3.036
334 1HB LYS 50 HB2 LYS 50 10.095 -1.408 -4.621
335 2HB LYS 50 HB3 LYS 50 11.269 -1.155 -3.345
336 1HG LYS 50 HG2 LYS 50 9.160 -3.202 -2.773
337 2HG LYS 50 HG3 LYS 50 10.292 -3.617 -4.044
338 1HD LYS 50 HD2 LYS 50 12.205 -3.239 -2.527
339 2HD LYS 50 HD3 LYS 50 11.131 -2.675 -1.262
340 1HE LYS 50 HE2 LYS 50 9.993 -4.947 -1.290
341 2HE LYS 50 HE3 LYS 50 11.189 -5.490 -2.450
342 1HZ LYS 50 HZ1 LYS 50 12.924 -4.976 -0.796
343 2HZ LYS 50 HZ2 LYS 50 11.802 -4.499 0.283
344 H VAL 51 HN VAL 51 7.751 -1.948 -1.080
345 HA VAL 51 HA VAL 51 9.679 -1.498 1.084
346 HB VAL 51 HB VAL 51 7.919 -1.126 2.642
347 1HG1 VAL 51 HG11 VAL 51 7.209 1.029 2.008
348 2HG1 VAL 51 HG12 VAL 51 8.723 0.772 1.108
349 3HG1 VAL 51 HG13 VAL 51 7.156 0.601 0.281
350 1HG2 VAL 51 HG21 VAL 51 6.039 -1.722 0.340
351 2HG2 VAL 51 HG22 VAL 51 6.196 -2.593 1.884
352 3HG2 VAL 51 HG23 VAL 51 5.520 -0.947 1.856
353 H SER 52 HN SER 52 9.937 -3.274 2.533
354 HA SER 52 HA SER 52 9.008 -5.770 1.525
355 1HB SER 52 HB2 SER 52 11.238 -5.616 2.525
356 2HB SER 52 HB3 SER 52 10.572 -5.008 4.028
357 HG SER 52 HG SER 52 11.098 -7.338 4.029
358 H ASP 53 HN ASP 53 7.338 -7.070 2.382
359 HA ASP 53 HA ASP 53 6.053 -5.986 4.765
360 1HB ASP 53 HB2 ASP 53 3.963 -7.091 3.963
361 2HB ASP 53 HB3 ASP 53 4.537 -5.872 2.843
362 HD2 ASP 53 HD2 ASP 53 5.751 -8.784 0.827
363 H SER 54 HN SER 54 8.360 -7.737 4.824
364 HA SER 54 HA SER 54 7.142 -10.326 5.383
365 1HB SER 54 HB2 SER 54 9.295 -11.346 4.488
366 2HB SER 54 HB3 SER 54 8.266 -10.601 3.281
367 HG SER 54 HG SER 54 9.625 -8.715 3.321
368 H ALA 55 HN ALA 55 7.636 -8.220 7.300
369 HA ALA 55 HA ALA 55 8.465 -8.003 9.342
370 1HB ALA 55 HB1 ALA 55 7.503 -10.293 9.505
371 2HB ALA 55 HB2 ALA 55 9.084 -10.971 9.048
372 3HB ALA 55 HB3 ALA 55 8.908 -10.074 10.575
373 H THR 56 HN THR 56 10.172 -7.004 7.460
374 HA THR 56 HA THR 56 12.290 -6.382 7.156
375 HB THR 56 HB THR 56 12.556 -7.300 10.067
376 HG1 THR 56 HG1 THR 56 11.737 -4.809 8.743
377 1HG2 THR 56 HG21 THR 56 13.993 -5.204 8.361
378 2HG2 THR 56 HG22 THR 56 14.048 -5.218 10.140
379 3HG2 THR 56 HG23 THR 56 14.733 -6.578 9.219
380 H ASN 57 HN ASN 57 12.173 -8.414 5.671
381 HA ASN 57 HA ASN 57 13.708 -10.610 6.434
382 1HB ASN 57 HB2 ASN 57 13.848 -11.035 3.952
383 2HB ASN 57 HB3 ASN 57 12.211 -10.696 4.478
384 1HD2 ASN 57 HD21 ASN 57 13.431 -8.717 1.402
385 2HD2 ASN 57 HD22 ASN 57 13.668 -10.362 1.891
386 H ILE 58 HN ILE 58 14.395 -7.384 5.024
387 HA ILE 58 HA ILE 58 17.163 -8.004 4.544
388 HB ILE 58 HB ILE 58 15.503 -5.497 4.339
389 1HG1 ILE 58 HG12 ILE 58 16.912 -6.776 2.039
390 2HG1 ILE 58 HG13 ILE 58 15.498 -7.594 2.674
391 1HG2 ILE 58 HG21 ILE 58 17.679 -4.747 4.983
392 2HG2 ILE 58 HG22 ILE 58 18.467 -5.866 3.845
393 3HG2 ILE 58 HG23 ILE 58 17.512 -4.497 3.228
394 1HD1 ILE 58 HD11 ILE 58 15.559 -4.650 1.867
395 2HD1 ILE 58 HD12 ILE 58 14.939 -5.970 0.847
396 3HD1 ILE 58 HD13 ILE 58 14.127 -5.574 2.381
397 H CYS 59 HN CYS 59 18.933 -7.477 5.870
398 HA CYS 59 HA CYS 59 19.726 -7.882 7.893
399 1HB CYS 59 HB2 CYS 59 18.339 -5.236 8.285
400 2HB CYS 59 HB3 CYS 59 19.292 -5.975 9.556
401 H GLY 60 HN GLY 60 17.694 -9.613 7.555
402 1HA GLY 60 HA1 GLY 60 17.190 -10.561 10.003
403 2HA GLY 60 HA2 GLY 60 15.858 -9.442 9.798
Start of MODEL 14
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 -0.954 0.414
3 1HB LYS 1 HB2 LYS 1 3.067 -0.080 -1.429
4 2HB LYS 1 HB3 LYS 1 1.550 -0.716 -2.032
5 1HG LYS 1 HG2 LYS 1 0.606 1.650 -1.955
6 2HG LYS 1 HG3 LYS 1 2.207 2.224 -1.531
7 1HD LYS 1 HD2 LYS 1 3.076 1.098 -3.661
8 2HD LYS 1 HD3 LYS 1 1.409 0.779 -4.098
9 1HE LYS 1 HE2 LYS 1 0.936 3.264 -3.931
10 2HE LYS 1 HE3 LYS 1 2.638 3.535 -3.617
11 1HZ LYS 1 HZ1 LYS 1 2.962 2.229 -5.815
12 2HZ LYS 1 HZ2 LYS 1 1.396 2.567 -6.109
13 H ASP 2 HN ASP 2 3.782 0.191 1.123
14 HA ASP 2 HA ASP 2 2.962 2.599 2.549
15 1HB ASP 2 HB2 ASP 2 5.026 0.506 3.380
16 2HB ASP 2 HB3 ASP 2 4.560 1.906 4.325
17 HD2 ASP 2 HD2 ASP 2 2.745 -0.986 5.590
18 H GLY 3 HN GLY 3 4.727 4.224 2.881
19 1HA GLY 3 HA1 GLY 3 7.347 4.069 2.333
20 2HA GLY 3 HA2 GLY 3 6.669 4.251 0.728
21 H TYR 4 HN TYR 4 7.835 6.345 0.652
22 HA TYR 4 HA TYR 4 6.542 8.420 2.272
23 1HB TYR 4 HB2 TYR 4 8.978 8.542 0.399
24 2HB TYR 4 HB3 TYR 4 8.586 9.684 1.669
25 HD1 TYR 4 HD1 TYR 4 8.689 8.862 4.107
26 HD2 TYR 4 HD2 TYR 4 10.378 6.690 0.830
27 HE1 TYR 4 HE1 TYR 4 10.168 7.566 5.718
28 HE2 TYR 4 HE2 TYR 4 11.851 5.402 2.453
29 HH TYR 4 HH TYR 4 12.329 5.012 4.525
30 HA PRO 5 HA PRO 5 4.375 9.175 -1.445
31 1HB PRO 5 HB2 PRO 5 2.495 10.875 -0.424
32 2HB PRO 5 HB3 PRO 5 2.340 9.130 -0.369
33 1HG PRO 5 HG2 PRO 5 3.027 10.998 1.816
34 2HG PRO 5 HG3 PRO 5 2.457 9.345 1.924
35 1HD PRO 5 HD2 PRO 5 5.149 10.261 2.302
36 2HD PRO 5 HD3 PRO 5 4.599 8.597 2.295
37 H VAL 6 HN VAL 6 4.574 10.510 -3.170
38 HA VAL 6 HA VAL 6 5.422 13.227 -2.477
39 HB VAL 6 HB VAL 6 7.108 13.164 -4.210
40 1HG1 VAL 6 HG11 VAL 6 7.539 10.749 -2.432
41 2HG1 VAL 6 HG12 VAL 6 8.758 11.874 -3.078
42 3HG1 VAL 6 HG13 VAL 6 7.609 12.424 -1.834
43 1HG2 VAL 6 HG21 VAL 6 6.137 11.594 -5.769
44 2HG2 VAL 6 HG22 VAL 6 7.744 11.001 -5.283
45 3HG2 VAL 6 HG23 VAL 6 6.278 10.269 -4.589
46 H ASP 7 HN ASP 7 4.387 14.807 -3.643
47 HA ASP 7 HA ASP 7 3.523 14.352 -6.257
48 1HB ASP 7 HB2 ASP 7 1.003 14.959 -5.386
49 2HB ASP 7 HB3 ASP 7 1.534 13.332 -5.762
50 HD2 ASP 7 HD2 ASP 7 1.190 14.313 -1.879
51 H SER 8 HN SER 8 1.979 16.111 -3.457
52 HA SER 8 HA SER 8 2.019 18.487 -5.031
53 1HB SER 8 HB2 SER 8 0.740 19.448 -3.090
54 2HB SER 8 HB3 SER 8 0.015 17.999 -3.757
55 HG SER 8 HG SER 8 0.099 17.980 -1.407
56 H LYS 9 HN LYS 9 3.747 17.073 -2.259
57 HA LYS 9 HA LYS 9 4.890 19.560 -1.431
58 1HB LYS 9 HB2 LYS 9 6.049 18.251 0.208
59 2HB LYS 9 HB3 LYS 9 4.395 17.680 0.117
60 1HG LYS 9 HG2 LYS 9 5.555 16.046 -1.756
61 2HG LYS 9 HG3 LYS 9 6.927 16.306 -0.697
62 1HD LYS 9 HD2 LYS 9 5.914 14.436 0.298
63 2HD LYS 9 HD3 LYS 9 5.245 15.745 1.250
64 1HE LYS 9 HE2 LYS 9 3.170 15.729 -0.059
65 2HE LYS 9 HE3 LYS 9 3.844 14.584 -1.203
66 1HZ LYS 9 HZ1 LYS 9 2.455 13.457 0.436
67 2HZ LYS 9 HZ2 LYS 9 3.993 12.954 0.618
68 H GLY 10 HN GLY 10 5.537 17.139 -3.868
69 1HA GLY 10 HA1 GLY 10 7.128 17.266 -5.522
70 2HA GLY 10 HA2 GLY 10 7.985 18.509 -4.634
71 H CYS 11 HN CYS 11 9.018 17.743 -2.452
72 HA CYS 11 HA CYS 11 10.244 15.146 -3.032
73 1HB CYS 11 HB2 CYS 11 11.712 17.630 -2.123
74 2HB CYS 11 HB3 CYS 11 12.415 16.056 -2.439
75 H LYS 12 HN LYS 12 8.718 14.299 -1.331
76 HA LYS 12 HA LYS 12 8.912 13.153 0.551
77 1HB LYS 12 HB2 LYS 12 11.561 14.267 0.223
78 2HB LYS 12 HB3 LYS 12 11.154 14.182 1.925
79 1HG LYS 12 HG2 LYS 12 12.153 12.057 1.297
80 2HG LYS 12 HG3 LYS 12 10.450 11.776 1.600
81 1HD LYS 12 HD2 LYS 12 9.933 11.595 -0.722
82 2HD LYS 12 HD3 LYS 12 11.409 12.404 -1.211
83 1HE LYS 12 HE2 LYS 12 12.708 10.420 -0.230
84 2HE LYS 12 HE3 LYS 12 11.171 9.606 -0.013
85 1HZ LYS 12 HZ1 LYS 12 10.797 9.911 -2.447
86 2HZ LYS 12 HZ2 LYS 12 12.298 10.524 -2.603
87 H LEU 13 HN LEU 13 9.209 13.662 3.170
88 HA LEU 13 HA LEU 13 7.581 16.038 3.597
89 1HB LEU 13 HB2 LEU 13 6.037 14.315 2.813
90 2HB LEU 13 HB3 LEU 13 6.600 13.218 4.058
91 HG LEU 13 HG LEU 13 5.676 14.604 5.805
92 1HD1 LEU 13 HD11 LEU 13 5.124 16.572 3.583
93 2HD1 LEU 13 HD12 LEU 13 4.279 16.630 5.148
94 3HD1 LEU 13 HD13 LEU 13 6.048 16.814 5.085
95 1HD2 LEU 13 HD21 LEU 13 3.313 14.377 5.338
96 2HD2 LEU 13 HD22 LEU 13 3.633 14.283 3.590
97 3HD2 LEU 13 HD23 LEU 13 4.195 12.984 4.668
98 H SER 14 HN SER 14 8.941 16.963 5.099
99 HA SER 14 HA SER 14 10.580 15.310 6.664
100 1HB SER 14 HB2 SER 14 10.033 18.307 6.728
101 2HB SER 14 HB3 SER 14 11.242 17.535 7.735
102 HG SER 14 HG SER 14 11.166 17.482 4.837
103 H CYS 15 HN CYS 15 9.484 14.022 8.171
104 HA CYS 15 HA CYS 15 7.435 15.098 9.813
105 1HB CYS 15 HB2 CYS 15 7.545 12.985 10.999
106 2HB CYS 15 HB3 CYS 15 7.475 12.742 9.265
107 H VAL 16 HN VAL 16 7.617 15.805 12.009
108 HA VAL 16 HA VAL 16 10.377 16.073 12.981
109 HB VAL 16 HB VAL 16 9.525 17.925 14.338
110 1HG1 VAL 16 HG11 VAL 16 9.222 19.547 12.527
111 2HG1 VAL 16 HG12 VAL 16 10.493 18.370 12.119
112 3HG1 VAL 16 HG13 VAL 16 8.878 18.225 11.385
113 1HG2 VAL 16 HG21 VAL 16 7.162 17.063 14.472
114 2HG2 VAL 16 HG22 VAL 16 7.306 18.801 14.118
115 3HG2 VAL 16 HG23 VAL 16 6.918 17.657 12.812
116 H ALA 17 HN ALA 17 7.600 14.193 13.201
117 HA ALA 17 HA ALA 17 8.301 13.022 15.662
118 1HB ALA 17 HB1 ALA 17 6.353 13.764 16.992
119 2HB ALA 17 HB2 ALA 17 7.417 15.131 16.581
120 3HB ALA 17 HB3 ALA 17 5.895 14.889 15.691
121 H ASN 18 HN ASN 18 6.610 11.334 16.289
122 HA ASN 18 HA ASN 18 5.993 10.025 13.875
123 1HB ASN 18 HB2 ASN 18 5.564 9.396 16.827
124 2HB ASN 18 HB3 ASN 18 4.905 8.340 15.594
125 1HD2 ASN 18 HD21 ASN 18 8.801 8.200 16.660
126 2HD2 ASN 18 HD22 ASN 18 7.593 9.167 17.436
127 H ASN 19 HN ASN 19 4.174 11.645 16.541
128 HA ASN 19 HA ASN 19 1.640 10.898 15.697
129 1HB ASN 19 HB2 ASN 19 0.915 12.945 17.055
130 2HB ASN 19 HB3 ASN 19 1.939 11.821 17.926
131 1HD2 ASN 19 HD21 ASN 19 3.033 15.672 17.286
132 2HD2 ASN 19 HD22 ASN 19 1.527 14.988 16.774
133 H TYR 20 HN TYR 20 3.883 13.581 14.865
134 HA TYR 20 HA TYR 20 2.033 15.170 13.464
135 1HB TYR 20 HB2 TYR 20 4.271 15.908 14.310
136 2HB TYR 20 HB3 TYR 20 5.073 14.685 13.344
137 HD1 TYR 20 HD1 TYR 20 3.485 17.988 13.314
138 HD2 TYR 20 HD2 TYR 20 5.328 14.967 10.909
139 HE1 TYR 20 HE1 TYR 20 3.758 19.656 11.415
140 HE2 TYR 20 HE2 TYR 20 5.594 16.645 9.018
141 HH TYR 20 HH TYR 20 4.457 19.993 9.406
142 H CYS 21 HN CYS 21 4.217 12.471 12.489
143 HA CYS 21 HA CYS 21 3.649 12.668 9.751
144 1HB CYS 21 HB2 CYS 21 5.573 11.467 10.401
145 2HB CYS 21 HB3 CYS 21 4.675 10.446 11.507
146 H ASP 22 HN ASP 22 2.222 10.734 12.496
147 HA ASP 22 HA ASP 22 1.030 8.937 10.784
148 1HB ASP 22 HB2 ASP 22 1.509 8.583 13.229
149 2HB ASP 22 HB3 ASP 22 0.214 9.694 13.630
150 HD2 ASP 22 HD2 ASP 22 -0.979 6.209 12.027
151 H ASN 23 HN ASN 23 -0.246 11.822 12.585
152 HA ASN 23 HA ASN 23 -2.902 11.380 11.928
153 1HB ASN 23 HB2 ASN 23 -3.302 13.435 13.012
154 2HB ASN 23 HB3 ASN 23 -1.744 13.003 13.689
155 1HD2 ASN 23 HD21 ASN 23 0.167 15.404 11.907
156 2HD2 ASN 23 HD22 ASN 23 0.172 13.929 12.815
157 H GLN 24 HN GLN 24 -0.156 12.904 10.263
158 HA GLN 24 HA GLN 24 -1.814 14.433 8.522
159 1HB GLN 24 HB2 GLN 24 0.407 15.255 9.251
160 2HB GLN 24 HB3 GLN 24 1.187 13.887 8.482
161 1HG GLN 24 HG2 GLN 24 0.690 14.658 6.293
162 2HG GLN 24 HG3 GLN 24 -0.627 15.676 6.841
163 1HE2 GLN 24 HE21 GLN 24 3.292 16.887 7.519
164 2HE2 GLN 24 HE22 GLN 24 2.842 15.215 7.531
165 H CYS 25 HN CYS 25 -0.143 11.293 8.523
166 HA CYS 25 HA CYS 25 -0.314 10.879 5.740
167 1HB CYS 25 HB2 CYS 25 0.032 8.978 8.062
168 2HB CYS 25 HB3 CYS 25 0.038 8.462 6.388
169 H LYS 26 HN LYS 26 -2.336 10.002 8.619
170 HA LYS 26 HA LYS 26 -4.048 8.348 7.052
171 1HB LYS 26 HB2 LYS 26 -5.084 7.801 9.075
172 2HB LYS 26 HB3 LYS 26 -3.409 8.068 9.512
173 1HG LYS 26 HG2 LYS 26 -3.940 10.370 10.270
174 2HG LYS 26 HG3 LYS 26 -5.605 10.178 9.757
175 1HD LYS 26 HD2 LYS 26 -5.484 9.793 12.167
176 2HD LYS 26 HD3 LYS 26 -5.872 8.277 11.378
177 1HE LYS 26 HE2 LYS 26 -3.637 7.432 11.646
178 2HE LYS 26 HE3 LYS 26 -2.988 9.019 12.005
179 1HZ LYS 26 HZ1 LYS 26 -3.277 7.729 14.037
180 2HZ LYS 26 HZ2 LYS 26 -4.290 9.003 14.083
181 H MET 27 HN MET 27 -3.726 11.724 7.475
182 HA MET 27 HA MET 27 -6.277 12.608 7.730
183 1HB MET 27 HB2 MET 27 -4.156 13.995 7.633
184 2HB MET 27 HB3 MET 27 -4.073 13.720 5.904
185 1HG MET 27 HG2 MET 27 -5.998 15.046 5.464
186 2HG MET 27 HG3 MET 27 -6.594 14.906 7.106
187 1HE MET 27 HE1 MET 27 -3.047 17.508 5.735
188 2HE MET 27 HE2 MET 27 -2.943 15.731 5.766
189 3HE MET 27 HE3 MET 27 -4.103 16.536 4.682
190 H LYS 28 HN LYS 28 -4.667 11.194 4.876
191 HA LYS 28 HA LYS 28 -7.108 10.797 3.532
192 1HB LYS 28 HB2 LYS 28 -6.712 12.321 1.610
193 2HB LYS 28 HB3 LYS 28 -7.108 13.154 3.100
194 1HG LYS 28 HG2 LYS 28 -4.530 13.342 3.469
195 2HG LYS 28 HG3 LYS 28 -4.377 12.880 1.786
196 1HD LYS 28 HD2 LYS 28 -5.889 14.805 1.157
197 2HD LYS 28 HD3 LYS 28 -5.935 15.288 2.841
198 1HE LYS 28 HE2 LYS 28 -4.202 16.641 2.010
199 2HE LYS 28 HE3 LYS 28 -3.303 15.291 2.675
200 1HZ LYS 28 HZ1 LYS 28 -2.615 15.865 0.383
201 2HZ LYS 28 HZ2 LYS 28 -3.155 14.331 0.464
202 H LYS 29 HN LYS 29 -3.533 11.256 3.301
203 HA LYS 29 HA LYS 29 -3.211 9.953 0.888
204 1HB LYS 29 HB2 LYS 29 -1.387 10.495 3.225
205 2HB LYS 29 HB3 LYS 29 -0.821 9.583 1.841
206 1HG LYS 29 HG2 LYS 29 -2.248 12.221 1.402
207 2HG LYS 29 HG3 LYS 29 -0.564 12.223 1.886
208 1HD LYS 29 HD2 LYS 29 0.164 11.219 -0.107
209 2HD LYS 29 HD3 LYS 29 -1.368 10.416 -0.392
210 1HE LYS 29 HE2 LYS 29 -1.135 12.226 -2.015
211 2HE LYS 29 HE3 LYS 29 -2.420 12.647 -0.901
212 1HZ LYS 29 HZ1 LYS 29 -0.941 14.526 -1.184
213 2HZ LYS 29 HZ2 LYS 29 -0.769 13.994 0.346
214 H ALA 30 HN ALA 30 -3.365 8.632 4.253
215 HA ALA 30 HA ALA 30 -2.964 5.964 3.130
216 1HB ALA 30 HB1 ALA 30 -1.308 6.858 5.484
217 2HB ALA 30 HB2 ALA 30 -0.998 5.556 4.311
218 3HB ALA 30 HB3 ALA 30 -0.773 7.256 3.834
219 H SER 31 HN SER 31 -2.817 4.463 5.397
220 HA SER 31 HA SER 31 -5.214 5.195 6.829
221 1HB SER 31 HB2 SER 31 -4.832 2.879 7.896
222 2HB SER 31 HB3 SER 31 -5.233 2.910 6.190
223 HG SER 31 HG SER 31 -2.480 2.937 7.018
224 H GLY 32 HN GLY 32 -1.692 5.023 7.151
225 1HA GLY 32 HA1 GLY 32 -1.796 6.423 9.669
226 2HA GLY 32 HA2 GLY 32 -1.222 4.774 9.808
227 H GLY 33 HN GLY 33 0.749 6.212 10.555
228 1HA GLY 33 HA1 GLY 33 2.723 5.631 8.629
229 2HA GLY 33 HA2 GLY 33 2.454 7.362 8.665
230 H HIS 34 HN HIS 34 4.937 6.242 9.450
231 HA HIS 34 HA HIS 34 4.906 7.365 12.134
232 1HB HIS 34 HB2 HIS 34 6.341 4.817 11.342
233 2HB HIS 34 HB3 HIS 34 6.671 5.712 12.812
234 HD1 HIS 34 HD1 HIS 34 4.113 6.238 14.142
235 HD2 HIS 34 HD2 HIS 34 4.687 2.736 11.906
236 HE1 HIS 34 HE1 HIS 34 2.379 4.563 14.979
237 H CYS 35 HN CYS 35 7.259 8.034 12.765
238 HA CYS 35 HA CYS 35 8.056 9.600 10.464
239 1HB CYS 35 HB2 CYS 35 7.500 10.830 12.451
240 2HB CYS 35 HB3 CYS 35 8.609 9.880 13.421
241 H TYR 36 HN TYR 36 9.603 8.554 9.210
242 HA TYR 36 HA TYR 36 11.862 7.349 10.633
243 1HB TYR 36 HB2 TYR 36 10.392 6.490 8.506
244 2HB TYR 36 HB3 TYR 36 11.456 7.562 7.616
245 HD1 TYR 36 HD1 TYR 36 11.644 4.790 10.141
246 HD2 TYR 36 HD2 TYR 36 13.439 6.700 6.760
247 HE1 TYR 36 HE1 TYR 36 13.409 2.963 10.037
248 HE2 TYR 36 HE2 TYR 36 15.198 4.867 6.667
249 HH TYR 36 HH TYR 36 15.933 3.037 7.532
250 H ALA 37 HN ALA 37 14.090 7.860 9.729
251 HA ALA 37 HA ALA 37 14.490 10.553 10.258
252 1HB ALA 37 HB1 ALA 37 16.840 10.050 9.628
253 2HB ALA 37 HB2 ALA 37 16.147 8.793 10.680
254 3HB ALA 37 HB3 ALA 37 16.308 8.500 8.932
255 H MET 38 HN MET 38 13.929 8.789 7.224
256 HA MET 38 HA MET 38 14.981 10.832 5.588
257 1HB MET 38 HB2 MET 38 13.116 8.452 5.084
258 2HB MET 38 HB3 MET 38 13.701 9.476 3.788
259 1HG MET 38 HG2 MET 38 16.025 8.877 4.258
260 2HG MET 38 HG3 MET 38 15.571 8.050 5.735
261 1HE MET 38 HE1 MET 38 16.862 5.981 5.016
262 2HE MET 38 HE2 MET 38 16.569 5.031 3.539
263 3HE MET 38 HE3 MET 38 17.323 6.640 3.428
264 H SER 39 HN SER 39 11.701 9.929 6.776
265 HA SER 39 HA SER 39 10.616 12.419 6.410
266 1HB SER 39 HB2 SER 39 10.638 10.738 3.959
267 2HB SER 39 HB3 SER 39 9.060 11.378 4.372
268 HG SER 39 HG SER 39 11.479 12.955 4.110
269 H CYS 40 HN CYS 40 8.026 12.206 6.385
270 HA CYS 40 HA CYS 40 7.151 10.313 8.206
271 1HB CYS 40 HB2 CYS 40 5.893 12.304 7.827
272 2HB CYS 40 HB3 CYS 40 5.681 11.933 6.127
273 H TYR 41 HN TYR 41 7.527 8.126 7.809
274 HA TYR 41 HA TYR 41 7.048 6.998 5.215
275 1HB TYR 41 HB2 TYR 41 8.713 6.180 6.963
276 2HB TYR 41 HB3 TYR 41 7.386 5.869 8.065
277 HD1 TYR 41 HD1 TYR 41 8.715 4.874 4.714
278 HD2 TYR 41 HD2 TYR 41 6.342 3.766 8.097
279 HE1 TYR 41 HE1 TYR 41 8.499 2.511 3.798
280 HE2 TYR 41 HE2 TYR 41 6.134 1.408 7.170
281 HH TYR 41 HH TYR 41 6.682 0.040 5.598
282 H CYS 42 HN CYS 42 4.930 7.137 4.505
283 HA CYS 42 HA CYS 42 2.842 6.885 6.478
284 1HB CYS 42 HB2 CYS 42 2.791 7.583 3.537
285 2HB CYS 42 HB3 CYS 42 1.357 7.459 4.536
286 H GLU 43 HN GLU 43 0.932 5.366 5.976
287 HA GLU 43 HA GLU 43 2.059 2.897 4.944
288 1HB GLU 43 HB2 GLU 43 1.165 3.423 7.802
289 2HB GLU 43 HB3 GLU 43 1.235 1.800 7.145
290 1HG GLU 43 HG2 GLU 43 3.640 2.064 6.636
291 2HG GLU 43 HG3 GLU 43 3.597 3.737 7.155
292 HE2 GLU 43 HE2 GLU 43 3.929 0.867 9.871
293 H GLY 44 HN GLY 44 0.558 1.830 3.725
294 1HA GLY 44 HA1 GLY 44 -1.467 0.862 3.276
295 2HA GLY 44 HA2 GLY 44 -2.207 1.750 4.593
296 H LEU 45 HN LEU 45 -0.410 2.670 1.557
297 HA LEU 45 HA LEU 45 -2.509 4.610 1.006
298 1HB LEU 45 HB2 LEU 45 0.193 4.093 -0.236
299 2HB LEU 45 HB3 LEU 45 -0.950 5.272 -0.846
300 HG LEU 45 HG LEU 45 -0.823 6.080 1.731
301 1HD1 LEU 45 HD11 LEU 45 1.881 4.853 1.134
302 2HD1 LEU 45 HD12 LEU 45 1.565 6.029 2.432
303 3HD1 LEU 45 HD13 LEU 45 0.770 4.436 2.461
304 1HD2 LEU 45 HD21 LEU 45 1.065 6.848 -0.512
305 2HD2 LEU 45 HD22 LEU 45 -0.548 7.527 -0.185
306 3HD2 LEU 45 HD23 LEU 45 0.783 7.800 0.966
307 HA PRO 46 HA PRO 46 -3.997 2.164 -2.387
308 1HB PRO 46 HB2 PRO 46 -5.055 4.128 -3.964
309 2HB PRO 46 HB3 PRO 46 -5.934 3.381 -2.646
310 1HG PRO 46 HG2 PRO 46 -4.686 6.058 -2.758
311 2HG PRO 46 HG3 PRO 46 -5.905 5.461 -1.650
312 1HD PRO 46 HD2 PRO 46 -3.114 5.821 -1.098
313 2HD PRO 46 HD3 PRO 46 -4.311 5.116 -0.030
314 H GLU 47 HN GLU 47 -3.663 1.777 -4.748
315 HA GLU 47 HA GLU 47 -0.858 1.778 -4.752
316 1HB GLU 47 HB2 GLU 47 -1.049 0.307 -6.654
317 2HB GLU 47 HB3 GLU 47 -2.356 -0.096 -5.558
318 1HG GLU 47 HG2 GLU 47 -3.840 1.503 -6.937
319 2HG GLU 47 HG3 GLU 47 -2.539 1.564 -8.109
320 HE2 GLU 47 HE2 GLU 47 -1.823 -0.389 -8.835
321 H ASN 48 HN ASN 48 -3.222 3.982 -5.971
322 HA ASN 48 HA ASN 48 -1.893 4.633 -8.368
323 1HB ASN 48 HB2 ASN 48 -3.568 6.428 -8.540
324 2HB ASN 48 HB3 ASN 48 -4.362 4.977 -7.962
325 1HD2 ASN 48 HD21 ASN 48 -4.135 8.385 -5.720
326 2HD2 ASN 48 HD22 ASN 48 -3.353 8.197 -7.255
327 H ALA 49 HN ALA 49 -1.538 5.442 -4.990
328 HA ALA 49 HA ALA 49 -0.584 8.120 -5.422
329 1HB ALA 49 HB1 ALA 49 -1.909 7.479 -3.429
330 2HB ALA 49 HB2 ALA 49 -0.620 6.351 -2.943
331 3HB ALA 49 HB3 ALA 49 -0.304 8.102 -2.977
332 H LYS 50 HN LYS 50 1.488 8.695 -5.871
333 HA LYS 50 HA LYS 50 3.373 6.573 -6.235
334 1HB LYS 50 HB2 LYS 50 3.210 8.303 -7.904
335 2HB LYS 50 HB3 LYS 50 3.490 9.561 -6.717
336 1HG LYS 50 HG2 LYS 50 5.587 9.176 -7.874
337 2HG LYS 50 HG3 LYS 50 5.765 8.550 -6.247
338 1HD LYS 50 HD2 LYS 50 5.414 6.256 -7.008
339 2HD LYS 50 HD3 LYS 50 4.951 6.798 -8.609
340 1HE LYS 50 HE2 LYS 50 7.268 6.018 -8.688
341 2HE LYS 50 HE3 LYS 50 7.254 7.752 -8.938
342 1HZ LYS 50 HZ1 LYS 50 7.942 8.096 -6.684
343 2HZ LYS 50 HZ2 LYS 50 7.705 6.540 -6.267
344 H VAL 51 HN VAL 51 4.760 5.810 -4.736
345 HA VAL 51 HA VAL 51 5.606 7.702 -2.653
346 HB VAL 51 HB VAL 51 5.582 5.961 -1.048
347 1HG1 VAL 51 HG11 VAL 51 3.403 7.061 -1.571
348 2HG1 VAL 51 HG12 VAL 51 3.010 5.692 -2.638
349 3HG1 VAL 51 HG13 VAL 51 3.231 5.425 -0.892
350 1HG2 VAL 51 HG21 VAL 51 4.962 4.093 -3.355
351 2HG2 VAL 51 HG22 VAL 51 6.393 4.086 -2.297
352 3HG2 VAL 51 HG23 VAL 51 4.800 3.638 -1.641
353 H SER 52 HN SER 52 7.877 7.378 -1.897
354 HA SER 52 HA SER 52 9.373 5.539 -3.558
355 1HB SER 52 HB2 SER 52 10.600 7.534 -3.191
356 2HB SER 52 HB3 SER 52 10.118 7.641 -1.510
357 HG SER 52 HG SER 52 12.003 5.803 -2.699
358 H ASP 53 HN ASP 53 10.196 3.559 -2.769
359 HA ASP 53 HA ASP 53 9.962 3.119 0.077
360 1HB ASP 53 HB2 ASP 53 9.055 0.808 -0.343
361 2HB ASP 53 HB3 ASP 53 7.934 2.084 -0.774
362 HD2 ASP 53 HD2 ASP 53 10.057 -0.219 -1.935
363 H SER 54 HN SER 54 12.269 3.746 -1.499
364 HA SER 54 HA SER 54 13.736 1.295 -1.203
365 1HB SER 54 HB2 SER 54 14.807 1.608 -3.495
366 2HB SER 54 HB3 SER 54 13.150 1.038 -3.511
367 HG SER 54 HG SER 54 13.381 2.723 -5.049
368 H ALA 55 HN ALA 55 13.757 3.601 0.409
369 HA ALA 55 HA ALA 55 15.171 5.020 1.351
370 1HB ALA 55 HB1 ALA 55 17.266 3.459 -0.216
371 2HB ALA 55 HB2 ALA 55 17.558 4.459 1.228
372 3HB ALA 55 HB3 ALA 55 16.583 2.975 1.355
373 H THR 56 HN THR 56 13.823 6.209 -0.682
374 HA THR 56 HA THR 56 13.883 8.130 -1.798
375 HB THR 56 HB THR 56 16.638 8.370 -0.475
376 HG1 THR 56 HG1 THR 56 14.794 8.007 0.967
377 1HG2 THR 56 HG21 THR 56 14.672 10.468 -1.538
378 2HG2 THR 56 HG22 THR 56 16.108 10.830 -0.551
379 3HG2 THR 56 HG23 THR 56 16.299 10.145 -2.183
380 H ASN 57 HN ASN 57 13.776 6.965 -3.810
381 HA ASN 57 HA ASN 57 16.299 7.100 -5.241
382 1HB ASN 57 HB2 ASN 57 15.115 5.795 -7.010
383 2HB ASN 57 HB3 ASN 57 15.016 4.978 -5.463
384 1HD2 ASN 57 HD21 ASN 57 11.560 5.345 -4.982
385 2HD2 ASN 57 HD22 ASN 57 13.091 4.783 -4.399
386 H ILE 58 HN ILE 58 14.288 9.335 -4.330
387 HA ILE 58 HA ILE 58 14.113 10.568 -6.984
388 HB ILE 58 HB ILE 58 12.056 11.384 -5.056
389 1HG1 ILE 58 HG12 ILE 58 11.972 8.600 -6.256
390 2HG1 ILE 58 HG13 ILE 58 12.096 8.988 -4.552
391 1HG2 ILE 58 HG21 ILE 58 10.790 11.753 -6.945
392 2HG2 ILE 58 HG22 ILE 58 12.439 11.991 -7.570
393 3HG2 ILE 58 HG23 ILE 58 11.587 10.458 -7.870
394 1HD1 ILE 58 HD11 ILE 58 9.767 9.684 -6.398
395 2HD1 ILE 58 HD12 ILE 58 9.763 8.487 -5.081
396 3HD1 ILE 58 HD13 ILE 58 9.900 10.221 -4.707
397 H CYS 59 HN CYS 59 13.199 13.118 -6.016
398 HA CYS 59 HA CYS 59 15.756 14.118 -5.886
399 1HB CYS 59 HB2 CYS 59 14.542 16.295 -5.244
400 2HB CYS 59 HB3 CYS 59 14.224 15.563 -6.804
401 H GLY 60 HN GLY 60 13.277 13.526 -3.332
402 1HA GLY 60 HA1 GLY 60 13.480 13.279 -1.107
403 2HA GLY 60 HA2 GLY 60 15.204 13.058 -1.337
Start of MODEL 15
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 -1.038 -0.066
3 1HB LYS 1 HB2 LYS 1 1.456 0.379 -2.124
4 2HB LYS 1 HB3 LYS 1 1.801 1.793 -1.148
5 1HG LYS 1 HG2 LYS 1 4.025 0.846 -0.536
6 2HG LYS 1 HG3 LYS 1 3.680 -0.596 -1.471
7 1HD LYS 1 HD2 LYS 1 3.344 0.971 -3.505
8 2HD LYS 1 HD3 LYS 1 4.032 2.245 -2.518
9 1HE LYS 1 HE2 LYS 1 6.053 0.698 -2.125
10 2HE LYS 1 HE3 LYS 1 5.382 -0.362 -3.348
11 1HZ LYS 1 HZ1 LYS 1 5.410 1.611 -4.877
12 2HZ LYS 1 HZ2 LYS 1 6.220 2.457 -3.745
13 H ASP 2 HN ASP 2 2.682 -1.250 1.909
14 HA ASP 2 HA ASP 2 2.760 1.173 3.530
15 1HB ASP 2 HB2 ASP 2 2.523 -1.730 4.455
16 2HB ASP 2 HB3 ASP 2 2.632 -0.344 5.522
17 HD2 ASP 2 HD2 ASP 2 0.777 -1.832 5.914
18 H GLY 3 HN GLY 3 4.703 1.316 4.980
19 1HA GLY 3 HA1 GLY 3 6.673 -0.384 5.486
20 2HA GLY 3 HA2 GLY 3 7.038 0.013 3.818
21 H TYR 4 HN TYR 4 9.031 1.063 4.447
22 HA TYR 4 HA TYR 4 8.616 3.614 5.845
23 1HB TYR 4 HB2 TYR 4 11.209 2.146 5.091
24 2HB TYR 4 HB3 TYR 4 11.033 3.391 6.312
25 HD1 TYR 4 HD1 TYR 4 9.460 2.808 8.339
26 HD2 TYR 4 HD2 TYR 4 11.192 -0.103 5.725
27 HE1 TYR 4 HE1 TYR 4 9.139 1.014 10.112
28 HE2 TYR 4 HE2 TYR 4 10.866 -1.887 7.507
29 HH TYR 4 HH TYR 4 10.127 -2.343 9.479
30 HA PRO 5 HA PRO 5 8.961 5.043 1.720
31 1HB PRO 5 HB2 PRO 5 7.957 7.553 2.124
32 2HB PRO 5 HB3 PRO 5 6.946 6.152 1.830
33 1HG PRO 5 HG2 PRO 5 7.440 7.580 4.371
34 2HG PRO 5 HG3 PRO 5 6.140 6.476 3.967
35 1HD PRO 5 HD2 PRO 5 8.448 5.898 5.570
36 2HD PRO 5 HD3 PRO 5 7.208 4.765 5.070
37 H VAL 6 HN VAL 6 10.605 5.807 0.518
38 HA VAL 6 HA VAL 6 12.220 7.894 1.660
39 HB VAL 6 HB VAL 6 13.009 5.893 2.847
40 1HG1 VAL 6 HG11 VAL 6 14.019 4.031 1.739
41 2HG1 VAL 6 HG12 VAL 6 12.425 4.283 0.989
42 3HG1 VAL 6 HG13 VAL 6 13.898 4.827 0.151
43 1HG2 VAL 6 HG21 VAL 6 14.562 7.734 2.352
44 2HG2 VAL 6 HG22 VAL 6 15.395 6.161 2.350
45 3HG2 VAL 6 HG23 VAL 6 14.995 6.958 0.810
46 H ASP 7 HN ASP 7 12.818 9.179 -0.010
47 HA ASP 7 HA ASP 7 13.958 8.065 -2.303
48 1HB ASP 7 HB2 ASP 7 12.053 9.439 -3.720
49 2HB ASP 7 HB3 ASP 7 12.032 7.703 -3.482
50 HD2 ASP 7 HD2 ASP 7 8.959 7.911 -1.999
51 H SER 8 HN SER 8 11.784 10.916 -1.597
52 HA SER 8 HA SER 8 13.755 12.666 -2.683
53 1HB SER 8 HB2 SER 8 12.052 14.440 -2.166
54 2HB SER 8 HB3 SER 8 11.420 13.135 -3.151
55 HG SER 8 HG SER 8 9.971 13.725 -1.402
56 H LYS 9 HN LYS 9 12.501 11.676 0.516
57 HA LYS 9 HA LYS 9 13.730 13.902 1.852
58 1HB LYS 9 HB2 LYS 9 12.734 13.005 3.839
59 2HB LYS 9 HB3 LYS 9 11.551 12.930 2.548
60 1HG LYS 9 HG2 LYS 9 12.702 10.475 2.227
61 2HG LYS 9 HG3 LYS 9 12.989 10.697 3.941
62 1HD LYS 9 HD2 LYS 9 10.868 9.697 3.959
63 2HD LYS 9 HD3 LYS 9 10.445 11.395 4.035
64 1HE LYS 9 HE2 LYS 9 10.265 11.365 1.475
65 2HE LYS 9 HE3 LYS 9 10.451 9.625 1.549
66 1HZ LYS 9 HZ1 LYS 9 8.118 10.143 1.569
67 2HZ LYS 9 HZ2 LYS 9 8.477 9.602 3.062
68 H GLY 10 HN GLY 10 14.622 10.658 0.839
69 1HA GLY 10 HA1 GLY 10 16.865 10.272 0.403
70 2HA GLY 10 HA2 GLY 10 17.326 11.432 1.633
71 H CYS 11 HN CYS 11 16.135 10.683 3.950
72 HA CYS 11 HA CYS 11 16.947 7.890 4.271
73 1HB CYS 11 HB2 CYS 11 17.841 10.291 5.849
74 2HB CYS 11 HB3 CYS 11 17.824 8.693 6.567
75 H LYS 12 HN LYS 12 16.143 7.167 6.649
76 HA LYS 12 HA LYS 12 13.364 7.223 6.221
77 1HB LYS 12 HB2 LYS 12 14.965 6.062 8.521
78 2HB LYS 12 HB3 LYS 12 13.288 5.705 8.160
79 1HG LYS 12 HG2 LYS 12 15.688 5.128 6.362
80 2HG LYS 12 HG3 LYS 12 14.731 3.943 7.228
81 1HD LYS 12 HD2 LYS 12 12.699 4.994 5.879
82 2HD LYS 12 HD3 LYS 12 13.952 5.603 4.815
83 1HE LYS 12 HE2 LYS 12 13.524 2.670 5.564
84 2HE LYS 12 HE3 LYS 12 13.100 3.403 4.030
85 1HZ LYS 12 HZ1 LYS 12 15.287 2.270 3.988
86 2HZ LYS 12 HZ2 LYS 12 15.436 3.849 3.620
87 H LEU 13 HN LEU 13 11.661 7.951 7.658
88 HA LEU 13 HA LEU 13 12.386 10.317 9.150
89 1HB LEU 13 HB2 LEU 13 9.702 9.010 8.684
90 2HB LEU 13 HB3 LEU 13 9.972 10.571 9.432
91 HG LEU 13 HG LEU 13 10.765 9.907 6.585
92 1HD1 LEU 13 HD11 LEU 13 8.284 11.336 7.579
93 2HD1 LEU 13 HD12 LEU 13 8.784 11.160 5.880
94 3HD1 LEU 13 HD13 LEU 13 8.343 9.722 6.832
95 1HD2 LEU 13 HD21 LEU 13 12.087 11.709 7.392
96 2HD2 LEU 13 HD22 LEU 13 10.806 12.418 6.380
97 3HD2 LEU 13 HD23 LEU 13 10.681 12.492 8.154
98 H SER 14 HN SER 14 13.229 10.088 11.151
99 HA SER 14 HA SER 14 12.709 7.662 12.565
100 1HB SER 14 HB2 SER 14 14.332 8.597 14.221
101 2HB SER 14 HB3 SER 14 14.972 8.572 12.590
102 HG SER 14 HG SER 14 13.796 10.879 13.894
103 H CYS 15 HN CYS 15 10.522 7.694 13.246
104 HA CYS 15 HA CYS 15 9.281 9.896 14.401
105 1HB CYS 15 HB2 CYS 15 7.680 8.234 15.319
106 2HB CYS 15 HB3 CYS 15 7.948 8.115 13.591
107 H VAL 16 HN VAL 16 9.293 10.705 16.521
108 HA VAL 16 HA VAL 16 11.447 9.587 18.148
109 HB VAL 16 HB VAL 16 11.372 11.991 17.250
110 1HG1 VAL 16 HG11 VAL 16 9.513 12.375 19.617
111 2HG1 VAL 16 HG12 VAL 16 10.113 13.619 18.494
112 3HG1 VAL 16 HG13 VAL 16 8.982 12.371 17.918
113 1HG2 VAL 16 HG21 VAL 16 11.794 11.486 20.215
114 2HG2 VAL 16 HG22 VAL 16 12.984 11.215 18.919
115 3HG2 VAL 16 HG23 VAL 16 12.436 12.867 19.294
116 H ALA 17 HN ALA 17 8.093 9.445 17.850
117 HA ALA 17 HA ALA 17 7.802 8.519 20.552
118 1HB ALA 17 HB1 ALA 17 5.974 10.119 21.090
119 2HB ALA 17 HB2 ALA 17 7.545 10.932 20.895
120 3HB ALA 17 HB3 ALA 17 6.335 11.009 19.592
121 H ASN 18 HN ASN 18 5.414 7.743 20.857
122 HA ASN 18 HA ASN 18 5.293 5.795 18.924
123 1HB ASN 18 HB2 ASN 18 3.193 6.666 20.977
124 2HB ASN 18 HB3 ASN 18 3.102 5.168 20.073
125 1HD2 ASN 18 HD21 ASN 18 5.498 5.594 23.343
126 2HD2 ASN 18 HD22 ASN 18 4.444 6.825 22.729
127 H ASN 19 HN ASN 19 3.408 8.821 19.471
128 HA ASN 19 HA ASN 19 1.389 8.097 17.636
129 1HB ASN 19 HB2 ASN 19 0.617 10.477 18.001
130 2HB ASN 19 HB3 ASN 19 0.874 9.611 19.502
131 1HD2 ASN 19 HD21 ASN 19 2.914 12.989 18.604
132 2HD2 ASN 19 HD22 ASN 19 1.721 12.274 17.571
133 H TYR 20 HN TYR 20 4.605 9.496 17.410
134 HA TYR 20 HA TYR 20 3.982 11.808 15.991
135 1HB TYR 20 HB2 TYR 20 6.081 11.071 17.360
136 2HB TYR 20 HB3 TYR 20 6.549 10.106 15.974
137 HD1 TYR 20 HD1 TYR 20 6.270 13.504 17.325
138 HD2 TYR 20 HD2 TYR 20 7.341 11.170 13.903
139 HE1 TYR 20 HE1 TYR 20 7.460 15.513 16.318
140 HE2 TYR 20 HE2 TYR 20 8.528 13.186 12.908
141 HH TYR 20 HH TYR 20 9.087 15.250 13.166
142 H CYS 21 HN CYS 21 4.760 8.485 14.914
143 HA CYS 21 HA CYS 21 5.507 9.132 12.320
144 1HB CYS 21 HB2 CYS 21 5.999 6.982 13.293
145 2HB CYS 21 HB3 CYS 21 4.295 6.610 13.464
146 H ASP 22 HN ASP 22 2.324 8.575 13.911
147 HA ASP 22 HA ASP 22 0.973 7.858 11.626
148 1HB ASP 22 HB2 ASP 22 0.189 7.547 14.000
149 2HB ASP 22 HB3 ASP 22 -0.111 9.270 14.109
150 HD2 ASP 22 HD2 ASP 22 -0.920 6.492 12.417
151 H ASN 23 HN ASN 23 1.162 11.028 13.414
152 HA ASN 23 HA ASN 23 -0.471 12.380 11.606
153 1HB ASN 23 HB2 ASN 23 0.640 14.453 12.715
154 2HB ASN 23 HB3 ASN 23 -0.218 13.359 13.781
155 1HD2 ASN 23 HD21 ASN 23 3.869 13.812 13.929
156 2HD2 ASN 23 HD22 ASN 23 2.873 14.532 12.708
157 H GLN 24 HN GLN 24 3.024 11.678 11.842
158 HA GLN 24 HA GLN 24 3.881 13.694 10.112
159 1HB GLN 24 HB2 GLN 24 5.382 12.541 11.701
160 2HB GLN 24 HB3 GLN 24 5.166 11.027 10.847
161 1HG GLN 24 HG2 GLN 24 6.235 11.938 8.832
162 2HG GLN 24 HG3 GLN 24 6.298 13.541 9.536
163 1HE2 GLN 24 HE21 GLN 24 9.585 12.891 10.460
164 2HE2 GLN 24 HE22 GLN 24 8.484 13.749 9.434
165 H CYS 25 HN CYS 25 2.663 10.369 9.638
166 HA CYS 25 HA CYS 25 3.612 10.226 6.952
167 1HB CYS 25 HB2 CYS 25 1.733 8.466 8.538
168 2HB CYS 25 HB3 CYS 25 2.234 8.131 6.892
169 H LYS 26 HN LYS 26 0.470 10.769 8.675
170 HA LYS 26 HA LYS 26 -0.989 10.752 6.216
171 1HB LYS 26 HB2 LYS 26 -2.894 10.799 7.536
172 2HB LYS 26 HB3 LYS 26 -1.745 9.951 8.552
173 1HG LYS 26 HG2 LYS 26 -1.181 12.377 9.474
174 2HG LYS 26 HG3 LYS 26 -2.741 12.802 8.798
175 1HD LYS 26 HD2 LYS 26 -2.229 10.582 10.834
176 2HD LYS 26 HD3 LYS 26 -2.948 12.141 11.184
177 1HE LYS 26 HE2 LYS 26 -4.119 10.032 9.305
178 2HE LYS 26 HE3 LYS 26 -4.686 10.373 10.928
179 1HZ LYS 26 HZ1 LYS 26 -5.006 12.754 10.058
180 2HZ LYS 26 HZ2 LYS 26 -4.865 12.131 8.560
181 H MET 27 HN MET 27 0.948 13.048 7.881
182 HA MET 27 HA MET 27 -0.106 15.435 7.346
183 1HB MET 27 HB2 MET 27 2.262 14.840 8.148
184 2HB MET 27 HB3 MET 27 2.699 14.545 6.477
185 1HG MET 27 HG2 MET 27 1.757 16.991 6.066
186 2HG MET 27 HG3 MET 27 1.961 17.176 7.797
187 1HE MET 27 HE1 MET 27 4.560 15.284 8.375
188 2HE MET 27 HE2 MET 27 5.728 16.628 8.371
189 3HE MET 27 HE3 MET 27 4.108 16.858 9.073
190 H LYS 28 HN LYS 28 1.101 13.061 4.909
191 HA LYS 28 HA LYS 28 0.102 14.507 2.705
192 1HB LYS 28 HB2 LYS 28 1.823 16.128 3.313
193 2HB LYS 28 HB3 LYS 28 3.049 14.877 3.314
194 1HG LYS 28 HG2 LYS 28 1.478 14.955 0.803
195 2HG LYS 28 HG3 LYS 28 2.335 16.451 1.121
196 1HD LYS 28 HD2 LYS 28 4.462 15.167 1.431
197 2HD LYS 28 HD3 LYS 28 3.606 13.671 1.113
198 1HE LYS 28 HE2 LYS 28 3.020 14.459 -1.170
199 2HE LYS 28 HE3 LYS 28 3.792 16.001 -0.858
200 1HZ LYS 28 HZ1 LYS 28 5.174 13.370 -0.896
201 2HZ LYS 28 HZ2 LYS 28 5.309 14.532 -2.029
202 H LYS 29 HN LYS 29 2.706 12.315 3.951
203 HA LYS 29 HA LYS 29 3.268 11.226 1.453
204 1HB LYS 29 HB2 LYS 29 3.723 10.051 4.212
205 2HB LYS 29 HB3 LYS 29 4.493 9.512 2.733
206 1HG LYS 29 HG2 LYS 29 6.079 11.111 2.966
207 2HG LYS 29 HG3 LYS 29 4.850 12.356 2.853
208 1HD LYS 29 HD2 LYS 29 4.385 11.948 5.359
209 2HD LYS 29 HD3 LYS 29 5.834 10.964 5.381
210 1HE LYS 29 HE2 LYS 29 7.185 12.899 4.586
211 2HE LYS 29 HE3 LYS 29 5.741 13.888 4.494
212 1HZ LYS 29 HZ1 LYS 29 6.781 14.322 6.587
213 2HZ LYS 29 HZ2 LYS 29 5.459 13.438 6.941
214 H ALA 30 HN ALA 30 0.998 10.147 4.075
215 HA ALA 30 HA ALA 30 0.241 7.925 2.323
216 1HB ALA 30 HB1 ALA 30 0.854 6.303 3.866
217 2HB ALA 30 HB2 ALA 30 2.152 7.496 4.111
218 3HB ALA 30 HB3 ALA 30 0.779 7.430 5.242
219 H SER 31 HN SER 31 -1.590 6.614 3.748
220 HA SER 31 HA SER 31 -3.549 8.599 4.370
221 1HB SER 31 HB2 SER 31 -4.185 6.561 3.134
222 2HB SER 31 HB3 SER 31 -3.633 5.551 4.455
223 HG SER 31 HG SER 31 -5.821 7.449 4.536
224 H GLY 32 HN GLY 32 -1.414 6.267 6.042
225 1HA GLY 32 HA1 GLY 32 -1.936 7.570 8.578
226 2HA GLY 32 HA2 GLY 32 -2.486 5.909 8.476
227 H GLY 33 HN GLY 33 -0.827 5.599 10.247
228 1HA GLY 33 HA1 GLY 33 1.342 4.168 9.329
229 2HA GLY 33 HA2 GLY 33 1.947 5.786 9.621
230 H HIS 34 HN HIS 34 2.892 3.606 11.139
231 HA HIS 34 HA HIS 34 2.148 4.705 13.714
232 1HB HIS 34 HB2 HIS 34 2.032 2.508 14.775
233 2HB HIS 34 HB3 HIS 34 0.774 2.714 13.572
234 HD1 HIS 34 HD1 HIS 34 4.284 1.164 13.748
235 HD2 HIS 34 HD2 HIS 34 0.584 0.602 11.854
236 HE1 HIS 34 HE1 HIS 34 4.493 -0.989 12.394
237 H CYS 35 HN CYS 35 3.865 4.332 15.367
238 HA CYS 35 HA CYS 35 6.363 4.692 13.987
239 1HB CYS 35 HB2 CYS 35 5.704 6.295 15.684
240 2HB CYS 35 HB3 CYS 35 5.587 5.030 16.891
241 H TYR 36 HN TYR 36 6.759 2.447 13.288
242 HA TYR 36 HA TYR 36 7.368 0.489 15.264
243 1HB TYR 36 HB2 TYR 36 6.909 0.214 12.735
244 2HB TYR 36 HB3 TYR 36 8.434 1.019 12.420
245 HD1 TYR 36 HD1 TYR 36 10.390 -0.244 12.196
246 HD2 TYR 36 HD2 TYR 36 7.024 -1.954 14.209
247 HE1 TYR 36 HE1 TYR 36 11.589 -2.483 12.314
248 HE2 TYR 36 HE2 TYR 36 8.235 -4.187 14.320
249 HH TYR 36 HH TYR 36 11.503 -4.536 12.960
250 H ALA 37 HN ALA 37 9.617 -0.286 15.767
251 HA ALA 37 HA ALA 37 10.618 1.899 17.171
252 1HB ALA 37 HB1 ALA 37 12.306 0.260 17.968
253 2HB ALA 37 HB2 ALA 37 10.659 -0.412 17.995
254 3HB ALA 37 HB3 ALA 37 11.787 -0.873 16.698
255 H MET 38 HN MET 38 11.637 0.313 14.125
256 HA MET 38 HA MET 38 14.231 1.456 14.271
257 1HB MET 38 HB2 MET 38 13.337 -0.779 13.124
258 2HB MET 38 HB3 MET 38 12.955 0.266 11.770
259 1HG MET 38 HG2 MET 38 15.138 -0.434 11.232
260 2HG MET 38 HG3 MET 38 15.443 1.108 12.008
261 1HE MET 38 HE1 MET 38 17.941 0.349 12.418
262 2HE MET 38 HE2 MET 38 18.395 -1.159 13.246
263 3HE MET 38 HE3 MET 38 17.590 -1.223 11.660
264 H SER 39 HN SER 39 11.147 2.162 12.584
265 HA SER 39 HA SER 39 12.037 4.749 11.911
266 1HB SER 39 HB2 SER 39 11.823 2.667 9.699
267 2HB SER 39 HB3 SER 39 11.733 4.388 9.384
268 HG SER 39 HG SER 39 13.893 4.164 10.880
269 H CYS 40 HN CYS 40 10.255 5.983 10.751
270 HA CYS 40 HA CYS 40 7.754 5.307 11.782
271 1HB CYS 40 HB2 CYS 40 8.252 7.586 11.381
272 2HB CYS 40 HB3 CYS 40 8.649 7.294 9.700
273 H TYR 41 HN TYR 41 6.768 3.394 11.135
274 HA TYR 41 HA TYR 41 6.853 2.589 8.368
275 1HB TYR 41 HB2 TYR 41 6.858 1.074 10.444
276 2HB TYR 41 HB3 TYR 41 5.257 1.667 10.840
277 HD1 TYR 41 HD1 TYR 41 7.200 -0.401 8.471
278 HD2 TYR 41 HD2 TYR 41 3.294 0.855 9.685
279 HE1 TYR 41 HE1 TYR 41 6.160 -2.241 7.058
280 HE2 TYR 41 HE2 TYR 41 2.268 -0.989 8.268
281 HH TYR 41 HH TYR 41 4.344 -3.219 6.434
282 H CYS 42 HN CYS 42 5.670 3.803 6.943
283 HA CYS 42 HA CYS 42 3.235 5.022 7.907
284 1HB CYS 42 HB2 CYS 42 4.755 5.292 5.307
285 2HB CYS 42 HB3 CYS 42 3.244 6.114 5.646
286 H GLU 43 HN GLU 43 1.225 4.847 6.454
287 HA GLU 43 HA GLU 43 1.092 2.188 5.295
288 1HB GLU 43 HB2 GLU 43 -0.619 3.250 7.575
289 2HB GLU 43 HB3 GLU 43 -1.138 1.909 6.574
290 1HG GLU 43 HG2 GLU 43 0.938 0.653 7.165
291 2HG GLU 43 HG3 GLU 43 1.479 1.998 8.149
292 HE2 GLU 43 HE2 GLU 43 -0.890 -0.626 9.782
293 H GLY 44 HN GLY 44 -0.258 2.056 3.499
294 1HA GLY 44 HA1 GLY 44 -1.766 2.693 1.940
295 2HA GLY 44 HA2 GLY 44 -2.380 3.912 3.039
296 H LEU 45 HN LEU 45 0.793 3.286 1.358
297 HA LEU 45 HA LEU 45 0.979 6.109 0.749
298 1HB LEU 45 HB2 LEU 45 2.818 3.759 0.297
299 2HB LEU 45 HB3 LEU 45 3.164 5.381 -0.270
300 HG LEU 45 HG LEU 45 2.542 4.992 2.635
301 1HD1 LEU 45 HD11 LEU 45 4.118 3.179 2.111
302 2HD1 LEU 45 HD12 LEU 45 5.245 4.367 1.412
303 3HD1 LEU 45 HD13 LEU 45 4.852 4.427 3.147
304 1HD2 LEU 45 HD21 LEU 45 2.833 7.251 1.712
305 2HD2 LEU 45 HD22 LEU 45 4.089 6.849 2.908
306 3HD2 LEU 45 HD23 LEU 45 4.471 6.814 1.170
307 HA PRO 46 HA PRO 46 -0.042 5.468 -3.536
308 1HB PRO 46 HB2 PRO 46 1.277 7.588 -4.647
309 2HB PRO 46 HB3 PRO 46 -0.346 7.703 -3.997
310 1HG PRO 46 HG2 PRO 46 2.191 8.676 -2.832
311 2HG PRO 46 HG3 PRO 46 0.549 9.140 -2.430
312 1HD PRO 46 HD2 PRO 46 2.257 7.394 -0.926
313 2HD PRO 46 HD3 PRO 46 0.579 7.766 -0.587
314 H GLU 47 HN GLU 47 0.929 4.761 -5.580
315 HA GLU 47 HA GLU 47 2.822 2.935 -4.516
316 1HB GLU 47 HB2 GLU 47 1.431 3.150 -7.216
317 2HB GLU 47 HB3 GLU 47 2.549 1.858 -6.828
318 1HG GLU 47 HG2 GLU 47 1.127 1.239 -4.851
319 2HG GLU 47 HG3 GLU 47 0.000 2.512 -5.274
320 HE2 GLU 47 HE2 GLU 47 -0.858 2.404 -7.284
321 H ASN 48 HN ASN 48 2.996 5.920 -6.222
322 HA ASN 48 HA ASN 48 5.218 5.302 -7.833
323 1HB ASN 48 HB2 ASN 48 5.288 7.723 -8.269
324 2HB ASN 48 HB3 ASN 48 3.614 7.204 -8.268
325 1HD2 ASN 48 HD21 ASN 48 5.086 9.850 -5.520
326 2HD2 ASN 48 HD22 ASN 48 6.076 9.033 -6.683
327 H ALA 49 HN ALA 49 4.685 6.043 -4.463
328 HA ALA 49 HA ALA 49 7.265 7.241 -4.021
329 1HB ALA 49 HB1 ALA 49 6.523 7.282 -1.678
330 2HB ALA 49 HB2 ALA 49 5.245 7.908 -2.747
331 3HB ALA 49 HB3 ALA 49 5.126 6.259 -2.089
332 H LYS 50 HN LYS 50 9.132 6.192 -3.487
333 HA LYS 50 HA LYS 50 9.060 3.321 -3.585
334 1HB LYS 50 HB2 LYS 50 10.767 4.672 -4.779
335 2HB LYS 50 HB3 LYS 50 11.394 5.228 -3.240
336 1HG LYS 50 HG2 LYS 50 11.100 2.259 -3.536
337 2HG LYS 50 HG3 LYS 50 12.329 3.009 -4.535
338 1HD LYS 50 HD2 LYS 50 13.372 4.043 -2.538
339 2HD LYS 50 HD3 LYS 50 12.102 3.403 -1.514
340 1HE LYS 50 HE2 LYS 50 12.787 1.057 -2.270
341 2HE LYS 50 HE3 LYS 50 14.155 1.783 -3.092
342 1HZ LYS 50 HZ1 LYS 50 14.857 2.710 -0.921
343 2HZ LYS 50 HZ2 LYS 50 13.616 1.964 -0.175
344 H VAL 51 HN VAL 51 9.397 1.880 -1.907
345 HA VAL 51 HA VAL 51 9.708 3.101 0.745
346 HB VAL 51 HB VAL 51 7.984 1.790 1.633
347 1HG1 VAL 51 HG11 VAL 51 6.970 2.682 -1.087
348 2HG1 VAL 51 HG12 VAL 51 6.008 2.460 0.394
349 3HG1 VAL 51 HG13 VAL 51 7.227 3.754 0.310
350 1HG2 VAL 51 HG21 VAL 51 6.719 0.112 0.208
351 2HG2 VAL 51 HG22 VAL 51 8.043 0.248 -0.974
352 3HG2 VAL 51 HG23 VAL 51 8.375 -0.350 0.670
353 H SER 52 HN SER 52 11.007 1.913 2.218
354 HA SER 52 HA SER 52 12.079 -0.567 1.165
355 1HB SER 52 HB2 SER 52 13.742 0.955 2.084
356 2HB SER 52 HB3 SER 52 12.831 1.147 3.569
357 HG SER 52 HG SER 52 14.639 -0.359 3.764
358 H ASP 53 HN ASP 53 11.993 -2.554 2.539
359 HA ASP 53 HA ASP 53 10.201 -2.262 4.817
360 1HB ASP 53 HB2 ASP 53 9.445 -4.599 4.439
361 2HB ASP 53 HB3 ASP 53 9.056 -3.571 3.075
362 HD2 ASP 53 HD2 ASP 53 12.005 -5.241 1.457
363 H SER 54 HN SER 54 13.206 -2.055 4.526
364 HA SER 54 HA SER 54 14.023 -4.660 5.558
365 1HB SER 54 HB2 SER 54 16.228 -4.185 4.347
366 2HB SER 54 HB3 SER 54 14.853 -4.546 3.322
367 HG SER 54 HG SER 54 14.594 -2.302 2.878
368 H ALA 55 HN ALA 55 13.236 -2.270 7.143
369 HA ALA 55 HA ALA 55 13.892 -1.638 9.159
370 1HB ALA 55 HB1 ALA 55 16.051 -3.751 8.770
371 2HB ALA 55 HB2 ALA 55 15.508 -3.076 10.325
372 3HB ALA 55 HB3 ALA 55 14.395 -4.060 9.345
373 H THR 56 HN THR 56 14.559 0.241 7.421
374 HA THR 56 HA THR 56 15.876 2.015 7.168
375 HB THR 56 HB THR 56 17.241 1.068 9.738
376 HG1 THR 56 HG1 THR 56 14.836 2.685 9.305
377 1HG2 THR 56 HG21 THR 56 18.194 3.156 8.799
378 2HG2 THR 56 HG22 THR 56 16.558 3.822 8.579
379 3HG2 THR 56 HG23 THR 56 17.193 3.546 10.218
380 H ASN 57 HN ASN 57 16.592 0.485 5.291
381 HA ASN 57 HA ASN 57 19.208 -0.557 5.590
382 1HB ASN 57 HB2 ASN 57 19.000 -0.950 3.090
383 2HB ASN 57 HB3 ASN 57 17.672 -1.626 4.011
384 1HD2 ASN 57 HD21 ASN 57 16.844 0.708 0.967
385 2HD2 ASN 57 HD22 ASN 57 18.234 -0.292 1.231
386 H ILE 58 HN ILE 58 17.699 2.500 4.731
387 HA ILE 58 HA ILE 58 20.291 3.506 3.788
388 HB ILE 58 HB ILE 58 17.482 4.517 3.349
389 1HG1 ILE 58 HG12 ILE 58 19.423 3.813 1.176
390 2HG1 ILE 58 HG13 ILE 58 18.599 2.518 2.020
391 1HG2 ILE 58 HG21 ILE 58 18.589 6.253 1.916
392 2HG2 ILE 58 HG22 ILE 58 18.838 6.453 3.668
393 3HG2 ILE 58 HG23 ILE 58 20.140 5.786 2.654
394 1HD1 ILE 58 HD11 ILE 58 16.402 3.495 1.478
395 2HD1 ILE 58 HD12 ILE 58 17.194 4.894 0.714
396 3HD1 ILE 58 HD13 ILE 58 17.352 3.277 -0.012
397 H CYS 59 HN CYS 59 21.132 5.482 4.757
398 HA CYS 59 HA CYS 59 22.057 6.021 6.690
399 1HB CYS 59 HB2 CYS 59 19.196 6.869 7.053
400 2HB CYS 59 HB3 CYS 59 20.375 7.142 8.321
401 H GLY 60 HN GLY 60 21.916 3.327 6.646
402 1HA GLY 60 HA1 GLY 60 20.441 2.224 8.845
403 2HA GLY 60 HA2 GLY 60 21.663 1.435 7.868
Start of MODEL 16
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 -1.003 -0.274
3 1HB LYS 1 HB2 LYS 1 1.809 1.988 -0.759
4 2HB LYS 1 HB3 LYS 1 3.068 0.837 -1.159
5 1HG LYS 1 HG2 LYS 1 1.208 -0.373 -2.573
6 2HG LYS 1 HG3 LYS 1 0.322 1.132 -2.424
7 1HD LYS 1 HD2 LYS 1 3.085 0.749 -3.663
8 2HD LYS 1 HD3 LYS 1 1.609 1.188 -4.501
9 1HE LYS 1 HE2 LYS 1 1.564 3.263 -2.884
10 2HE LYS 1 HE3 LYS 1 3.243 2.874 -2.570
11 1HZ LYS 1 HZ1 LYS 1 2.080 3.463 -5.239
12 2HZ LYS 1 HZ2 LYS 1 3.105 4.417 -4.408
13 H ASP 2 HN ASP 2 3.840 -0.382 0.937
14 HA ASP 2 HA ASP 2 3.303 1.206 3.282
15 1HB ASP 2 HB2 ASP 2 4.592 -1.549 3.495
16 2HB ASP 2 HB3 ASP 2 4.180 -0.479 4.820
17 HD2 ASP 2 HD2 ASP 2 2.887 -2.259 2.289
18 H GLY 3 HN GLY 3 5.226 2.307 3.963
19 1HA GLY 3 HA1 GLY 3 7.822 1.705 3.730
20 2HA GLY 3 HA2 GLY 3 7.437 2.172 2.086
21 H TYR 4 HN TYR 4 8.633 4.120 2.052
22 HA TYR 4 HA TYR 4 7.909 6.074 4.130
23 1HB TYR 4 HB2 TYR 4 10.383 5.930 2.311
24 2HB TYR 4 HB3 TYR 4 10.226 6.870 3.782
25 HD1 TYR 4 HD1 TYR 4 9.866 5.510 5.997
26 HD2 TYR 4 HD2 TYR 4 11.409 3.829 2.378
27 HE1 TYR 4 HE1 TYR 4 10.905 3.602 7.318
28 HE2 TYR 4 HE2 TYR 4 12.443 1.927 3.711
29 HH TYR 4 HH TYR 4 11.693 1.460 7.063
30 HA PRO 5 HA PRO 5 6.089 7.734 0.527
31 1HB PRO 5 HB2 PRO 5 4.379 9.492 1.732
32 2HB PRO 5 HB3 PRO 5 4.006 7.795 1.507
33 1HG PRO 5 HG2 PRO 5 4.794 9.207 3.981
34 2HG PRO 5 HG3 PRO 5 4.019 7.645 3.808
35 1HD PRO 5 HD2 PRO 5 6.778 8.133 4.423
36 2HD PRO 5 HD3 PRO 5 6.028 6.575 4.136
37 H VAL 6 HN VAL 6 6.271 9.458 -0.915
38 HA VAL 6 HA VAL 6 7.283 11.899 0.336
39 HB VAL 6 HB VAL 6 8.620 12.100 -1.908
40 1HG1 VAL 6 HG11 VAL 6 10.604 11.221 -0.790
41 2HG1 VAL 6 HG12 VAL 6 9.579 12.101 0.368
42 3HG1 VAL 6 HG13 VAL 6 9.584 10.321 0.358
43 1HG2 VAL 6 HG21 VAL 6 9.466 10.032 -2.798
44 2HG2 VAL 6 HG22 VAL 6 8.600 9.085 -1.564
45 3HG2 VAL 6 HG23 VAL 6 7.687 9.956 -2.820
46 H ASP 7 HN ASP 7 6.046 13.632 -0.204
47 HA ASP 7 HA ASP 7 5.178 13.950 -2.852
48 1HB ASP 7 HB2 ASP 7 2.670 14.263 -1.816
49 2HB ASP 7 HB3 ASP 7 3.204 12.807 -2.631
50 HD2 ASP 7 HD2 ASP 7 3.179 12.583 1.379
51 H SER 8 HN SER 8 3.782 14.802 0.414
52 HA SER 8 HA SER 8 3.927 17.571 -0.318
53 1HB SER 8 HB2 SER 8 2.675 17.926 1.814
54 2HB SER 8 HB3 SER 8 1.886 16.773 0.756
55 HG SER 8 HG SER 8 3.374 16.272 3.169
56 H LYS 9 HN LYS 9 5.857 15.220 1.335
57 HA LYS 9 HA LYS 9 6.857 17.178 3.258
58 1HB LYS 9 HB2 LYS 9 7.771 15.202 4.431
59 2HB LYS 9 HB3 LYS 9 6.030 15.144 4.245
60 1HG LYS 9 HG2 LYS 9 7.512 13.904 1.987
61 2HG LYS 9 HG3 LYS 9 7.784 13.111 3.526
62 1HD LYS 9 HD2 LYS 9 4.961 13.813 2.660
63 2HD LYS 9 HD3 LYS 9 5.737 12.373 2.030
64 1HE LYS 9 HE2 LYS 9 6.126 11.541 4.342
65 2HE LYS 9 HE3 LYS 9 5.424 13.004 5.005
66 1HZ LYS 9 HZ1 LYS 9 3.774 11.236 4.915
67 2HZ LYS 9 HZ2 LYS 9 3.321 12.412 3.883
68 H GLY 10 HN GLY 10 7.590 15.650 0.240
69 1HA GLY 10 HA1 GLY 10 9.274 16.281 -1.163
70 2HA GLY 10 HA2 GLY 10 10.065 17.140 0.144
71 H CYS 11 HN CYS 11 11.001 15.662 1.972
72 HA CYS 11 HA CYS 11 11.952 13.155 0.830
73 1HB CYS 11 HB2 CYS 11 13.672 15.429 1.801
74 2HB CYS 11 HB3 CYS 11 14.244 13.773 1.827
75 H LYS 12 HN LYS 12 10.132 12.548 2.492
76 HA LYS 12 HA LYS 12 10.038 11.028 4.094
77 1HB LYS 12 HB2 LYS 12 12.925 11.379 3.743
78 2HB LYS 12 HB3 LYS 12 12.503 10.866 5.364
79 1HG LYS 12 HG2 LYS 12 12.832 8.897 3.920
80 2HG LYS 12 HG3 LYS 12 11.160 8.983 4.440
81 1HD LYS 12 HD2 LYS 12 10.372 9.437 2.316
82 2HD LYS 12 HD3 LYS 12 11.758 10.421 1.892
83 1HE LYS 12 HE2 LYS 12 13.096 8.525 1.333
84 2HE LYS 12 HE3 LYS 12 12.075 7.420 2.230
85 1HZ LYS 12 HZ1 LYS 12 10.308 7.830 0.575
86 2HZ LYS 12 HZ2 LYS 12 11.285 8.822 -0.269
87 H LEU 13 HN LEU 13 10.288 10.807 6.637
88 HA LEU 13 HA LEU 13 11.163 13.285 7.863
89 1HB LEU 13 HB2 LEU 13 9.217 13.221 9.437
90 2HB LEU 13 HB3 LEU 13 8.881 13.772 7.808
91 HG LEU 13 HG LEU 13 8.441 10.890 8.159
92 1HD1 LEU 13 HD11 LEU 13 7.797 11.460 10.394
93 2HD1 LEU 13 HD12 LEU 13 6.840 12.848 9.823
94 3HD1 LEU 13 HD13 LEU 13 6.319 11.189 9.440
95 1HD2 LEU 13 HD21 LEU 13 6.368 11.391 6.980
96 2HD2 LEU 13 HD22 LEU 13 6.664 13.136 7.167
97 3HD2 LEU 13 HD23 LEU 13 7.759 12.150 6.169
98 H SER 14 HN SER 14 12.177 12.939 9.898
99 HA SER 14 HA SER 14 13.533 10.532 9.683
100 1HB SER 14 HB2 SER 14 13.564 12.509 12.006
101 2HB SER 14 HB3 SER 14 14.801 11.317 11.658
102 HG SER 14 HG SER 14 15.265 12.409 9.663
103 H CYS 15 HN CYS 15 11.127 11.775 12.085
104 HA CYS 15 HA CYS 15 9.881 10.758 13.580
105 1HB CYS 15 HB2 CYS 15 8.980 8.743 13.137
106 2HB CYS 15 HB3 CYS 15 9.735 9.024 11.581
107 H VAL 16 HN VAL 16 10.426 10.559 15.746
108 HA VAL 16 HA VAL 16 12.691 8.807 16.368
109 HB VAL 16 HB VAL 16 12.154 11.327 17.912
110 1HG1 VAL 16 HG11 VAL 16 13.573 9.669 18.979
111 2HG1 VAL 16 HG12 VAL 16 14.603 9.572 17.531
112 3HG1 VAL 16 HG13 VAL 16 14.556 11.070 18.490
113 1HG2 VAL 16 HG21 VAL 16 13.861 11.058 15.418
114 2HG2 VAL 16 HG22 VAL 16 12.473 12.143 15.673
115 3HG2 VAL 16 HG23 VAL 16 13.985 12.405 16.575
116 H ALA 17 HN ALA 17 9.584 8.719 16.282
117 HA ALA 17 HA ALA 17 9.228 7.428 18.796
118 1HB ALA 17 HB1 ALA 17 8.998 9.639 19.683
119 2HB ALA 17 HB2 ALA 17 8.003 10.165 18.303
120 3HB ALA 17 HB3 ALA 17 7.345 9.009 19.486
121 H ASN 18 HN ASN 18 7.329 6.122 18.782
122 HA ASN 18 HA ASN 18 6.707 5.341 16.183
123 1HB ASN 18 HB2 ASN 18 5.419 4.623 18.869
124 2HB ASN 18 HB3 ASN 18 5.060 3.788 17.371
125 1HD2 ASN 18 HD21 ASN 18 8.031 1.938 17.171
126 2HD2 ASN 18 HD22 ASN 18 6.610 2.516 16.366
127 H ASN 19 HN ASN 19 4.928 7.093 18.809
128 HA ASN 19 HA ASN 19 2.457 7.075 17.590
129 1HB ASN 19 HB2 ASN 19 2.056 9.143 19.096
130 2HB ASN 19 HB3 ASN 19 2.572 7.683 19.917
131 1HD2 ASN 19 HD21 ASN 19 5.598 8.909 21.107
132 2HD2 ASN 19 HD22 ASN 19 4.481 7.595 20.953
133 H TYR 20 HN TYR 20 5.322 9.226 17.333
134 HA TYR 20 HA TYR 20 4.022 11.416 16.153
135 1HB TYR 20 HB2 TYR 20 6.283 11.409 17.258
136 2HB TYR 20 HB3 TYR 20 6.879 10.265 16.072
137 HD1 TYR 20 HD1 TYR 20 5.937 13.777 16.664
138 HD2 TYR 20 HD2 TYR 20 7.518 10.984 13.835
139 HE1 TYR 20 HE1 TYR 20 6.728 15.698 15.198
140 HE2 TYR 20 HE2 TYR 20 8.303 12.915 12.379
141 HH TYR 20 HH TYR 20 7.643 16.275 13.331
142 H CYS 21 HN CYS 21 5.576 8.461 14.810
143 HA CYS 21 HA CYS 21 5.289 9.284 12.124
144 1HB CYS 21 HB2 CYS 21 6.908 7.621 12.641
145 2HB CYS 21 HB3 CYS 21 5.723 6.599 13.430
146 H ASP 22 HN ASP 22 3.377 7.174 14.401
147 HA ASP 22 HA ASP 22 1.882 6.064 12.379
148 1HB ASP 22 HB2 ASP 22 2.169 5.195 14.743
149 2HB ASP 22 HB3 ASP 22 1.080 6.450 15.301
150 HD2 ASP 22 HD2 ASP 22 -1.431 4.124 14.977
151 H ASN 23 HN ASN 23 1.292 8.852 14.612
152 HA ASN 23 HA ASN 23 -1.404 9.113 13.965
153 1HB ASN 23 HB2 ASN 23 -1.345 11.058 15.343
154 2HB ASN 23 HB3 ASN 23 -0.049 10.073 15.993
155 1HD2 ASN 23 HD21 ASN 23 0.635 13.687 14.213
156 2HD2 ASN 23 HD22 ASN 23 -0.922 12.930 14.267
157 H GLN 24 HN GLN 24 1.642 10.228 12.527
158 HA GLN 24 HA GLN 24 0.388 12.353 11.085
159 1HB GLN 24 HB2 GLN 24 2.729 12.514 11.961
160 2HB GLN 24 HB3 GLN 24 3.215 11.225 10.879
161 1HG GLN 24 HG2 GLN 24 2.658 12.574 8.910
162 2HG GLN 24 HG3 GLN 24 1.933 13.819 9.908
163 1HE2 GLN 24 HE21 GLN 24 5.401 14.795 8.872
164 2HE2 GLN 24 HE22 GLN 24 3.959 14.284 8.059
165 H CYS 25 HN CYS 25 1.301 8.964 10.600
166 HA CYS 25 HA CYS 25 1.154 9.060 7.770
167 1HB CYS 25 HB2 CYS 25 1.046 6.748 9.716
168 2HB CYS 25 HB3 CYS 25 1.074 6.567 7.973
169 H LYS 26 HN LYS 26 -1.080 8.222 10.507
170 HA LYS 26 HA LYS 26 -2.823 6.820 8.755
171 1HB LYS 26 HB2 LYS 26 -4.023 6.244 10.700
172 2HB LYS 26 HB3 LYS 26 -2.339 6.282 11.181
173 1HG LYS 26 HG2 LYS 26 -2.604 8.504 12.183
174 2HG LYS 26 HG3 LYS 26 -4.229 8.652 11.542
175 1HD LYS 26 HD2 LYS 26 -4.354 8.020 13.908
176 2HD LYS 26 HD3 LYS 26 -4.954 6.697 12.929
177 1HE LYS 26 HE2 LYS 26 -2.882 5.451 13.176
178 2HE LYS 26 HE3 LYS 26 -2.055 6.833 13.868
179 1HZ LYS 26 HZ1 LYS 26 -3.528 6.695 15.796
180 2HZ LYS 26 HZ2 LYS 26 -4.353 5.450 15.148
181 H MET 27 HN MET 27 -2.400 10.157 9.609
182 HA MET 27 HA MET 27 -5.046 10.848 10.016
183 1HB MET 27 HB2 MET 27 -4.207 13.145 9.886
184 2HB MET 27 HB3 MET 27 -2.939 12.177 10.613
185 1HG MET 27 HG2 MET 27 -1.972 11.903 8.222
186 2HG MET 27 HG3 MET 27 -3.095 13.155 7.729
187 1HE MET 27 HE1 MET 27 -1.194 14.770 6.939
188 2HE MET 27 HE2 MET 27 0.264 15.116 7.900
189 3HE MET 27 HE3 MET 27 -0.045 13.464 7.315
190 H LYS 28 HN LYS 28 -3.269 10.167 7.075
191 HA LYS 28 HA LYS 28 -5.480 10.783 5.410
192 1HB LYS 28 HB2 LYS 28 -4.746 13.080 5.835
193 2HB LYS 28 HB3 LYS 28 -3.117 12.682 5.328
194 1HG LYS 28 HG2 LYS 28 -5.213 11.930 3.354
195 2HG LYS 28 HG3 LYS 28 -5.108 13.652 3.658
196 1HD LYS 28 HD2 LYS 28 -2.593 13.495 3.261
197 2HD LYS 28 HD3 LYS 28 -2.823 11.824 2.787
198 1HE LYS 28 HE2 LYS 28 -2.842 13.067 0.738
199 2HE LYS 28 HE3 LYS 28 -4.519 12.664 1.045
200 1HZ LYS 28 HZ1 LYS 28 -3.250 15.269 1.704
201 2HZ LYS 28 HZ2 LYS 28 -4.288 15.009 0.477
202 H LYS 29 HN LYS 29 -1.875 10.396 5.617
203 HA LYS 29 HA LYS 29 -1.669 9.734 2.898
204 1HB LYS 29 HB2 LYS 29 0.243 9.373 5.222
205 2HB LYS 29 HB3 LYS 29 0.668 9.073 3.549
206 1HG LYS 29 HG2 LYS 29 -0.566 11.729 4.346
207 2HG LYS 29 HG3 LYS 29 1.144 11.447 4.604
208 1HD LYS 29 HD2 LYS 29 1.508 11.014 2.224
209 2HD LYS 29 HD3 LYS 29 -0.215 11.023 1.904
210 1HE LYS 29 HE2 LYS 29 0.719 13.181 1.226
211 2HE LYS 29 HE3 LYS 29 -0.322 13.432 2.613
212 1HZ LYS 29 HZ1 LYS 29 2.034 14.464 2.631
213 2HZ LYS 29 HZ2 LYS 29 1.512 13.757 4.003
214 H ALA 30 HN ALA 30 -2.176 7.802 5.873
215 HA ALA 30 HA ALA 30 -2.125 5.374 4.260
216 1HB ALA 30 HB1 ALA 30 0.206 6.101 5.289
217 2HB ALA 30 HB2 ALA 30 -0.498 5.455 6.791
218 3HB ALA 30 HB3 ALA 30 -0.327 4.405 5.364
219 H SER 31 HN SER 31 -2.478 3.442 6.064
220 HA SER 31 HA SER 31 -4.793 4.299 7.548
221 1HB SER 31 HB2 SER 31 -4.943 2.229 6.222
222 2HB SER 31 HB3 SER 31 -3.574 1.544 7.075
223 HG SER 31 HG SER 31 -6.141 2.241 8.225
224 H GLY 32 HN GLY 32 -1.436 3.156 7.999
225 1HA GLY 32 HA1 GLY 32 -1.516 4.163 10.729
226 2HA GLY 32 HA2 GLY 32 -1.163 2.455 10.551
227 H GLY 33 HN GLY 33 0.930 3.352 11.635
228 1HA GLY 33 HA1 GLY 33 2.928 3.064 9.643
229 2HA GLY 33 HA2 GLY 33 2.871 4.724 10.204
230 H HIS 34 HN HIS 34 5.141 3.066 10.643
231 HA HIS 34 HA HIS 34 5.138 3.355 13.530
232 1HB HIS 34 HB2 HIS 34 5.278 0.815 12.170
233 2HB HIS 34 HB3 HIS 34 6.801 1.127 12.980
234 HD1 HIS 34 HD1 HIS 34 3.219 1.903 14.133
235 HD2 HIS 34 HD2 HIS 34 6.617 -0.244 15.333
236 HE1 HIS 34 HE1 HIS 34 2.679 0.936 16.431
237 H CYS 35 HN CYS 35 7.420 3.564 14.388
238 HA CYS 35 HA CYS 35 8.726 5.313 12.486
239 1HB CYS 35 HB2 CYS 35 8.172 6.296 14.595
240 2HB CYS 35 HB3 CYS 35 8.949 4.998 15.481
241 H TYR 36 HN TYR 36 10.155 4.166 11.180
242 HA TYR 36 HA TYR 36 11.928 2.247 12.498
243 1HB TYR 36 HB2 TYR 36 10.529 1.956 10.255
244 2HB TYR 36 HB3 TYR 36 11.695 3.054 9.544
245 HD1 TYR 36 HD1 TYR 36 11.598 -0.132 11.527
246 HD2 TYR 36 HD2 TYR 36 13.576 2.163 8.506
247 HE1 TYR 36 HE1 TYR 36 13.160 -2.082 11.058
248 HE2 TYR 36 HE2 TYR 36 15.131 0.204 8.047
249 HH TYR 36 HH TYR 36 15.672 -1.818 8.554
250 H ALA 37 HN ALA 37 14.296 2.320 11.806
251 HA ALA 37 HA ALA 37 15.184 4.681 12.961
252 1HB ALA 37 HB1 ALA 37 16.693 2.545 11.399
253 2HB ALA 37 HB2 ALA 37 17.438 3.756 12.470
254 3HB ALA 37 HB3 ALA 37 16.342 2.526 13.144
255 H MET 38 HN MET 38 14.830 3.672 9.552
256 HA MET 38 HA MET 38 16.474 5.722 8.551
257 1HB MET 38 HB2 MET 38 14.293 3.958 7.313
258 2HB MET 38 HB3 MET 38 15.265 5.057 6.356
259 1HG MET 38 HG2 MET 38 16.533 2.951 8.160
260 2HG MET 38 HG3 MET 38 16.071 2.594 6.507
261 1HE MET 38 HE1 MET 38 19.084 2.479 7.796
262 2HE MET 38 HE2 MET 38 18.605 1.917 6.177
263 3HE MET 38 HE3 MET 38 19.976 3.037 6.361
264 H SER 39 HN SER 39 12.933 5.357 9.115
265 HA SER 39 HA SER 39 12.439 8.069 9.118
266 1HB SER 39 HB2 SER 39 12.376 6.769 6.429
267 2HB SER 39 HB3 SER 39 10.995 7.778 6.809
268 HG SER 39 HG SER 39 13.773 8.593 6.956
269 H CYS 40 HN CYS 40 9.924 8.468 8.914
270 HA CYS 40 HA CYS 40 8.499 6.574 10.345
271 1HB CYS 40 HB2 CYS 40 7.756 8.825 10.321
272 2HB CYS 40 HB3 CYS 40 7.637 8.856 8.573
273 H TYR 41 HN TYR 41 8.239 4.474 9.615
274 HA TYR 41 HA TYR 41 7.784 3.967 6.811
275 1HB TYR 41 HB2 TYR 41 9.112 2.505 8.440
276 2HB TYR 41 HB3 TYR 41 7.653 2.269 9.382
277 HD1 TYR 41 HD1 TYR 41 9.160 1.625 6.033
278 HD2 TYR 41 HD2 TYR 41 6.129 0.539 8.850
279 HE1 TYR 41 HE1 TYR 41 8.574 -0.411 4.628
280 HE2 TYR 41 HE2 TYR 41 5.553 -1.493 7.435
281 HH TYR 41 HH TYR 41 7.305 -2.137 4.408
282 H CYS 42 HN CYS 42 5.800 4.741 6.110
283 HA CYS 42 HA CYS 42 3.553 4.541 7.892
284 1HB CYS 42 HB2 CYS 42 3.875 5.710 5.124
285 2HB CYS 42 HB3 CYS 42 2.352 5.680 5.991
286 H GLU 43 HN GLU 43 1.454 3.508 7.081
287 HA GLU 43 HA GLU 43 2.152 1.106 5.604
288 1HB GLU 43 HB2 GLU 43 1.145 1.248 8.470
289 2HB GLU 43 HB3 GLU 43 0.958 -0.198 7.498
290 1HG GLU 43 HG2 GLU 43 3.405 -0.334 7.156
291 2HG GLU 43 HG3 GLU 43 3.637 1.179 8.010
292 HE2 GLU 43 HE2 GLU 43 3.190 -2.173 10.080
293 H GLY 44 HN GLY 44 0.585 0.674 4.110
294 1HA GLY 44 HA1 GLY 44 -1.547 0.146 3.452
295 2HA GLY 44 HA2 GLY 44 -2.200 0.886 4.900
296 H LEU 45 HN LEU 45 -0.186 1.972 2.063
297 HA LEU 45 HA LEU 45 -1.768 4.418 2.005
298 1HB LEU 45 HB2 LEU 45 0.815 3.605 0.672
299 2HB LEU 45 HB3 LEU 45 -0.014 5.113 0.343
300 HG LEU 45 HG LEU 45 0.152 5.283 3.037
301 1HD1 LEU 45 HD11 LEU 45 2.555 3.653 2.176
302 2HD1 LEU 45 HD12 LEU 45 2.439 4.558 3.705
303 3HD1 LEU 45 HD13 LEU 45 1.319 3.213 3.380
304 1HD2 LEU 45 HD21 LEU 45 2.287 6.092 1.044
305 2HD2 LEU 45 HD22 LEU 45 0.826 7.013 1.475
306 3HD2 LEU 45 HD23 LEU 45 2.102 6.749 2.688
307 HA PRO 46 HA PRO 46 -3.513 3.225 -1.918
308 1HB PRO 46 HB2 PRO 46 -4.055 5.697 -2.949
309 2HB PRO 46 HB3 PRO 46 -5.160 4.834 -1.898
310 1HG PRO 46 HG2 PRO 46 -3.424 7.142 -1.268
311 2HG PRO 46 HG3 PRO 46 -4.817 6.544 -0.389
312 1HD PRO 46 HD2 PRO 46 -2.060 6.179 0.312
313 2HD PRO 46 HD3 PRO 46 -3.448 5.485 1.125
314 H GLU 47 HN GLU 47 -3.051 3.332 -4.272
315 HA GLU 47 HA GLU 47 -0.277 2.845 -4.148
316 1HB GLU 47 HB2 GLU 47 -0.557 1.779 -6.280
317 2HB GLU 47 HB3 GLU 47 -2.011 1.434 -5.364
318 1HG GLU 47 HG2 GLU 47 -3.064 3.500 -6.505
319 2HG GLU 47 HG3 GLU 47 -1.669 3.515 -7.566
320 HE2 GLU 47 HE2 GLU 47 -4.471 0.714 -8.055
321 H ASN 48 HN ASN 48 -2.163 5.606 -4.925
322 HA ASN 48 HA ASN 48 -0.678 6.550 -7.098
323 1HB ASN 48 HB2 ASN 48 -1.853 8.705 -6.645
324 2HB ASN 48 HB3 ASN 48 -2.973 7.359 -6.569
325 1HD2 ASN 48 HD21 ASN 48 -3.100 9.843 -3.615
326 2HD2 ASN 48 HD22 ASN 48 -2.880 10.080 -5.316
327 H ALA 49 HN ALA 49 -0.302 6.559 -3.582
328 HA ALA 49 HA ALA 49 1.484 8.818 -3.546
329 1HB ALA 49 HB1 ALA 49 -0.086 8.362 -1.694
330 2HB ALA 49 HB2 ALA 49 0.703 6.793 -1.408
331 3HB ALA 49 HB3 ALA 49 1.602 8.305 -1.134
332 H LYS 50 HN LYS 50 3.630 8.722 -3.976
333 HA LYS 50 HA LYS 50 4.760 6.145 -4.536
334 1HB LYS 50 HB2 LYS 50 5.080 8.247 -5.918
335 2HB LYS 50 HB3 LYS 50 6.108 8.855 -4.637
336 1HG LYS 50 HG2 LYS 50 6.685 6.078 -5.636
337 2HG LYS 50 HG3 LYS 50 7.068 7.402 -6.717
338 1HD LYS 50 HD2 LYS 50 8.513 8.448 -5.040
339 2HD LYS 50 HD3 LYS 50 7.999 7.309 -3.812
340 1HE LYS 50 HE2 LYS 50 8.958 5.433 -5.252
341 2HE LYS 50 HE3 LYS 50 9.600 6.656 -6.330
342 1HZ LYS 50 HZ1 LYS 50 10.841 7.575 -4.416
343 2HZ LYS 50 HZ2 LYS 50 10.277 6.393 -3.449
344 H VAL 51 HN VAL 51 6.085 4.938 -3.257
345 HA VAL 51 HA VAL 51 7.144 6.264 -0.861
346 HB VAL 51 HB VAL 51 6.574 4.420 0.487
347 1HG1 VAL 51 HG11 VAL 51 4.175 4.420 0.444
348 2HG1 VAL 51 HG12 VAL 51 4.726 6.027 -0.087
349 3HG1 VAL 51 HG13 VAL 51 4.148 4.843 -1.284
350 1HG2 VAL 51 HG21 VAL 51 5.386 2.401 -0.455
351 2HG2 VAL 51 HG22 VAL 51 5.809 2.995 -2.078
352 3HG2 VAL 51 HG23 VAL 51 7.095 2.561 -0.926
353 H SER 52 HN SER 52 9.294 5.666 -0.292
354 HA SER 52 HA SER 52 10.572 3.747 -2.007
355 1HB SER 52 HB2 SER 52 12.006 5.530 -1.378
356 2HB SER 52 HB3 SER 52 11.469 5.505 0.290
357 HG SER 52 HG SER 52 13.420 4.482 0.398
358 H ASP 53 HN ASP 53 11.597 1.755 -1.115
359 HA ASP 53 HA ASP 53 10.634 1.009 1.506
360 1HB ASP 53 HB2 ASP 53 9.969 -1.244 0.683
361 2HB ASP 53 HB3 ASP 53 8.994 0.022 -0.036
362 HD2 ASP 53 HD2 ASP 53 11.245 -0.573 -3.015
363 H SER 54 HN SER 54 13.242 1.886 0.538
364 HA SER 54 HA SER 54 14.774 -0.443 1.142
365 1HB SER 54 HB2 SER 54 16.242 -0.072 -0.952
366 2HB SER 54 HB3 SER 54 14.710 -0.892 -1.184
367 HG SER 54 HG SER 54 15.138 0.820 -2.769
368 H ALA 55 HN ALA 55 14.773 1.428 2.911
369 HA ALA 55 HA ALA 55 16.103 2.757 4.077
370 1HB ALA 55 HB1 ALA 55 18.526 2.536 3.692
371 2HB ALA 55 HB2 ALA 55 17.721 0.953 3.576
372 3HB ALA 55 HB3 ALA 55 18.215 1.810 2.097
373 H THR 56 HN THR 56 14.489 4.181 2.396
374 HA THR 56 HA THR 56 14.305 6.383 2.068
375 HB THR 56 HB THR 56 17.323 6.681 2.383
376 HG1 THR 56 HG1 THR 56 16.846 6.530 4.669
377 1HG2 THR 56 HG21 THR 56 16.757 8.799 3.382
378 2HG2 THR 56 HG22 THR 56 15.726 8.691 1.935
379 3HG2 THR 56 HG23 THR 56 15.043 8.347 3.543
380 H ASN 57 HN ASN 57 17.530 5.570 0.600
381 HA ASN 57 HA ASN 57 18.347 6.414 -1.268
382 1HB ASN 57 HB2 ASN 57 17.240 5.399 -3.320
383 2HB ASN 57 HB3 ASN 57 17.528 4.241 -2.037
384 1HD2 ASN 57 HD21 ASN 57 14.183 3.537 -1.315
385 2HD2 ASN 57 HD22 ASN 57 15.843 3.417 -0.835
386 H ILE 58 HN ILE 58 16.924 8.501 -0.072
387 HA ILE 58 HA ILE 58 16.348 10.032 -2.413
388 HB ILE 58 HB ILE 58 14.170 8.832 -1.035
389 1HG1 ILE 58 HG12 ILE 58 13.996 11.001 -3.127
390 2HG1 ILE 58 HG13 ILE 58 14.581 9.396 -3.518
391 1HG2 ILE 58 HG21 ILE 58 14.227 11.852 -0.783
392 2HG2 ILE 58 HG22 ILE 58 12.827 10.799 -0.465
393 3HG2 ILE 58 HG23 ILE 58 14.281 10.679 0.556
394 1HD1 ILE 58 HD11 ILE 58 12.188 9.462 -3.960
395 2HD1 ILE 58 HD12 ILE 58 12.455 8.434 -2.532
396 3HD1 ILE 58 HD13 ILE 58 11.860 10.099 -2.330
397 H CYS 59 HN CYS 59 16.681 12.278 -2.030
398 HA CYS 59 HA CYS 59 18.250 13.631 -1.231
399 1HB CYS 59 HB2 CYS 59 16.345 13.355 1.089
400 2HB CYS 59 HB3 CYS 59 17.680 14.489 1.115
401 H GLY 60 HN GLY 60 19.422 11.184 -1.321
402 1HA GLY 60 HA1 GLY 60 20.977 9.832 -0.403
403 2HA GLY 60 HA2 GLY 60 21.108 10.930 0.957
Start of MODEL 17
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 0.546 -0.885
3 1HB LYS 1 HB2 LYS 1 1.467 1.704 1.323
4 2HB LYS 1 HB3 LYS 1 1.786 0.179 2.124
5 1HG LYS 1 HG2 LYS 1 4.029 0.055 1.167
6 2HG LYS 1 HG3 LYS 1 3.715 1.417 0.110
7 1HD LYS 1 HD2 LYS 1 4.687 2.673 1.751
8 2HD LYS 1 HD3 LYS 1 3.144 2.533 2.571
9 1HE LYS 1 HE2 LYS 1 5.549 0.686 2.949
10 2HE LYS 1 HE3 LYS 1 4.988 1.892 4.090
11 1HZ LYS 1 HZ1 LYS 1 3.681 -0.646 3.357
12 2HZ LYS 1 HZ2 LYS 1 3.997 -0.064 4.845
13 H ASP 2 HN ASP 2 3.498 -0.876 -1.349
14 HA ASP 2 HA ASP 2 3.031 -3.614 -0.554
15 1HB ASP 2 HB2 ASP 2 3.267 -2.851 -3.493
16 2HB ASP 2 HB3 ASP 2 2.847 -4.419 -2.831
17 HD2 ASP 2 HD2 ASP 2 -0.034 -1.996 -3.767
18 H GLY 3 HN GLY 3 4.957 -4.971 -0.985
19 1HA GLY 3 HA1 GLY 3 7.103 -4.636 -2.487
20 2HA GLY 3 HA2 GLY 3 7.405 -3.407 -1.274
21 H TYR 4 HN TYR 4 9.300 -4.596 -0.543
22 HA TYR 4 HA TYR 4 8.668 -7.099 0.848
23 1HB TYR 4 HB2 TYR 4 11.412 -5.817 0.497
24 2HB TYR 4 HB3 TYR 4 11.022 -7.525 0.538
25 HD1 TYR 4 HD1 TYR 4 11.881 -4.810 -1.552
26 HD2 TYR 4 HD2 TYR 4 9.556 -8.401 -1.490
27 HE1 TYR 4 HE1 TYR 4 11.916 -4.885 -4.093
28 HE2 TYR 4 HE2 TYR 4 9.599 -8.464 -4.031
29 HH TYR 4 HH TYR 4 9.955 -7.163 -5.855
30 HA PRO 5 HA PRO 5 8.770 -4.539 4.404
31 1HB PRO 5 HB2 PRO 5 7.688 -6.341 6.151
32 2HB PRO 5 HB3 PRO 5 6.720 -5.292 5.135
33 1HG PRO 5 HG2 PRO 5 7.252 -8.184 4.836
34 2HG PRO 5 HG3 PRO 5 5.981 -7.221 4.109
35 1HD PRO 5 HD2 PRO 5 8.365 -8.166 2.825
36 2HD PRO 5 HD3 PRO 5 7.152 -7.107 2.134
37 H VAL 6 HN VAL 6 10.339 -3.997 5.806
38 HA VAL 6 HA VAL 6 11.924 -6.241 6.795
39 HB VAL 6 HB VAL 6 13.989 -4.949 6.305
40 1HG1 VAL 6 HG11 VAL 6 12.379 -5.652 3.829
41 2HG1 VAL 6 HG12 VAL 6 14.152 -5.622 3.983
42 3HG1 VAL 6 HG13 VAL 6 13.201 -6.831 4.878
43 1HG2 VAL 6 HG21 VAL 6 12.135 -3.240 4.612
44 2HG2 VAL 6 HG22 VAL 6 13.018 -2.719 6.067
45 3HG2 VAL 6 HG23 VAL 6 13.913 -3.172 4.596
46 H ASP 7 HN ASP 7 12.480 -6.017 8.935
47 HA ASP 7 HA ASP 7 12.826 -3.475 10.070
48 1HB ASP 7 HB2 ASP 7 10.916 -4.168 11.873
49 2HB ASP 7 HB3 ASP 7 10.603 -3.103 10.517
50 HD2 ASP 7 HD2 ASP 7 9.038 -6.789 10.481
51 H SER 8 HN SER 8 11.383 -6.602 11.307
52 HA SER 8 HA SER 8 13.186 -6.391 13.508
53 1HB SER 8 HB2 SER 8 11.871 -8.446 14.309
54 2HB SER 8 HB3 SER 8 10.952 -6.970 14.095
55 HG SER 8 HG SER 8 9.889 -7.809 12.388
56 H LYS 9 HN LYS 9 12.668 -8.448 10.626
57 HA LYS 9 HA LYS 9 14.524 -10.445 11.517
58 1HB LYS 9 HB2 LYS 9 14.011 -11.558 9.464
59 2HB LYS 9 HB3 LYS 9 12.513 -10.940 10.130
60 1HG LYS 9 HG2 LYS 9 13.190 -8.798 8.601
61 2HG LYS 9 HG3 LYS 9 14.024 -10.042 7.691
62 1HD LYS 9 HD2 LYS 9 11.906 -10.078 6.684
63 2HD LYS 9 HD3 LYS 9 11.748 -11.366 7.863
64 1HE LYS 9 HE2 LYS 9 9.771 -10.050 8.133
65 2HE LYS 9 HE3 LYS 9 10.792 -9.598 9.483
66 1HZ LYS 9 HZ1 LYS 9 10.519 -8.065 6.953
67 2HZ LYS 9 HZ2 LYS 9 9.924 -7.623 8.403
68 H GLY 10 HN GLY 10 14.644 -7.357 9.896
69 1HA GLY 10 HA1 GLY 10 16.539 -6.174 9.380
70 2HA GLY 10 HA2 GLY 10 17.517 -7.615 9.570
71 H CYS 11 HN CYS 11 17.178 -9.397 7.834
72 HA CYS 11 HA CYS 11 17.139 -7.939 5.294
73 1HB CYS 11 HB2 CYS 11 19.014 -9.917 6.457
74 2HB CYS 11 HB3 CYS 11 18.649 -10.116 4.755
75 H LYS 12 HN LYS 12 14.617 -8.621 5.681
76 HA LYS 12 HA LYS 12 13.238 -9.265 4.069
77 1HB LYS 12 HB2 LYS 12 15.722 -9.615 2.856
78 2HB LYS 12 HB3 LYS 12 14.922 -11.154 2.607
79 1HG LYS 12 HG2 LYS 12 14.283 -9.770 0.748
80 2HG LYS 12 HG3 LYS 12 12.874 -9.861 1.785
81 1HD LYS 12 HD2 LYS 12 12.930 -7.626 2.266
82 2HD LYS 12 HD3 LYS 12 14.664 -7.626 2.515
83 1HE LYS 12 HE2 LYS 12 13.292 -7.632 -0.218
84 2HE LYS 12 HE3 LYS 12 13.978 -6.217 0.556
85 1HZ LYS 12 HZ1 LYS 12 15.766 -6.908 -0.684
86 2HZ LYS 12 HZ2 LYS 12 16.090 -7.791 0.645
87 H LEU 13 HN LEU 13 12.101 -11.362 3.228
88 HA LEU 13 HA LEU 13 11.959 -13.049 5.599
89 1HB LEU 13 HB2 LEU 13 10.045 -12.624 3.301
90 2HB LEU 13 HB3 LEU 13 9.771 -13.720 4.641
91 HG LEU 13 HG LEU 13 10.122 -11.571 6.115
92 1HD1 LEU 13 HD11 LEU 13 10.833 -10.002 4.496
93 2HD1 LEU 13 HD12 LEU 13 9.496 -10.412 3.395
94 3HD1 LEU 13 HD13 LEU 13 9.163 -9.554 4.919
95 1HD2 LEU 13 HD21 LEU 13 7.627 -12.200 4.521
96 2HD2 LEU 13 HD22 LEU 13 8.073 -12.791 6.140
97 3HD2 LEU 13 HD23 LEU 13 7.672 -11.074 5.899
98 H SER 14 HN SER 14 13.057 -13.024 2.283
99 HA SER 14 HA SER 14 14.059 -14.522 1.073
100 1HB SER 14 HB2 SER 14 14.476 -16.002 3.709
101 2HB SER 14 HB3 SER 14 15.364 -16.311 2.230
102 HG SER 14 HG SER 14 15.354 -13.849 3.757
103 H CYS 15 HN CYS 15 11.941 -15.037 0.063
104 HA CYS 15 HA CYS 15 10.613 -17.393 1.072
105 1HB CYS 15 HB2 CYS 15 8.929 -16.940 -0.605
106 2HB CYS 15 HB3 CYS 15 9.255 -15.514 0.360
107 H VAL 16 HN VAL 16 10.504 -19.396 -0.116
108 HA VAL 16 HA VAL 16 12.060 -19.442 -2.607
109 HB VAL 16 HB VAL 16 13.155 -20.531 -0.587
110 1HG1 VAL 16 HG11 VAL 16 11.051 -21.539 0.310
111 2HG1 VAL 16 HG12 VAL 16 11.055 -22.669 -1.066
112 3HG1 VAL 16 HG13 VAL 16 12.382 -22.705 0.120
113 1HG2 VAL 16 HG21 VAL 16 13.988 -22.410 -1.892
114 2HG2 VAL 16 HG22 VAL 16 12.590 -22.301 -2.990
115 3HG2 VAL 16 HG23 VAL 16 13.787 -20.984 -2.939
116 H ALA 17 HN ALA 17 9.064 -19.169 -1.586
117 HA ALA 17 HA ALA 17 7.901 -20.877 -3.543
118 1HB ALA 17 HB1 ALA 17 8.372 -22.561 -1.811
119 2HB ALA 17 HB2 ALA 17 7.529 -21.565 -0.600
120 3HB ALA 17 HB3 ALA 17 6.620 -22.280 -1.953
121 H ASN 18 HN ASN 18 5.509 -20.533 -3.639
122 HA ASN 18 HA ASN 18 5.178 -17.756 -3.338
123 1HB ASN 18 HB2 ASN 18 3.182 -19.919 -4.196
124 2HB ASN 18 HB3 ASN 18 2.933 -18.197 -4.405
125 1HD2 ASN 18 HD21 ASN 18 5.244 -17.754 -7.053
126 2HD2 ASN 18 HD22 ASN 18 4.442 -16.998 -5.716
127 H ASN 19 HN ASN 19 3.779 -20.751 -1.869
128 HA ASN 19 HA ASN 19 1.735 -19.452 -0.504
129 1HB ASN 19 HB2 ASN 19 1.652 -21.604 0.844
130 2HB ASN 19 HB3 ASN 19 1.640 -21.867 -0.888
131 1HD2 ASN 19 HD21 ASN 19 4.134 -24.041 1.036
132 2HD2 ASN 19 HD22 ASN 19 2.486 -23.593 1.323
133 H TYR 20 HN TYR 20 5.138 -20.339 0.264
134 HA TYR 20 HA TYR 20 5.159 -19.912 2.986
135 1HB TYR 20 HB2 TYR 20 7.040 -20.825 1.638
136 2HB TYR 20 HB3 TYR 20 7.125 -19.356 0.685
137 HD1 TYR 20 HD1 TYR 20 8.004 -17.243 1.731
138 HD2 TYR 20 HD2 TYR 20 8.191 -21.021 3.729
139 HE1 TYR 20 HE1 TYR 20 9.766 -16.325 3.317
140 HE2 TYR 20 HE2 TYR 20 9.952 -20.091 5.309
141 HH TYR 20 HH TYR 20 11.292 -16.869 4.817
142 H CYS 21 HN CYS 21 5.377 -17.553 0.272
143 HA CYS 21 HA CYS 21 5.963 -15.385 2.007
144 1HB CYS 21 HB2 CYS 21 6.728 -15.287 -0.251
145 2HB CYS 21 HB3 CYS 21 5.115 -15.544 -0.886
146 H ASP 22 HN ASP 22 3.031 -16.529 0.156
147 HA ASP 22 HA ASP 22 1.635 -14.220 0.567
148 1HB ASP 22 HB2 ASP 22 1.128 -16.121 -1.059
149 2HB ASP 22 HB3 ASP 22 0.450 -17.020 0.284
150 HD2 ASP 22 HD2 ASP 22 -2.490 -15.624 -0.995
151 H ASN 23 HN ASN 23 1.744 -17.318 2.436
152 HA ASN 23 HA ASN 23 -0.531 -16.764 3.941
153 1HB ASN 23 HB2 ASN 23 -0.091 -18.825 4.972
154 2HB ASN 23 HB3 ASN 23 0.872 -19.009 3.519
155 1HD2 ASN 23 HD21 ASN 23 4.035 -18.746 5.058
156 2HD2 ASN 23 HD22 ASN 23 3.126 -18.614 3.590
157 H GLN 24 HN GLN 24 2.916 -15.939 4.203
158 HA GLN 24 HA GLN 24 2.681 -15.416 7.025
159 1HB GLN 24 HB2 GLN 24 4.957 -15.663 7.107
160 2HB GLN 24 HB3 GLN 24 4.713 -16.476 5.573
161 1HG GLN 24 HG2 GLN 24 5.011 -14.161 4.456
162 2HG GLN 24 HG3 GLN 24 5.558 -13.581 6.017
163 1HE2 GLN 24 HE21 GLN 24 8.448 -15.820 6.105
164 2HE2 GLN 24 HE22 GLN 24 7.152 -15.241 7.098
165 H CYS 25 HN CYS 25 2.577 -13.748 3.943
166 HA CYS 25 HA CYS 25 3.086 -11.166 4.990
167 1HB CYS 25 HB2 CYS 25 1.688 -12.120 2.487
168 2HB CYS 25 HB3 CYS 25 1.908 -10.426 2.879
169 H LYS 26 HN LYS 26 0.137 -13.162 4.260
170 HA LYS 26 HA LYS 26 -1.613 -11.024 4.910
171 1HB LYS 26 HB2 LYS 26 -3.347 -12.494 4.303
172 2HB LYS 26 HB3 LYS 26 -2.012 -12.891 3.239
173 1HG LYS 26 HG2 LYS 26 -1.395 -14.817 4.658
174 2HG LYS 26 HG3 LYS 26 -2.620 -14.384 5.834
175 1HD LYS 26 HD2 LYS 26 -3.529 -16.163 4.455
176 2HD LYS 26 HD3 LYS 26 -4.386 -14.690 4.045
177 1HE LYS 26 HE2 LYS 26 -3.135 -14.404 2.000
178 2HE LYS 26 HE3 LYS 26 -1.936 -15.591 2.475
179 1HZ LYS 26 HZ1 LYS 26 -3.542 -16.531 0.906
180 2HZ LYS 26 HZ2 LYS 26 -3.665 -17.310 2.330
181 H MET 27 HN MET 27 0.218 -13.268 6.767
182 HA MET 27 HA MET 27 -1.543 -13.984 8.728
183 1HB MET 27 HB2 MET 27 0.797 -14.858 8.431
184 2HB MET 27 HB3 MET 27 1.446 -13.311 8.938
185 1HG MET 27 HG2 MET 27 0.737 -13.599 11.190
186 2HG MET 27 HG3 MET 27 -0.473 -14.793 10.763
187 1HE MET 27 HE1 MET 27 4.078 -15.474 10.942
188 2HE MET 27 HE2 MET 27 3.345 -14.427 9.702
189 3HE MET 27 HE3 MET 27 3.214 -13.994 11.424
190 H LYS 28 HN LYS 28 0.181 -10.902 8.211
191 HA LYS 28 HA LYS 28 -1.298 -9.567 10.213
192 1HB LYS 28 HB2 LYS 28 0.533 -9.098 11.783
193 2HB LYS 28 HB3 LYS 28 0.103 -10.797 11.758
194 1HG LYS 28 HG2 LYS 28 2.009 -11.119 10.042
195 2HG LYS 28 HG3 LYS 28 2.509 -9.483 10.424
196 1HD LYS 28 HD2 LYS 28 2.678 -10.138 12.858
197 2HD LYS 28 HD3 LYS 28 2.265 -11.784 12.420
198 1HE LYS 28 HE2 LYS 28 4.676 -11.691 12.559
199 2HE LYS 28 HE3 LYS 28 4.277 -11.804 10.856
200 1HZ LYS 28 HZ1 LYS 28 4.986 -9.310 12.305
201 2HZ LYS 28 HZ2 LYS 28 5.892 -10.057 11.177
202 H LYS 29 HN LYS 29 1.725 -9.738 8.244
203 HA LYS 29 HA LYS 29 2.342 -7.053 8.368
204 1HB LYS 29 HB2 LYS 29 2.959 -9.244 6.394
205 2HB LYS 29 HB3 LYS 29 3.511 -7.606 6.110
206 1HG LYS 29 HG2 LYS 29 3.993 -8.871 8.819
207 2HG LYS 29 HG3 LYS 29 5.023 -9.321 7.474
208 1HD LYS 29 HD2 LYS 29 5.582 -6.917 7.087
209 2HD LYS 29 HD3 LYS 29 4.535 -6.454 8.413
210 1HE LYS 29 HE2 LYS 29 6.901 -6.542 9.152
211 2HE LYS 29 HE3 LYS 29 5.939 -7.727 10.013
212 1HZ LYS 29 HZ1 LYS 29 7.706 -8.287 7.693
213 2HZ LYS 29 HZ2 LYS 29 7.951 -8.769 9.229
214 H ALA 30 HN ALA 30 0.079 -8.817 6.159
215 HA ALA 30 HA ALA 30 -0.513 -6.287 4.845
216 1HB ALA 30 HB1 ALA 30 0.278 -6.959 2.728
217 2HB ALA 30 HB2 ALA 30 1.575 -7.459 3.840
218 3HB ALA 30 HB3 ALA 30 0.421 -8.664 3.220
219 H SER 31 HN SER 31 -2.134 -6.942 2.868
220 HA SER 31 HA SER 31 -4.126 -8.639 4.006
221 1HB SER 31 HB2 SER 31 -5.236 -8.138 1.688
222 2HB SER 31 HB3 SER 31 -5.073 -6.834 2.847
223 HG SER 31 HG SER 31 -3.076 -7.346 0.823
224 H GLY 32 HN GLY 32 -1.540 -8.783 1.565
225 1HA GLY 32 HA1 GLY 32 -1.837 -11.646 1.338
226 2HA GLY 32 HA2 GLY 32 -2.261 -10.770 -0.119
227 H GLY 33 HN GLY 33 -0.244 -12.291 -0.689
228 1HA GLY 33 HA1 GLY 33 1.761 -10.441 -1.411
229 2HA GLY 33 HA2 GLY 33 2.349 -11.450 -0.105
230 H HIS 34 HN HIS 34 3.602 -11.599 -2.594
231 HA HIS 34 HA HIS 34 3.215 -14.430 -2.944
232 1HB HIS 34 HB2 HIS 34 2.219 -12.581 -4.880
233 2HB HIS 34 HB3 HIS 34 3.618 -13.374 -5.575
234 HD1 HIS 34 HD1 HIS 34 0.707 -14.691 -3.428
235 HD2 HIS 34 HD2 HIS 34 2.732 -15.506 -7.010
236 HE1 HIS 34 HE1 HIS 34 -0.385 -16.779 -4.407
237 H CYS 35 HN CYS 35 5.130 -15.420 -4.088
238 HA CYS 35 HA CYS 35 7.439 -14.076 -3.022
239 1HB CYS 35 HB2 CYS 35 7.083 -16.439 -2.547
240 2HB CYS 35 HB3 CYS 35 7.103 -16.816 -4.258
241 H TYR 36 HN TYR 36 7.504 -12.267 -4.621
242 HA TYR 36 HA TYR 36 8.257 -12.697 -7.275
243 1HB TYR 36 HB2 TYR 36 7.755 -10.504 -6.092
244 2HB TYR 36 HB3 TYR 36 9.181 -10.719 -5.097
245 HD1 TYR 36 HD1 TYR 36 11.146 -9.645 -5.724
246 HD2 TYR 36 HD2 TYR 36 8.220 -10.521 -8.721
247 HE1 TYR 36 HE1 TYR 36 12.531 -8.396 -7.452
248 HE2 TYR 36 HE2 TYR 36 9.615 -9.269 -10.438
249 HH TYR 36 HH TYR 36 12.687 -7.741 -9.498
250 H ALA 37 HN ALA 37 10.532 -12.488 -8.189
251 HA ALA 37 HA ALA 37 11.557 -14.946 -7.488
252 1HB ALA 37 HB1 ALA 37 13.366 -14.365 -9.094
253 2HB ALA 37 HB2 ALA 37 11.753 -13.943 -9.716
254 3HB ALA 37 HB3 ALA 37 12.819 -12.671 -9.072
255 H MET 38 HN MET 38 12.475 -11.649 -6.445
256 HA MET 38 HA MET 38 14.971 -12.543 -5.421
257 1HB MET 38 HB2 MET 38 13.383 -9.930 -5.196
258 2HB MET 38 HB3 MET 38 14.979 -10.123 -4.496
259 1HG MET 38 HG2 MET 38 14.409 -10.636 -7.452
260 2HG MET 38 HG3 MET 38 14.898 -9.067 -6.843
261 1HE MET 38 HE1 MET 38 17.007 -9.054 -8.394
262 2HE MET 38 HE2 MET 38 18.178 -10.391 -8.491
263 3HE MET 38 HE3 MET 38 16.505 -10.632 -9.048
264 H SER 39 HN SER 39 11.674 -11.945 -4.112
265 HA SER 39 HA SER 39 12.419 -12.605 -1.484
266 1HB SER 39 HB2 SER 39 12.076 -9.637 -2.107
267 2HB SER 39 HB3 SER 39 12.194 -10.320 -0.497
268 HG SER 39 HG SER 39 14.339 -11.215 -1.235
269 H CYS 40 HN CYS 40 10.537 -12.020 0.081
270 HA CYS 40 HA CYS 40 8.122 -12.700 -1.218
271 1HB CYS 40 HB2 CYS 40 8.554 -13.551 0.972
272 2HB CYS 40 HB3 CYS 40 8.780 -11.942 1.629
273 H TYR 41 HN TYR 41 7.243 -11.130 -2.578
274 HA TYR 41 HA TYR 41 7.140 -8.379 -1.726
275 1HB TYR 41 HB2 TYR 41 7.372 -9.275 -4.125
276 2HB TYR 41 HB3 TYR 41 5.782 -9.996 -3.973
277 HD1 TYR 41 HD1 TYR 41 3.787 -8.691 -4.257
278 HD2 TYR 41 HD2 TYR 41 7.613 -6.778 -4.163
279 HE1 TYR 41 HE1 TYR 41 2.738 -6.533 -5.099
280 HE2 TYR 41 HE2 TYR 41 6.551 -4.627 -5.005
281 HH TYR 41 HH TYR 41 4.749 -3.661 -5.689
282 H CYS 42 HN CYS 42 5.838 -8.022 0.049
283 HA CYS 42 HA CYS 42 3.321 -9.424 0.204
284 1HB CYS 42 HB2 CYS 42 4.644 -7.448 2.073
285 2HB CYS 42 HB3 CYS 42 3.101 -8.220 2.375
286 H GLU 43 HN GLU 43 1.265 -8.058 0.622
287 HA GLU 43 HA GLU 43 1.368 -5.769 -1.154
288 1HB GLU 43 HB2 GLU 43 0.981 -8.123 -2.324
289 2HB GLU 43 HB3 GLU 43 -0.650 -7.950 -1.706
290 1HG GLU 43 HG2 GLU 43 -0.830 -5.714 -2.827
291 2HG GLU 43 HG3 GLU 43 0.794 -5.903 -3.456
292 HE2 GLU 43 HE2 GLU 43 -2.253 -7.291 -3.363
293 H GLY 44 HN GLY 44 0.168 -4.153 -0.256
294 1HA GLY 44 HA1 GLY 44 -1.734 -3.182 0.569
295 2HA GLY 44 HA2 GLY 44 -2.437 -4.760 0.864
296 H LEU 45 HN LEU 45 0.324 -2.686 2.003
297 HA LEU 45 HA LEU 45 -0.069 -3.834 4.667
298 1HB LEU 45 HB2 LEU 45 2.247 -2.394 3.378
299 2HB LEU 45 HB3 LEU 45 2.163 -2.720 5.098
300 HG LEU 45 HG LEU 45 1.737 -5.217 4.194
301 1HD1 LEU 45 HD11 LEU 45 3.249 -5.652 2.277
302 2HD1 LEU 45 HD12 LEU 45 1.822 -4.680 1.845
303 3HD1 LEU 45 HD13 LEU 45 3.408 -3.895 2.040
304 1HD2 LEU 45 HD21 LEU 45 4.406 -3.839 4.578
305 2HD2 LEU 45 HD22 LEU 45 3.419 -4.663 5.810
306 3HD2 LEU 45 HD23 LEU 45 4.182 -5.604 4.505
307 HA PRO 46 HA PRO 46 -0.986 0.305 6.117
308 1HB PRO 46 HB2 PRO 46 -0.194 0.063 8.721
309 2HB PRO 46 HB3 PRO 46 -1.805 -0.347 8.168
310 1HG PRO 46 HG2 PRO 46 0.417 -2.152 8.904
311 2HG PRO 46 HG3 PRO 46 -1.292 -2.515 8.765
312 1HD PRO 46 HD2 PRO 46 0.764 -3.183 6.879
313 2HD PRO 46 HD3 PRO 46 -0.959 -3.442 6.687
314 H GLU 47 HN GLU 47 0.151 2.274 6.850
315 HA GLU 47 HA GLU 47 2.414 2.112 5.156
316 1HB GLU 47 HB2 GLU 47 1.084 4.432 6.616
317 2HB GLU 47 HB3 GLU 47 2.458 4.640 5.548
318 1HG GLU 47 HG2 GLU 47 1.159 3.586 3.680
319 2HG GLU 47 HG3 GLU 47 -0.216 3.395 4.749
320 HE2 GLU 47 HE2 GLU 47 0.524 6.953 3.136
321 H ASN 48 HN ASN 48 1.916 1.771 8.527
322 HA ASN 48 HA ASN 48 4.206 3.094 9.443
323 1HB ASN 48 HB2 ASN 48 3.798 1.821 11.546
324 2HB ASN 48 HB3 ASN 48 2.297 2.480 10.928
325 1HD2 ASN 48 HD21 ASN 48 2.145 -1.219 11.924
326 2HD2 ASN 48 HD22 ASN 48 2.856 0.175 12.666
327 H ALA 49 HN ALA 49 3.508 -0.037 7.954
328 HA ALA 49 HA ALA 49 5.968 -1.247 8.860
329 1HB ALA 49 HB1 ALA 49 3.901 -2.572 8.613
330 2HB ALA 49 HB2 ALA 49 3.839 -2.161 6.882
331 3HB ALA 49 HB3 ALA 49 5.171 -3.160 7.513
332 H LYS 50 HN LYS 50 7.865 -0.588 7.977
333 HA LYS 50 HA LYS 50 7.894 0.802 5.501
334 1HB LYS 50 HB2 LYS 50 9.393 1.316 7.404
335 2HB LYS 50 HB3 LYS 50 10.182 -0.235 7.201
336 1HG LYS 50 HG2 LYS 50 9.973 1.456 4.736
337 2HG LYS 50 HG3 LYS 50 11.037 2.062 5.989
338 1HD LYS 50 HD2 LYS 50 12.277 -0.085 6.022
339 2HD LYS 50 HD3 LYS 50 11.172 -0.768 4.846
340 1HE LYS 50 HE2 LYS 50 11.854 1.087 3.233
341 2HE LYS 50 HE3 LYS 50 13.064 1.588 4.397
342 1HZ LYS 50 HZ1 LYS 50 14.044 -0.652 4.239
343 2HZ LYS 50 HZ2 LYS 50 12.928 -1.103 3.142
344 H VAL 51 HN VAL 51 8.190 0.046 3.456
345 HA VAL 51 HA VAL 51 9.298 -2.663 3.218
346 HB VAL 51 HB VAL 51 7.789 -3.190 1.501
347 1HG1 VAL 51 HG11 VAL 51 5.655 -3.145 2.579
348 2HG1 VAL 51 HG12 VAL 51 6.888 -3.230 3.861
349 3HG1 VAL 51 HG13 VAL 51 6.081 -1.685 3.503
350 1HG2 VAL 51 HG21 VAL 51 7.069 -0.251 1.498
351 2HG2 VAL 51 HG22 VAL 51 7.712 -1.240 0.166
352 3HG2 VAL 51 HG23 VAL 51 6.043 -1.487 0.731
353 H SER 52 HN SER 52 10.675 -3.002 1.336
354 HA SER 52 HA SER 52 11.393 -0.540 -0.016
355 1HB SER 52 HB2 SER 52 13.330 -1.760 0.651
356 2HB SER 52 HB3 SER 52 12.649 -3.296 0.151
357 HG SER 52 HG SER 52 13.679 -1.168 -1.498
358 H ASP 53 HN ASP 53 10.925 -0.205 -2.244
359 HA ASP 53 HA ASP 53 10.028 -2.594 -3.652
360 1HB ASP 53 HB2 ASP 53 8.702 -1.100 -5.144
361 2HB ASP 53 HB3 ASP 53 8.154 -1.020 -3.481
362 HD2 ASP 53 HD2 ASP 53 10.024 2.236 -3.418
363 H SER 54 HN SER 54 12.792 -1.818 -3.325
364 HA SER 54 HA SER 54 13.332 -0.223 -5.708
365 1HB SER 54 HB2 SER 54 15.334 0.656 -4.344
366 2HB SER 54 HB3 SER 54 13.747 1.243 -3.888
367 HG SER 54 HG SER 54 14.992 0.594 -2.027
368 H ALA 55 HN ALA 55 13.284 -2.995 -5.970
369 HA ALA 55 HA ALA 55 14.521 -4.494 -7.028
370 1HB ALA 55 HB1 ALA 55 16.537 -2.224 -7.276
371 2HB ALA 55 HB2 ALA 55 16.442 -3.675 -8.303
372 3HB ALA 55 HB3 ALA 55 15.135 -2.468 -8.345
373 H THR 56 HN THR 56 14.640 -4.505 -4.156
374 HA THR 56 HA THR 56 15.681 -5.772 -2.651
375 HB THR 56 HB THR 56 17.101 -6.951 -5.095
376 HG1 THR 56 HG1 THR 56 14.775 -6.779 -5.381
377 1HG2 THR 56 HG21 THR 56 17.721 -7.819 -2.745
378 2HG2 THR 56 HG22 THR 56 16.019 -8.311 -2.579
379 3HG2 THR 56 HG23 THR 56 17.035 -9.035 -3.848
380 H ASN 57 HN ASN 57 16.663 -3.413 -2.322
381 HA ASN 57 HA ASN 57 19.491 -3.432 -2.678
382 1HB ASN 57 HB2 ASN 57 19.431 -1.258 -1.573
383 2HB ASN 57 HB3 ASN 57 18.052 -1.326 -2.652
384 1HD2 ASN 57 HD21 ASN 57 15.560 -1.275 -0.196
385 2HD2 ASN 57 HD22 ASN 57 15.993 -1.407 -1.868
386 H ILE 58 HN ILE 58 17.068 -4.417 -0.290
387 HA ILE 58 HA ILE 58 19.065 -4.893 1.742
388 HB ILE 58 HB ILE 58 16.154 -5.671 1.540
389 1HG1 ILE 58 HG12 ILE 58 16.611 -3.783 3.593
390 2HG1 ILE 58 HG13 ILE 58 17.466 -3.180 2.188
391 1HG2 ILE 58 HG21 ILE 58 17.223 -7.237 2.985
392 2HG2 ILE 58 HG22 ILE 58 18.146 -5.952 3.801
393 3HG2 ILE 58 HG23 ILE 58 16.381 -6.051 4.011
394 1HD1 ILE 58 HD11 ILE 58 14.539 -4.048 2.249
395 2HD1 ILE 58 HD12 ILE 58 15.136 -2.373 2.180
396 3HD1 ILE 58 HD13 ILE 58 15.405 -3.470 0.804
397 H CYS 59 HN CYS 59 19.357 -7.209 2.593
398 HA CYS 59 HA CYS 59 21.021 -8.243 0.826
399 1HB CYS 59 HB2 CYS 59 19.458 -9.955 2.767
400 2HB CYS 59 HB3 CYS 59 21.026 -10.322 2.076
401 H GLY 60 HN GLY 60 17.693 -9.614 1.420
402 1HA GLY 60 HA1 GLY 60 16.522 -9.933 -0.853
403 2HA GLY 60 HA2 GLY 60 17.881 -10.992 -1.174
Start of MODEL 18
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 -1.038 0.056
3 1HB LYS 1 HB2 LYS 1 3.023 0.260 -1.457
4 2HB LYS 1 HB3 LYS 1 1.417 0.171 -2.150
5 1HG LYS 1 HG2 LYS 1 0.902 2.415 -1.040
6 2HG LYS 1 HG3 LYS 1 2.588 2.508 -0.572
7 1HD LYS 1 HD2 LYS 1 3.093 2.105 -3.121
8 2HD LYS 1 HD3 LYS 1 1.413 2.533 -3.374
9 1HE LYS 1 HE2 LYS 1 3.497 4.274 -1.969
10 2HE LYS 1 HE3 LYS 1 2.893 4.521 -3.596
11 1HZ LYS 1 HZ1 LYS 1 0.618 4.711 -2.542
12 2HZ LYS 1 HZ2 LYS 1 1.339 4.747 -1.081
13 H ASP 2 HN ASP 2 3.916 0.354 0.731
14 HA ASP 2 HA ASP 2 3.071 1.760 3.140
15 1HB ASP 2 HB2 ASP 2 5.579 0.069 3.073
16 2HB ASP 2 HB3 ASP 2 4.626 0.556 4.461
17 HD2 ASP 2 HD2 ASP 2 2.455 -0.245 4.307
18 H GLY 3 HN GLY 3 4.590 3.454 3.840
19 1HA GLY 3 HA1 GLY 3 7.149 3.880 3.023
20 2HA GLY 3 HA2 GLY 3 6.192 4.580 1.733
21 H TYR 4 HN TYR 4 7.264 6.642 2.508
22 HA TYR 4 HA TYR 4 5.673 7.767 4.714
23 1HB TYR 4 HB2 TYR 4 8.331 8.614 3.400
24 2HB TYR 4 HB3 TYR 4 7.613 9.406 4.788
25 HD1 TYR 4 HD1 TYR 4 9.461 6.456 3.621
26 HD2 TYR 4 HD2 TYR 4 7.679 8.365 7.010
27 HE1 TYR 4 HE1 TYR 4 10.729 4.895 5.176
28 HE2 TYR 4 HE2 TYR 4 8.953 6.797 8.554
29 HH TYR 4 HH TYR 4 11.038 4.251 7.216
30 HA PRO 5 HA PRO 5 3.927 9.602 1.120
31 1HB PRO 5 HB2 PRO 5 1.511 10.286 2.198
32 2HB PRO 5 HB3 PRO 5 1.846 8.703 1.525
33 1HG PRO 5 HG2 PRO 5 1.636 9.504 4.363
34 2HG PRO 5 HG3 PRO 5 1.545 7.899 3.666
35 1HD PRO 5 HD2 PRO 5 3.779 9.042 5.054
36 2HD PRO 5 HD3 PRO 5 3.728 7.483 4.256
37 H VAL 6 HN VAL 6 3.559 11.653 0.194
38 HA VAL 6 HA VAL 6 3.446 13.786 2.193
39 HB VAL 6 HB VAL 6 4.836 15.145 0.539
40 1HG1 VAL 6 HG11 VAL 6 5.628 14.397 2.760
41 2HG1 VAL 6 HG12 VAL 6 6.207 12.881 2.029
42 3HG1 VAL 6 HG13 VAL 6 6.935 14.434 1.554
43 1HG2 VAL 6 HG21 VAL 6 5.716 12.386 -0.372
44 2HG2 VAL 6 HG22 VAL 6 4.690 13.489 -1.320
45 3HG2 VAL 6 HG23 VAL 6 6.359 13.955 -0.915
46 H ASP 7 HN ASP 7 1.805 15.232 1.807
47 HA ASP 7 HA ASP 7 1.211 15.946 -0.842
48 1HB ASP 7 HB2 ASP 7 -1.390 15.369 -0.208
49 2HB ASP 7 HB3 ASP 7 -0.382 14.345 -1.211
50 HD2 ASP 7 HD2 ASP 7 -0.631 11.729 0.986
51 H SER 8 HN SER 8 -0.847 15.637 2.152
52 HA SER 8 HA SER 8 -1.271 18.465 2.115
53 1HB SER 8 HB2 SER 8 -2.916 18.051 3.840
54 2HB SER 8 HB3 SER 8 -3.089 16.796 2.630
55 HG SER 8 HG SER 8 -1.935 15.332 3.990
56 H LYS 9 HN LYS 9 0.730 16.071 3.776
57 HA LYS 9 HA LYS 9 1.136 17.751 6.083
58 1HB LYS 9 HB2 LYS 9 2.547 15.879 6.860
59 2HB LYS 9 HB3 LYS 9 0.926 15.374 6.426
60 1HG LYS 9 HG2 LYS 9 2.709 15.254 4.100
61 2HG LYS 9 HG3 LYS 9 3.361 14.319 5.431
62 1HD LYS 9 HD2 LYS 9 0.440 14.049 4.634
63 2HD LYS 9 HD3 LYS 9 1.684 13.159 3.779
64 1HE LYS 9 HE2 LYS 9 2.427 12.093 5.886
65 2HE LYS 9 HE3 LYS 9 1.290 13.057 6.808
66 1HZ LYS 9 HZ1 LYS 9 0.424 10.821 6.297
67 2HZ LYS 9 HZ2 LYS 9 -0.532 11.965 5.641
68 H GLY 10 HN GLY 10 2.519 17.268 2.920
69 1HA GLY 10 HA1 GLY 10 3.991 18.672 1.902
70 2HA GLY 10 HA2 GLY 10 4.308 19.469 3.430
71 H CYS 11 HN CYS 11 5.652 18.208 5.086
72 HA CYS 11 HA CYS 11 7.503 16.409 3.707
73 1HB CYS 11 HB2 CYS 11 8.152 18.795 5.425
74 2HB CYS 11 HB3 CYS 11 9.277 17.462 5.253
75 H LYS 12 HN LYS 12 5.448 15.223 4.969
76 HA LYS 12 HA LYS 12 5.244 13.468 6.297
77 1HB LYS 12 HB2 LYS 12 8.090 13.894 6.223
78 2HB LYS 12 HB3 LYS 12 7.633 13.355 7.826
79 1HG LYS 12 HG2 LYS 12 8.059 11.388 6.448
80 2HG LYS 12 HG3 LYS 12 6.343 11.454 6.799
81 1HD LYS 12 HD2 LYS 12 6.233 11.085 4.510
82 2HD LYS 12 HD3 LYS 12 6.257 12.838 4.505
83 1HE LYS 12 HE2 LYS 12 8.876 11.310 4.433
84 2HE LYS 12 HE3 LYS 12 7.940 11.487 2.962
85 1HZ LYS 12 HZ1 LYS 12 7.921 14.001 3.776
86 2HZ LYS 12 HZ2 LYS 12 9.308 13.558 4.505
87 H LEU 13 HN LEU 13 5.037 12.854 8.700
88 HA LEU 13 HA LEU 13 4.736 15.307 10.281
89 1HB LEU 13 HB2 LEU 13 3.424 12.615 10.675
90 2HB LEU 13 HB3 LEU 13 3.140 14.063 11.622
91 HG LEU 13 HG LEU 13 2.648 14.134 8.661
92 1HD1 LEU 13 HD11 LEU 13 0.273 13.432 9.140
93 2HD1 LEU 13 HD12 LEU 13 1.491 12.137 9.215
94 3HD1 LEU 13 HD13 LEU 13 0.847 12.840 10.718
95 1HD2 LEU 13 HD21 LEU 13 2.540 16.219 9.925
96 2HD2 LEU 13 HD22 LEU 13 0.937 15.765 9.300
97 3HD2 LEU 13 HD23 LEU 13 1.327 15.509 11.018
98 H SER 14 HN SER 14 6.184 15.673 11.872
99 HA SER 14 HA SER 14 8.275 13.901 12.285
100 1HB SER 14 HB2 SER 14 8.851 15.433 14.203
101 2HB SER 14 HB3 SER 14 8.578 16.268 12.687
102 HG SER 14 HG SER 14 7.504 17.283 14.532
103 H CYS 15 HN CYS 15 5.154 14.443 13.963
104 HA CYS 15 HA CYS 15 3.977 13.034 15.182
105 1HB CYS 15 HB2 CYS 15 4.261 10.828 14.974
106 2HB CYS 15 HB3 CYS 15 5.482 11.284 13.803
107 H VAL 16 HN VAL 16 3.811 12.451 17.501
108 HA VAL 16 HA VAL 16 5.903 13.835 19.006
109 HB VAL 16 HB VAL 16 3.058 13.122 19.748
110 1HG1 VAL 16 HG11 VAL 16 4.360 13.299 21.746
111 2HG1 VAL 16 HG12 VAL 16 5.182 14.764 21.158
112 3HG1 VAL 16 HG13 VAL 16 3.452 14.820 21.575
113 1HG2 VAL 16 HG21 VAL 16 3.052 14.741 17.949
114 2HG2 VAL 16 HG22 VAL 16 2.630 15.561 19.471
115 3HG2 VAL 16 HG23 VAL 16 4.264 15.738 18.788
116 H ALA 17 HN ALA 17 4.692 10.697 18.213
117 HA ALA 17 HA ALA 17 6.254 9.413 20.222
118 1HB ALA 17 HB1 ALA 17 4.353 10.121 21.612
119 2HB ALA 17 HB2 ALA 17 3.218 9.370 20.465
120 3HB ALA 17 HB3 ALA 17 4.344 8.354 21.396
121 H ASN 18 HN ASN 18 5.808 6.925 20.087
122 HA ASN 18 HA ASN 18 6.439 6.362 17.482
123 1HB ASN 18 HB2 ASN 18 5.452 4.513 19.716
124 2HB ASN 18 HB3 ASN 18 6.151 3.927 18.219
125 1HD2 ASN 18 HD21 ASN 18 9.488 4.899 18.902
126 2HD2 ASN 18 HD22 ASN 18 8.317 4.635 17.654
127 H ASN 19 HN ASN 19 3.340 6.310 19.277
128 HA ASN 19 HA ASN 19 2.152 4.580 17.316
129 1HB ASN 19 HB2 ASN 19 0.152 4.703 18.872
130 2HB ASN 19 HB3 ASN 19 1.611 4.146 19.668
131 1HD2 ASN 19 HD21 ASN 19 1.980 6.844 21.853
132 2HD2 ASN 19 HD22 ASN 19 2.611 5.370 21.199
133 H TYR 20 HN TYR 20 2.717 7.915 17.732
134 HA TYR 20 HA TYR 20 0.115 8.965 17.599
135 1HB TYR 20 HB2 TYR 20 2.349 9.994 18.425
136 2HB TYR 20 HB3 TYR 20 2.840 10.128 16.748
137 HD1 TYR 20 HD1 TYR 20 0.651 11.483 19.367
138 HD2 TYR 20 HD2 TYR 20 1.824 11.798 15.265
139 HE1 TYR 20 HE1 TYR 20 -0.466 13.762 19.215
140 HE2 TYR 20 HE2 TYR 20 0.703 14.076 15.127
141 HH TYR 20 HH TYR 20 -0.917 15.463 17.973
142 H CYS 21 HN CYS 21 2.430 7.889 15.135
143 HA CYS 21 HA CYS 21 1.323 9.263 12.973
144 1HB CYS 21 HB2 CYS 21 3.463 8.292 12.723
145 2HB CYS 21 HB3 CYS 21 2.897 6.704 13.203
146 H ASP 22 HN ASP 22 0.484 6.209 14.703
147 HA ASP 22 HA ASP 22 -0.597 4.952 12.522
148 1HB ASP 22 HB2 ASP 22 0.055 3.969 14.799
149 2HB ASP 22 HB3 ASP 22 -1.464 4.578 15.425
150 HD2 ASP 22 HD2 ASP 22 -1.504 2.389 15.881
151 H ASN 23 HN ASN 23 -2.138 6.850 15.211
152 HA ASN 23 HA ASN 23 -4.746 6.365 14.407
153 1HB ASN 23 HB2 ASN 23 -5.215 8.486 15.825
154 2HB ASN 23 HB3 ASN 23 -4.402 7.168 16.646
155 1HD2 ASN 23 HD21 ASN 23 -2.570 10.772 15.929
156 2HD2 ASN 23 HD22 ASN 23 -4.134 10.357 15.312
157 H GLN 24 HN GLN 24 -2.225 8.647 13.390
158 HA GLN 24 HA GLN 24 -4.122 10.463 12.242
159 1HB GLN 24 HB2 GLN 24 -1.914 11.115 13.397
160 2HB GLN 24 HB3 GLN 24 -1.091 10.528 11.965
161 1HG GLN 24 HG2 GLN 24 -2.159 12.168 10.551
162 2HG GLN 24 HG3 GLN 24 -3.336 12.578 11.782
163 1HE2 GLN 24 HE21 GLN 24 -1.067 15.369 11.947
164 2HE2 GLN 24 HE22 GLN 24 -2.353 14.711 10.991
165 H CYS 25 HN CYS 25 -2.299 7.639 11.317
166 HA CYS 25 HA CYS 25 -2.369 8.238 8.516
167 1HB CYS 25 HB2 CYS 25 -1.713 5.700 10.024
168 2HB CYS 25 HB3 CYS 25 -1.621 5.866 8.282
169 H LYS 26 HN LYS 26 -4.209 6.292 10.957
170 HA LYS 26 HA LYS 26 -5.440 4.731 8.925
171 1HB LYS 26 HB2 LYS 26 -6.355 3.481 10.683
172 2HB LYS 26 HB3 LYS 26 -4.795 4.006 11.283
173 1HG LYS 26 HG2 LYS 26 -6.091 6.045 12.297
174 2HG LYS 26 HG3 LYS 26 -7.540 5.107 11.992
175 1HD LYS 26 HD2 LYS 26 -5.159 4.175 13.665
176 2HD LYS 26 HD3 LYS 26 -6.677 4.764 14.311
177 1HE LYS 26 HE2 LYS 26 -6.325 2.281 12.564
178 2HE LYS 26 HE3 LYS 26 -6.631 2.283 14.289
179 1HZ LYS 26 HZ1 LYS 26 -8.480 3.052 12.126
180 2HZ LYS 26 HZ2 LYS 26 -8.746 2.039 13.373
181 H MET 27 HN MET 27 -6.033 7.858 10.261
182 HA MET 27 HA MET 27 -8.788 7.698 10.568
183 1HB MET 27 HB2 MET 27 -8.645 10.124 10.831
184 2HB MET 27 HB3 MET 27 -7.172 9.456 11.507
185 1HG MET 27 HG2 MET 27 -6.101 9.843 9.173
186 2HG MET 27 HG3 MET 27 -7.521 10.795 8.791
187 1HE MET 27 HE1 MET 27 -4.747 12.056 8.593
188 2HE MET 27 HE2 MET 27 -6.229 13.024 8.407
189 3HE MET 27 HE3 MET 27 -4.923 13.593 9.474
190 H LYS 28 HN LYS 28 -6.745 8.112 7.728
191 HA LYS 28 HA LYS 28 -8.916 7.474 6.084
192 1HB LYS 28 HB2 LYS 28 -9.016 9.566 4.733
193 2HB LYS 28 HB3 LYS 28 -9.691 9.720 6.342
194 1HG LYS 28 HG2 LYS 28 -8.316 11.495 6.665
195 2HG LYS 28 HG3 LYS 28 -6.971 10.372 6.692
196 1HD LYS 28 HD2 LYS 28 -6.355 11.899 4.992
197 2HD LYS 28 HD3 LYS 28 -7.002 10.543 4.090
198 1HE LYS 28 HE2 LYS 28 -7.997 12.517 3.132
199 2HE LYS 28 HE3 LYS 28 -9.261 11.743 4.065
200 1HZ LYS 28 HZ1 LYS 28 -7.610 14.031 4.997
201 2HZ LYS 28 HZ2 LYS 28 -9.177 14.108 4.560
202 H LYS 29 HN LYS 29 -5.640 8.897 6.480
203 HA LYS 29 HA LYS 29 -4.908 8.892 3.838
204 1HB LYS 29 HB2 LYS 29 -3.238 8.564 6.345
205 2HB LYS 29 HB3 LYS 29 -2.557 8.828 4.752
206 1HG LYS 29 HG2 LYS 29 -4.671 10.693 5.903
207 2HG LYS 29 HG3 LYS 29 -2.968 10.916 6.253
208 1HD LYS 29 HD2 LYS 29 -2.543 10.927 3.727
209 2HD LYS 29 HD3 LYS 29 -4.281 10.937 3.497
210 1HE LYS 29 HE2 LYS 29 -4.334 13.033 5.015
211 2HE LYS 29 HE3 LYS 29 -2.588 13.070 4.870
212 1HZ LYS 29 HZ1 LYS 29 -3.884 14.407 3.166
213 2HZ LYS 29 HZ2 LYS 29 -2.757 13.412 2.541
214 H ALA 30 HN ALA 30 -4.777 6.223 6.258
215 HA ALA 30 HA ALA 30 -4.148 4.362 4.125
216 1HB ALA 30 HB1 ALA 30 -2.005 5.498 5.156
217 2HB ALA 30 HB2 ALA 30 -2.326 4.408 6.526
218 3HB ALA 30 HB3 ALA 30 -2.041 3.737 4.902
219 H SER 31 HN SER 31 -3.585 2.112 5.593
220 HA SER 31 HA SER 31 -6.051 1.718 6.971
221 1HB SER 31 HB2 SER 31 -3.699 -0.180 6.549
222 2HB SER 31 HB3 SER 31 -5.282 -0.642 7.142
223 HG SER 31 HG SER 31 -5.070 -1.050 4.857
224 H GLY 32 HN GLY 32 -2.576 2.119 7.712
225 1HA GLY 32 HA1 GLY 32 -3.123 2.842 10.406
226 2HA GLY 32 HA2 GLY 32 -2.473 1.217 10.325
227 H GLY 33 HN GLY 33 -0.572 2.180 11.529
228 1HA GLY 33 HA1 GLY 33 1.574 1.687 10.080
229 2HA GLY 33 HA2 GLY 33 1.362 3.385 9.699
230 H HIS 34 HN HIS 34 3.518 3.637 10.781
231 HA HIS 34 HA HIS 34 3.171 4.017 13.628
232 1HB HIS 34 HB2 HIS 34 5.436 2.314 12.560
233 2HB HIS 34 HB3 HIS 34 5.125 2.726 14.235
234 HD1 HIS 34 HD1 HIS 34 3.839 0.539 11.429
235 HD2 HIS 34 HD2 HIS 34 3.168 1.174 15.521
236 HE1 HIS 34 HE1 HIS 34 2.363 -1.387 12.219
237 H CYS 35 HN CYS 35 5.071 5.263 14.562
238 HA CYS 35 HA CYS 35 6.061 7.094 12.543
239 1HB CYS 35 HB2 CYS 35 5.038 8.083 14.491
240 2HB CYS 35 HB3 CYS 35 6.097 7.188 15.564
241 H TYR 36 HN TYR 36 7.894 6.315 11.522
242 HA TYR 36 HA TYR 36 9.842 4.890 13.198
243 1HB TYR 36 HB2 TYR 36 8.649 3.868 11.100
244 2HB TYR 36 HB3 TYR 36 9.502 5.063 10.143
245 HD1 TYR 36 HD1 TYR 36 9.773 1.910 11.958
246 HD2 TYR 36 HD2 TYR 36 11.977 4.949 9.907
247 HE1 TYR 36 HE1 TYR 36 11.771 0.348 11.776
248 HE2 TYR 36 HE2 TYR 36 13.968 3.377 9.731
249 HH TYR 36 HH TYR 36 14.761 1.425 10.178
250 H ALA 37 HN ALA 37 11.907 5.672 13.431
251 HA ALA 37 HA ALA 37 13.424 7.308 13.547
252 1HB ALA 37 HB1 ALA 37 14.061 6.021 11.525
253 2HB ALA 37 HB2 ALA 37 13.097 7.133 10.523
254 3HB ALA 37 HB3 ALA 37 14.530 7.733 11.392
255 H MET 38 HN MET 38 10.964 8.389 14.153
256 HA MET 38 HA MET 38 9.942 10.298 14.351
257 1HB MET 38 HB2 MET 38 12.514 10.903 14.652
258 2HB MET 38 HB3 MET 38 12.345 11.705 13.103
259 1HG MET 38 HG2 MET 38 10.391 13.023 14.064
260 2HG MET 38 HG3 MET 38 10.722 12.297 15.625
261 1HE MET 38 HE1 MET 38 13.167 15.482 13.437
262 2HE MET 38 HE2 MET 38 12.690 13.971 12.625
263 3HE MET 38 HE3 MET 38 11.443 15.088 13.232
264 H SER 39 HN SER 39 9.430 8.891 11.886
265 HA SER 39 HA SER 39 8.206 11.170 10.651
266 1HB SER 39 HB2 SER 39 9.780 9.153 8.989
267 2HB SER 39 HB3 SER 39 8.780 10.438 8.342
268 HG SER 39 HG SER 39 10.314 11.807 9.885
269 H CYS 40 HN CYS 40 6.155 10.627 9.696
270 HA CYS 40 HA CYS 40 5.045 8.353 10.960
271 1HB CYS 40 HB2 CYS 40 3.782 10.391 10.828
272 2HB CYS 40 HB3 CYS 40 3.884 10.412 9.079
273 H TYR 41 HN TYR 41 5.878 6.417 10.065
274 HA TYR 41 HA TYR 41 5.748 6.004 7.217
275 1HB TYR 41 HB2 TYR 41 7.459 5.000 8.817
276 2HB TYR 41 HB3 TYR 41 6.164 4.197 9.682
277 HD1 TYR 41 HD1 TYR 41 5.724 1.972 9.179
278 HD2 TYR 41 HD2 TYR 41 7.538 4.444 6.194
279 HE1 TYR 41 HE1 TYR 41 5.956 -0.040 7.643
280 HE2 TYR 41 HE2 TYR 41 7.763 2.422 4.669
281 HH TYR 41 HH TYR 41 6.762 -0.796 5.781
282 H CYS 42 HN CYS 42 3.579 6.194 6.549
283 HA CYS 42 HA CYS 42 1.557 4.878 8.103
284 1HB CYS 42 HB2 CYS 42 1.465 6.509 5.562
285 2HB CYS 42 HB3 CYS 42 0.050 5.756 6.270
286 H GLU 43 HN GLU 43 0.042 3.263 7.039
287 HA GLU 43 HA GLU 43 1.508 1.640 5.133
288 1HB GLU 43 HB2 GLU 43 0.605 0.752 7.903
289 2HB GLU 43 HB3 GLU 43 1.026 -0.381 6.634
290 1HG GLU 43 HG2 GLU 43 3.296 0.689 6.456
291 2HG GLU 43 HG3 GLU 43 2.871 1.780 7.759
292 HE2 GLU 43 HE2 GLU 43 3.401 -2.109 8.678
293 H GLY 44 HN GLY 44 0.173 0.595 3.665
294 1HA GLY 44 HA1 GLY 44 -1.804 -0.294 2.869
295 2HA GLY 44 HA2 GLY 44 -2.670 0.330 4.259
296 H LEU 45 HN LEU 45 -0.412 2.131 2.086
297 HA LEU 45 HA LEU 45 -2.405 4.178 1.789
298 1HB LEU 45 HB2 LEU 45 0.417 3.895 0.753
299 2HB LEU 45 HB3 LEU 45 -0.595 5.302 0.491
300 HG LEU 45 HG LEU 45 -0.132 4.380 3.304
301 1HD1 LEU 45 HD11 LEU 45 1.951 5.604 3.473
302 2HD1 LEU 45 HD12 LEU 45 2.098 4.322 2.248
303 3HD1 LEU 45 HD13 LEU 45 1.885 6.016 1.743
304 1HD2 LEU 45 HD21 LEU 45 -0.340 7.155 2.107
305 2HD2 LEU 45 HD22 LEU 45 -1.712 6.223 2.754
306 3HD2 LEU 45 HD23 LEU 45 -0.381 6.711 3.831
307 HA PRO 46 HA PRO 46 -3.622 3.007 -2.283
308 1HB PRO 46 HB2 PRO 46 -4.482 5.416 -3.242
309 2HB PRO 46 HB3 PRO 46 -5.486 4.358 -2.271
310 1HG PRO 46 HG2 PRO 46 -4.130 6.864 -1.483
311 2HG PRO 46 HG3 PRO 46 -5.451 6.033 -0.685
312 1HD PRO 46 HD2 PRO 46 -2.696 6.041 0.115
313 2HD PRO 46 HD3 PRO 46 -3.997 5.118 0.843
314 H GLU 47 HN GLU 47 -3.121 3.309 -4.612
315 HA GLU 47 HA GLU 47 -0.265 3.555 -4.451
316 1HB GLU 47 HB2 GLU 47 -2.108 2.406 -6.591
317 2HB GLU 47 HB3 GLU 47 -0.360 2.406 -6.713
318 1HG GLU 47 HG2 GLU 47 -0.217 1.104 -4.574
319 2HG GLU 47 HG3 GLU 47 -1.966 1.094 -4.468
320 HE2 GLU 47 HE2 GLU 47 0.639 0.241 -6.394
321 H ASN 48 HN ASN 48 -2.782 5.627 -5.177
322 HA ASN 48 HA ASN 48 -1.831 6.724 -7.586
323 1HB ASN 48 HB2 ASN 48 -3.465 8.549 -7.099
324 2HB ASN 48 HB3 ASN 48 -4.194 6.975 -6.847
325 1HD2 ASN 48 HD21 ASN 48 -4.771 9.481 -4.008
326 2HD2 ASN 48 HD22 ASN 48 -4.828 9.617 -5.734
327 H ALA 49 HN ALA 49 -1.141 7.085 -4.135
328 HA ALA 49 HA ALA 49 0.094 9.680 -4.462
329 1HB ALA 49 HB1 ALA 49 0.456 9.484 -2.026
330 2HB ALA 49 HB2 ALA 49 -1.240 9.152 -2.454
331 3HB ALA 49 HB3 ALA 49 -0.138 7.807 -2.071
332 H LYS 50 HN LYS 50 2.317 10.085 -4.487
333 HA LYS 50 HA LYS 50 4.034 7.741 -4.643
334 1HB LYS 50 HB2 LYS 50 5.638 9.140 -5.633
335 2HB LYS 50 HB3 LYS 50 4.110 9.655 -6.317
336 1HG LYS 50 HG2 LYS 50 4.808 11.749 -5.702
337 2HG LYS 50 HG3 LYS 50 4.205 11.291 -4.122
338 1HD LYS 50 HD2 LYS 50 6.453 10.530 -3.435
339 2HD LYS 50 HD3 LYS 50 7.082 10.832 -5.042
340 1HE LYS 50 HE2 LYS 50 6.802 13.222 -4.817
341 2HE LYS 50 HE3 LYS 50 5.793 13.047 -3.395
342 1HZ LYS 50 HZ1 LYS 50 7.716 12.204 -2.179
343 2HZ LYS 50 HZ2 LYS 50 8.661 12.277 -3.504
344 H VAL 51 HN VAL 51 5.930 7.516 -3.274
345 HA VAL 51 HA VAL 51 5.686 8.963 -0.746
346 HB VAL 51 HB VAL 51 5.662 6.937 0.522
347 1HG1 VAL 51 HG11 VAL 51 3.489 7.836 -0.278
348 2HG1 VAL 51 HG12 VAL 51 3.565 6.721 -1.664
349 3HG1 VAL 51 HG13 VAL 51 3.454 6.077 -0.008
350 1HG2 VAL 51 HG21 VAL 51 7.028 5.493 -0.845
351 2HG2 VAL 51 HG22 VAL 51 5.452 4.706 -0.587
352 3HG2 VAL 51 HG23 VAL 51 5.810 5.492 -2.144
353 H SER 52 HN SER 52 7.695 8.979 0.504
354 HA SER 52 HA SER 52 10.002 8.018 -0.890
355 1HB SER 52 HB2 SER 52 10.557 9.905 0.355
356 2HB SER 52 HB3 SER 52 9.458 9.508 1.661
357 HG SER 52 HG SER 52 11.446 9.078 2.529
358 H ASP 53 HN ASP 53 11.539 6.441 0.244
359 HA ASP 53 HA ASP 53 10.142 4.595 1.961
360 1HB ASP 53 HB2 ASP 53 10.770 2.659 0.511
361 2HB ASP 53 HB3 ASP 53 9.630 3.734 -0.273
362 HD2 ASP 53 HD2 ASP 53 12.320 2.854 -2.608
363 H SER 54 HN SER 54 12.330 6.456 2.411
364 HA SER 54 HA SER 54 14.297 4.629 3.303
365 1HB SER 54 HB2 SER 54 16.193 5.895 2.090
366 2HB SER 54 HB3 SER 54 15.268 4.746 1.145
367 HG SER 54 HG SER 54 15.559 6.776 0.021
368 H ALA 55 HN ALA 55 12.993 5.915 5.088
369 HA ALA 55 HA ALA 55 13.161 7.308 6.800
370 1HB ALA 55 HB1 ALA 55 15.405 6.245 6.895
371 2HB ALA 55 HB2 ALA 55 16.054 7.556 5.880
372 3HB ALA 55 HB3 ALA 55 15.430 7.916 7.508
373 H THR 56 HN THR 56 11.926 8.496 4.645
374 HA THR 56 HA THR 56 11.042 10.540 4.458
375 HB THR 56 HB THR 56 13.316 11.616 6.191
376 HG1 THR 56 HG1 THR 56 11.685 10.977 7.905
377 1HG2 THR 56 HG21 THR 56 10.338 12.301 6.153
378 2HG2 THR 56 HG22 THR 56 11.649 13.200 6.954
379 3HG2 THR 56 HG23 THR 56 11.531 13.192 5.178
380 H ASN 57 HN ASN 57 14.602 11.225 4.614
381 HA ASN 57 HA ASN 57 15.818 12.448 3.260
382 1HB ASN 57 HB2 ASN 57 16.037 11.480 0.949
383 2HB ASN 57 HB3 ASN 57 15.994 10.232 2.179
384 1HD2 ASN 57 HD21 ASN 57 13.017 8.726 1.172
385 2HD2 ASN 57 HD22 ASN 57 14.293 8.846 2.337
386 H ILE 58 HN ILE 58 13.280 13.720 3.772
387 HA ILE 58 HA ILE 58 13.016 15.237 1.300
388 HB ILE 58 HB ILE 58 10.879 13.646 2.623
389 1HG1 ILE 58 HG12 ILE 58 11.310 14.491 -0.257
390 2HG1 ILE 58 HG13 ILE 58 11.942 13.016 0.447
391 1HG2 ILE 58 HG21 ILE 58 10.080 15.891 3.029
392 2HG2 ILE 58 HG22 ILE 58 10.393 16.346 1.337
393 3HG2 ILE 58 HG23 ILE 58 9.135 15.146 1.718
394 1HD1 ILE 58 HD11 ILE 58 9.040 13.792 0.006
395 2HD1 ILE 58 HD12 ILE 58 9.901 12.342 -0.564
396 3HD1 ILE 58 HD13 ILE 58 9.486 12.511 1.159
397 H CYS 59 HN CYS 59 12.372 17.467 1.668
398 HA CYS 59 HA CYS 59 13.087 19.292 2.659
399 1HB CYS 59 HB2 CYS 59 11.500 17.978 4.825
400 2HB CYS 59 HB3 CYS 59 12.431 19.409 5.222
401 H GLY 60 HN GLY 60 13.444 17.163 5.571
402 1HA GLY 60 HA1 GLY 60 15.230 16.706 6.857
403 2HA GLY 60 HA2 GLY 60 16.228 16.804 5.420
Start of MODEL 19
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 -1.009 0.250
3 1HB LYS 1 HB2 LYS 1 1.530 -0.352 -2.127
4 2HB LYS 1 HB3 LYS 1 1.710 1.332 -1.677
5 1HG LYS 1 HG2 LYS 1 3.900 0.670 -2.333
6 2HG LYS 1 HG3 LYS 1 3.957 0.654 -0.582
7 1HD LYS 1 HD2 LYS 1 3.701 -1.767 -0.509
8 2HD LYS 1 HD3 LYS 1 3.321 -1.840 -2.219
9 1HE LYS 1 HE2 LYS 1 5.625 -0.988 -2.754
10 2HE LYS 1 HE3 LYS 1 6.001 -0.954 -1.042
11 1HZ LYS 1 HZ1 LYS 1 5.677 -3.347 -0.950
12 2HZ LYS 1 HZ2 LYS 1 5.200 -3.413 -2.506
13 H ASP 2 HN ASP 2 3.354 -0.421 1.711
14 HA ASP 2 HA ASP 2 3.376 2.348 2.538
15 1HB ASP 2 HB2 ASP 2 3.356 0.032 4.526
16 2HB ASP 2 HB3 ASP 2 3.419 1.737 4.925
17 HD2 ASP 2 HD2 ASP 2 -0.060 0.055 4.696
18 H GLY 3 HN GLY 3 5.511 2.983 3.347
19 1HA GLY 3 HA1 GLY 3 7.633 1.608 4.150
20 2HA GLY 3 HA2 GLY 3 7.625 1.188 2.449
21 H TYR 4 HN TYR 4 9.410 2.356 1.680
22 HA TYR 4 HA TYR 4 9.591 5.143 2.611
23 1HB TYR 4 HB2 TYR 4 11.797 3.143 1.831
24 2HB TYR 4 HB3 TYR 4 12.043 4.682 2.631
25 HD1 TYR 4 HD1 TYR 4 11.091 1.177 3.069
26 HD2 TYR 4 HD2 TYR 4 11.487 4.962 5.025
27 HE1 TYR 4 HE1 TYR 4 10.975 0.027 5.334
28 HE2 TYR 4 HE2 TYR 4 11.369 3.799 7.283
29 HH TYR 4 HH TYR 4 10.954 0.272 7.474
30 HA PRO 5 HA PRO 5 9.634 5.827 -1.752
31 1HB PRO 5 HB2 PRO 5 9.040 8.492 -1.633
32 2HB PRO 5 HB3 PRO 5 7.817 7.240 -1.716
33 1HG PRO 5 HG2 PRO 5 8.650 8.866 0.608
34 2HG PRO 5 HG3 PRO 5 7.180 7.937 0.388
35 1HD PRO 5 HD2 PRO 5 9.455 7.203 1.974
36 2HD PRO 5 HD3 PRO 5 8.035 6.224 1.661
37 H VAL 6 HN VAL 6 11.167 6.500 -3.228
38 HA VAL 6 HA VAL 6 12.929 8.593 -2.329
39 HB VAL 6 HB VAL 6 14.023 6.661 -1.382
40 1HG1 VAL 6 HG11 VAL 6 14.802 4.784 -2.750
41 2HG1 VAL 6 HG12 VAL 6 13.029 4.926 -2.819
42 3HG1 VAL 6 HG13 VAL 6 14.021 5.490 -4.186
43 1HG2 VAL 6 HG21 VAL 6 16.210 6.881 -2.421
44 2HG2 VAL 6 HG22 VAL 6 15.474 7.544 -3.900
45 3HG2 VAL 6 HG23 VAL 6 15.402 8.467 -2.380
46 H ASP 7 HN ASP 7 13.458 9.891 -4.044
47 HA ASP 7 HA ASP 7 13.963 8.819 -6.566
48 1HB ASP 7 HB2 ASP 7 11.970 10.420 -7.522
49 2HB ASP 7 HB3 ASP 7 11.793 8.691 -7.294
50 HD2 ASP 7 HD2 ASP 7 9.992 11.112 -4.639
51 H SER 8 HN SER 8 12.260 11.823 -5.371
52 HA SER 8 HA SER 8 14.122 13.408 -6.836
53 1HB SER 8 HB2 SER 8 12.654 15.265 -5.565
54 2HB SER 8 HB3 SER 8 12.055 14.416 -6.976
55 HG SER 8 HG SER 8 10.645 13.280 -5.767
56 H LYS 9 HN LYS 9 13.418 12.527 -3.439
57 HA LYS 9 HA LYS 9 15.142 14.556 -2.380
58 1HB LYS 9 HB2 LYS 9 14.578 13.581 -0.223
59 2HB LYS 9 HB3 LYS 9 13.134 13.839 -1.181
60 1HG LYS 9 HG2 LYS 9 13.955 11.238 -1.894
61 2HG LYS 9 HG3 LYS 9 14.278 11.319 -0.174
62 1HD LYS 9 HD2 LYS 9 12.041 10.651 -0.146
63 2HD LYS 9 HD3 LYS 9 11.849 12.390 -0.045
64 1HE LYS 9 HE2 LYS 9 11.815 10.847 -2.681
65 2HE LYS 9 HE3 LYS 9 10.367 11.248 -1.779
66 1HZ LYS 9 HZ1 LYS 9 11.077 12.884 -3.572
67 2HZ LYS 9 HZ2 LYS 9 10.746 13.548 -2.122
68 H GLY 10 HN GLY 10 15.505 11.344 -3.708
69 1HA GLY 10 HA1 GLY 10 17.556 10.805 -4.623
70 2HA GLY 10 HA2 GLY 10 18.367 11.860 -3.483
71 H CYS 11 HN CYS 11 17.932 11.126 -1.014
72 HA CYS 11 HA CYS 11 17.902 8.225 -0.857
73 1HB CYS 11 HB2 CYS 11 20.181 9.962 0.092
74 2HB CYS 11 HB3 CYS 11 19.889 8.352 0.721
75 H LYS 12 HN LYS 12 15.698 9.438 -0.153
76 HA LYS 12 HA LYS 12 14.283 9.809 1.499
77 1HB LYS 12 HB2 LYS 12 16.344 8.096 2.704
78 2HB LYS 12 HB3 LYS 12 15.455 9.042 3.880
79 1HG LYS 12 HG2 LYS 12 13.302 8.221 2.961
80 2HG LYS 12 HG3 LYS 12 14.149 7.338 1.707
81 1HD LYS 12 HD2 LYS 12 14.812 6.822 4.622
82 2HD LYS 12 HD3 LYS 12 13.392 6.083 3.909
83 1HE LYS 12 HE2 LYS 12 14.764 5.002 2.168
84 2HE LYS 12 HE3 LYS 12 16.198 5.840 2.726
85 1HZ LYS 12 HZ1 LYS 12 15.869 4.678 4.906
86 2HZ LYS 12 HZ2 LYS 12 14.666 3.802 4.245
87 H LEU 13 HN LEU 13 14.267 10.883 3.974
88 HA LEU 13 HA LEU 13 15.446 13.482 3.343
89 1HB LEU 13 HB2 LEU 13 13.136 12.736 5.143
90 2HB LEU 13 HB3 LEU 13 13.714 14.364 4.851
91 HG LEU 13 HG LEU 13 13.256 13.642 2.304
92 1HD1 LEU 13 HD11 LEU 13 11.114 12.363 2.219
93 2HD1 LEU 13 HD12 LEU 13 12.522 11.402 2.733
94 3HD1 LEU 13 HD13 LEU 13 11.339 11.963 3.939
95 1HD2 LEU 13 HD21 LEU 13 11.104 14.802 2.469
96 2HD2 LEU 13 HD22 LEU 13 11.144 14.631 4.241
97 3HD2 LEU 13 HD23 LEU 13 12.368 15.625 3.415
98 H SER 14 HN SER 14 16.390 10.814 4.967
99 HA SER 14 HA SER 14 17.163 10.271 6.943
100 1HB SER 14 HB2 SER 14 19.048 11.748 7.749
101 2HB SER 14 HB3 SER 14 19.146 11.321 6.053
102 HG SER 14 HG SER 14 17.872 13.765 6.902
103 H CYS 15 HN CYS 15 14.770 10.742 7.693
104 HA CYS 15 HA CYS 15 14.296 13.194 9.009
105 1HB CYS 15 HB2 CYS 15 12.189 12.187 9.699
106 2HB CYS 15 HB3 CYS 15 12.487 11.974 7.985
107 H VAL 16 HN VAL 16 14.186 13.589 11.311
108 HA VAL 16 HA VAL 16 15.048 11.345 12.993
109 HB VAL 16 HB VAL 16 16.238 12.990 14.403
110 1HG1 VAL 16 HG11 VAL 16 17.219 12.897 11.529
111 2HG1 VAL 16 HG12 VAL 16 18.210 13.196 12.977
112 3HG1 VAL 16 HG13 VAL 16 17.436 11.610 12.740
113 1HG2 VAL 16 HG21 VAL 16 15.826 14.913 12.089
114 2HG2 VAL 16 HG22 VAL 16 14.981 15.001 13.654
115 3HG2 VAL 16 HG23 VAL 16 16.747 15.215 13.582
116 H ALA 17 HN ALA 17 12.396 12.670 12.071
117 HA ALA 17 HA ALA 17 11.159 12.645 14.635
118 1HB ALA 17 HB1 ALA 17 11.400 15.286 13.139
119 2HB ALA 17 HB2 ALA 17 10.323 14.991 14.525
120 3HB ALA 17 HB3 ALA 17 12.089 14.905 14.735
121 H ASN 18 HN ASN 18 8.822 12.569 14.432
122 HA ASN 18 HA ASN 18 8.226 11.086 12.160
123 1HB ASN 18 HB2 ASN 18 6.544 12.223 14.438
124 2HB ASN 18 HB3 ASN 18 5.797 11.303 13.146
125 1HD2 ASN 18 HD21 ASN 18 6.972 9.254 16.188
126 2HD2 ASN 18 HD22 ASN 18 6.191 10.794 16.050
127 H ASN 19 HN ASN 19 7.405 14.421 13.294
128 HA ASN 19 HA ASN 19 5.434 14.920 11.431
129 1HB ASN 19 HB2 ASN 19 5.939 17.363 11.957
130 2HB ASN 19 HB3 ASN 19 5.693 16.367 13.378
131 1HD2 ASN 19 HD21 ASN 19 9.189 18.307 12.686
132 2HD2 ASN 19 HD22 ASN 19 7.808 18.388 11.644
133 H TYR 20 HN TYR 20 8.983 14.977 11.303
134 HA TYR 20 HA TYR 20 9.208 16.807 9.142
135 1HB TYR 20 HB2 TYR 20 10.885 16.046 11.021
136 2HB TYR 20 HB3 TYR 20 11.099 14.574 10.095
137 HD1 TYR 20 HD1 TYR 20 12.457 14.530 8.107
138 HD2 TYR 20 HD2 TYR 20 11.648 18.236 10.087
139 HE1 TYR 20 HE1 TYR 20 14.258 15.672 6.723
140 HE2 TYR 20 HE2 TYR 20 13.452 19.365 8.696
141 HH TYR 20 HH TYR 20 15.365 17.489 6.361
142 H CYS 21 HN CYS 21 8.702 13.304 9.442
143 HA CYS 21 HA CYS 21 9.176 12.912 6.630
144 1HB CYS 21 HB2 CYS 21 9.758 11.076 7.985
145 2HB CYS 21 HB3 CYS 21 8.251 11.134 8.876
146 H ASP 22 HN ASP 22 6.430 13.269 8.976
147 HA ASP 22 HA ASP 22 4.641 11.883 7.445
148 1HB ASP 22 HB2 ASP 22 4.455 12.607 9.897
149 2HB ASP 22 HB3 ASP 22 3.973 14.193 9.327
150 HD2 ASP 22 HD2 ASP 22 0.814 12.784 9.866
151 H ASN 23 HN ASN 23 5.627 15.327 7.456
152 HA ASN 23 HA ASN 23 3.370 16.330 6.191
153 1HB ASN 23 HB2 ASN 23 4.699 18.362 5.880
154 2HB ASN 23 HB3 ASN 23 5.128 17.678 7.435
155 1HD2 ASN 23 HD21 ASN 23 8.418 16.754 6.626
156 2HD2 ASN 23 HD22 ASN 23 7.130 16.803 7.783
157 H GLN 24 HN GLN 24 6.464 14.901 5.062
158 HA GLN 24 HA GLN 24 6.225 15.940 2.447
159 1HB GLN 24 HB2 GLN 24 8.333 15.048 2.101
160 2HB GLN 24 HB3 GLN 24 8.337 15.121 3.852
161 1HG GLN 24 HG2 GLN 24 9.017 12.912 3.526
162 2HG GLN 24 HG3 GLN 24 7.287 12.685 3.683
163 1HE2 GLN 24 HE21 GLN 24 9.000 12.637 -0.105
164 2HE2 GLN 24 HE22 GLN 24 9.627 13.635 1.164
165 H CYS 25 HN CYS 25 5.079 13.069 4.146
166 HA CYS 25 HA CYS 25 4.454 11.574 1.839
167 1HB CYS 25 HB2 CYS 25 3.046 11.489 4.511
168 2HB CYS 25 HB3 CYS 25 3.076 10.239 3.283
169 H LYS 26 HN LYS 26 2.603 13.846 3.999
170 HA LYS 26 HA LYS 26 0.165 13.458 2.704
171 1HB LYS 26 HB2 LYS 26 1.229 15.640 4.505
172 2HB LYS 26 HB3 LYS 26 -0.409 15.659 3.886
173 1HG LYS 26 HG2 LYS 26 -0.911 13.507 4.934
174 2HG LYS 26 HG3 LYS 26 0.768 13.270 5.375
175 1HD LYS 26 HD2 LYS 26 0.684 15.213 6.904
176 2HD LYS 26 HD3 LYS 26 -0.956 15.574 6.402
177 1HE LYS 26 HE2 LYS 26 -1.782 13.467 7.348
178 2HE LYS 26 HE3 LYS 26 -0.150 12.921 7.681
179 1HZ LYS 26 HZ1 LYS 26 0.075 14.851 9.211
180 2HZ LYS 26 HZ2 LYS 26 -1.483 15.249 8.956
181 H MET 27 HN MET 27 2.900 15.689 2.093
182 HA MET 27 HA MET 27 1.467 17.582 0.707
183 1HB MET 27 HB2 MET 27 4.365 16.679 0.804
184 2HB MET 27 HB3 MET 27 3.912 17.871 -0.399
185 1HG MET 27 HG2 MET 27 3.264 19.474 1.245
186 2HG MET 27 HG3 MET 27 3.095 18.264 2.500
187 1HE MET 27 HE1 MET 27 5.429 20.238 0.211
188 2HE MET 27 HE2 MET 27 7.067 19.827 0.773
189 3HE MET 27 HE3 MET 27 6.108 18.627 -0.126
190 H LYS 28 HN LYS 28 2.745 14.427 -0.306
191 HA LYS 28 HA LYS 28 1.507 14.724 -2.885
192 1HB LYS 28 HB2 LYS 28 3.906 13.942 -3.832
193 2HB LYS 28 HB3 LYS 28 3.358 15.606 -3.823
194 1HG LYS 28 HG2 LYS 28 4.546 16.065 -1.736
195 2HG LYS 28 HG3 LYS 28 4.929 14.369 -1.518
196 1HD LYS 28 HD2 LYS 28 6.293 14.415 -3.624
197 2HD LYS 28 HD3 LYS 28 5.923 16.116 -3.821
198 1HE LYS 28 HE2 LYS 28 8.070 16.071 -2.764
199 2HE LYS 28 HE3 LYS 28 6.948 16.492 -1.486
200 1HZ LYS 28 HZ1 LYS 28 8.557 14.673 -0.914
201 2HZ LYS 28 HZ2 LYS 28 7.002 14.249 -0.683
202 H LYS 29 HN LYS 29 3.798 12.699 -0.827
203 HA LYS 29 HA LYS 29 3.777 10.849 -2.954
204 1HB LYS 29 HB2 LYS 29 5.004 10.832 -0.189
205 2HB LYS 29 HB3 LYS 29 5.205 9.508 -1.318
206 1HG LYS 29 HG2 LYS 29 5.776 12.330 -2.252
207 2HG LYS 29 HG3 LYS 29 6.961 11.509 -1.256
208 1HD LYS 29 HD2 LYS 29 7.418 9.881 -2.880
209 2HD LYS 29 HD3 LYS 29 5.827 9.998 -3.604
210 1HE LYS 29 HE2 LYS 29 7.483 10.989 -5.123
211 2HE LYS 29 HE3 LYS 29 6.414 12.247 -4.536
212 1HZ LYS 29 HZ1 LYS 29 8.706 12.971 -4.362
213 2HZ LYS 29 HZ2 LYS 29 8.130 12.790 -2.850
214 H ALA 30 HN ALA 30 2.064 11.073 0.187
215 HA ALA 30 HA ALA 30 0.607 8.657 -0.374
216 1HB ALA 30 HB1 ALA 30 2.099 8.497 2.192
217 2HB ALA 30 HB2 ALA 30 1.681 7.217 1.029
218 3HB ALA 30 HB3 ALA 30 3.077 8.277 0.721
219 H SER 31 HN SER 31 -0.446 8.113 2.103
220 HA SER 31 HA SER 31 -2.095 10.427 2.304
221 1HB SER 31 HB2 SER 31 -2.220 7.719 3.704
222 2HB SER 31 HB3 SER 31 -3.454 8.956 3.839
223 HG SER 31 HG SER 31 -2.604 7.727 1.355
224 H GLY 32 HN GLY 32 0.539 8.900 4.085
225 1HA GLY 32 HA1 GLY 32 0.994 11.052 5.788
226 2HA GLY 32 HA2 GLY 32 -0.023 9.924 6.662
227 H GLY 33 HN GLY 33 2.110 9.914 8.032
228 1HA GLY 33 HA1 GLY 33 2.700 7.358 8.320
229 2HA GLY 33 HA2 GLY 33 3.874 7.785 7.092
230 H HIS 34 HN HIS 34 5.651 7.388 8.601
231 HA HIS 34 HA HIS 34 5.922 9.371 10.689
232 1HB HIS 34 HB2 HIS 34 5.832 6.414 11.346
233 2HB HIS 34 HB3 HIS 34 6.143 7.724 12.468
234 HD1 HIS 34 HD1 HIS 34 4.047 9.473 12.795
235 HD2 HIS 34 HD2 HIS 34 3.177 5.750 11.069
236 HE1 HIS 34 HE1 HIS 34 1.524 9.158 13.009
237 H CYS 35 HN CYS 35 8.102 8.772 11.971
238 HA CYS 35 HA CYS 35 10.017 8.282 9.825
239 1HB CYS 35 HB2 CYS 35 10.142 10.463 10.921
240 2HB CYS 35 HB3 CYS 35 10.355 9.692 12.480
241 H TYR 36 HN TYR 36 10.542 6.102 9.799
242 HA TYR 36 HA TYR 36 10.693 4.735 12.388
243 1HB TYR 36 HB2 TYR 36 9.152 3.947 10.501
244 2HB TYR 36 HB3 TYR 36 10.548 3.801 9.452
245 HD1 TYR 36 HD1 TYR 36 8.681 2.287 12.213
246 HD2 TYR 36 HD2 TYR 36 12.193 1.988 9.787
247 HE1 TYR 36 HE1 TYR 36 9.021 -0.111 12.988
248 HE2 TYR 36 HE2 TYR 36 12.521 -0.409 10.570
249 HH TYR 36 HH TYR 36 10.225 -1.891 12.847
250 H ALA 37 HN ALA 37 12.655 4.229 13.221
251 HA ALA 37 HA ALA 37 14.879 4.045 13.344
252 1HB ALA 37 HB1 ALA 37 14.089 1.807 12.600
253 2HB ALA 37 HB2 ALA 37 14.366 2.288 10.909
254 3HB ALA 37 HB3 ALA 37 15.739 2.159 12.034
255 H MET 38 HN MET 38 14.402 6.493 12.287
256 HA MET 38 HA MET 38 15.371 8.109 11.203
257 1HB MET 38 HB2 MET 38 17.418 6.421 12.058
258 2HB MET 38 HB3 MET 38 17.778 6.545 10.347
259 1HG MET 38 HG2 MET 38 17.269 8.996 12.095
260 2HG MET 38 HG3 MET 38 18.869 8.319 11.867
261 1HE MET 38 HE1 MET 38 19.838 9.078 8.311
262 2HE MET 38 HE2 MET 38 20.368 8.834 9.993
263 3HE MET 38 HE3 MET 38 19.487 7.543 9.141
264 H SER 39 HN SER 39 13.550 6.605 9.654
265 HA SER 39 HA SER 39 14.483 7.478 7.115
266 1HB SER 39 HB2 SER 39 14.155 4.551 7.738
267 2HB SER 39 HB3 SER 39 13.623 5.113 6.166
268 HG SER 39 HG SER 39 16.252 5.669 7.242
269 H CYS 40 HN CYS 40 12.682 7.908 5.666
270 HA CYS 40 HA CYS 40 10.435 8.552 7.307
271 1HB CYS 40 HB2 CYS 40 11.289 10.250 5.865
272 2HB CYS 40 HB3 CYS 40 11.176 9.214 4.456
273 H TYR 41 HN TYR 41 9.032 6.839 7.692
274 HA TYR 41 HA TYR 41 8.452 5.010 5.504
275 1HB TYR 41 HB2 TYR 41 8.964 4.279 7.889
276 2HB TYR 41 HB3 TYR 41 7.615 5.240 8.463
277 HD1 TYR 41 HD1 TYR 41 5.419 4.351 8.517
278 HD2 TYR 41 HD2 TYR 41 8.481 2.294 6.351
279 HE1 TYR 41 HE1 TYR 41 3.877 2.351 8.223
280 HE2 TYR 41 HE2 TYR 41 6.930 0.301 6.064
281 HH TYR 41 HH TYR 41 3.678 0.327 7.498
282 H CYS 42 HN CYS 42 7.052 5.981 4.048
283 HA CYS 42 HA CYS 42 4.848 7.518 5.105
284 1HB CYS 42 HB2 CYS 42 5.895 6.993 2.329
285 2HB CYS 42 HB3 CYS 42 4.336 7.748 2.594
286 H GLU 43 HN GLU 43 2.582 7.003 4.150
287 HA GLU 43 HA GLU 43 2.277 4.118 3.973
288 1HB GLU 43 HB2 GLU 43 0.900 5.964 5.966
289 2HB GLU 43 HB3 GLU 43 0.311 4.354 5.603
290 1HG GLU 43 HG2 GLU 43 2.587 3.432 6.238
291 2HG GLU 43 HG3 GLU 43 3.071 5.048 6.713
292 HE2 GLU 43 HE2 GLU 43 0.656 2.949 9.094
293 H GLY 44 HN GLY 44 0.635 3.452 2.578
294 1HA GLY 44 HA1 GLY 44 -1.171 3.640 1.200
295 2HA GLY 44 HA2 GLY 44 -1.421 5.292 1.727
296 H LEU 45 HN LEU 45 1.312 3.500 0.112
297 HA LEU 45 HA LEU 45 1.794 5.875 -1.477
298 1HB LEU 45 HB2 LEU 45 3.318 3.317 -1.015
299 2HB LEU 45 HB3 LEU 45 3.802 4.504 -2.209
300 HG LEU 45 HG LEU 45 3.368 5.413 0.613
301 1HD1 LEU 45 HD11 LEU 45 4.682 3.383 0.894
302 2HD1 LEU 45 HD12 LEU 45 5.847 3.945 -0.329
303 3HD1 LEU 45 HD13 LEU 45 5.676 4.825 1.209
304 1HD2 LEU 45 HD21 LEU 45 5.089 7.020 0.065
305 2HD2 LEU 45 HD22 LEU 45 5.395 6.215 -1.492
306 3HD2 LEU 45 HD23 LEU 45 3.838 7.027 -1.202
307 HA PRO 46 HA PRO 46 0.493 3.824 -5.220
308 1HB PRO 46 HB2 PRO 46 1.959 5.242 -7.039
309 2HB PRO 46 HB3 PRO 46 0.378 5.748 -6.478
310 1HG PRO 46 HG2 PRO 46 3.034 6.829 -5.759
311 2HG PRO 46 HG3 PRO 46 1.457 7.567 -5.558
312 1HD PRO 46 HD2 PRO 46 3.052 6.344 -3.512
313 2HD PRO 46 HD3 PRO 46 1.428 6.977 -3.336
314 H GLU 47 HN GLU 47 1.144 2.099 -6.481
315 HA GLU 47 HA GLU 47 3.604 1.051 -5.486
316 1HB GLU 47 HB2 GLU 47 1.482 -0.055 -7.370
317 2HB GLU 47 HB3 GLU 47 2.921 -0.953 -6.931
318 1HG GLU 47 HG2 GLU 47 2.302 -0.772 -4.515
319 2HG GLU 47 HG3 GLU 47 0.869 0.140 -4.947
320 HE2 GLU 47 HE2 GLU 47 0.317 -1.771 -3.689
321 H ASN 48 HN ASN 48 2.520 2.873 -8.244
322 HA ASN 48 HA ASN 48 4.360 1.786 -10.084
323 1HB ASN 48 HB2 ASN 48 3.699 3.806 -11.471
324 2HB ASN 48 HB3 ASN 48 2.325 2.879 -10.903
325 1HD2 ASN 48 HD21 ASN 48 0.840 5.447 -9.132
326 2HD2 ASN 48 HD22 ASN 48 0.810 3.815 -9.712
327 H ALA 49 HN ALA 49 4.449 4.117 -7.474
328 HA ALA 49 HA ALA 49 6.804 5.471 -8.441
329 1HB ALA 49 HB1 ALA 49 5.385 5.475 -5.745
330 2HB ALA 49 HB2 ALA 49 6.699 6.575 -6.225
331 3HB ALA 49 HB3 ALA 49 5.131 6.641 -7.065
332 H LYS 50 HN LYS 50 8.928 5.250 -7.533
333 HA LYS 50 HA LYS 50 9.505 2.544 -6.802
334 1HB LYS 50 HB2 LYS 50 10.857 4.085 -8.350
335 2HB LYS 50 HB3 LYS 50 11.447 4.857 -6.892
336 1HG LYS 50 HG2 LYS 50 11.561 1.843 -7.056
337 2HG LYS 50 HG3 LYS 50 12.729 2.767 -7.979
338 1HD LYS 50 HD2 LYS 50 13.497 3.927 -5.943
339 2HD LYS 50 HD3 LYS 50 12.242 3.162 -4.990
340 1HE LYS 50 HE2 LYS 50 13.253 0.899 -5.627
341 2HE LYS 50 HE3 LYS 50 14.583 1.768 -6.367
342 1HZ LYS 50 HZ1 LYS 50 15.034 2.799 -4.193
343 2HZ LYS 50 HZ2 LYS 50 13.804 1.980 -3.507
344 H VAL 51 HN VAL 51 9.005 1.870 -4.773
345 HA VAL 51 HA VAL 51 10.138 3.492 -2.612
346 HB VAL 51 HB VAL 51 8.248 3.220 -1.259
347 1HG1 VAL 51 HG11 VAL 51 6.481 4.332 -2.461
348 2HG1 VAL 51 HG12 VAL 51 8.041 4.932 -3.076
349 3HG1 VAL 51 HG13 VAL 51 7.108 3.747 -4.021
350 1HG2 VAL 51 HG21 VAL 51 7.251 1.227 -3.315
351 2HG2 VAL 51 HG22 VAL 51 7.687 0.924 -1.616
352 3HG2 VAL 51 HG23 VAL 51 6.240 1.884 -2.005
353 H SER 52 HN SER 52 11.041 2.249 -0.864
354 HA SER 52 HA SER 52 11.170 -0.589 -1.351
355 1HB SER 52 HB2 SER 52 13.237 0.380 -0.604
356 2HB SER 52 HB3 SER 52 12.450 1.266 0.687
357 HG SER 52 HG SER 52 13.371 -0.494 1.698
358 H ASP 53 HN ASP 53 10.322 -2.179 0.227
359 HA ASP 53 HA ASP 53 9.149 -0.942 2.574
360 1HB ASP 53 HB2 ASP 53 7.378 -2.722 2.590
361 2HB ASP 53 HB3 ASP 53 7.235 -1.625 1.231
362 HD2 ASP 53 HD2 ASP 53 8.907 -4.684 -0.431
363 H SER 54 HN SER 54 11.810 -2.171 1.925
364 HA SER 54 HA SER 54 11.604 -4.611 3.503
365 1HB SER 54 HB2 SER 54 13.519 -5.470 1.975
366 2HB SER 54 HB3 SER 54 11.890 -5.481 1.328
367 HG SER 54 HG SER 54 13.495 -4.582 -0.159
368 H ALA 55 HN ALA 55 12.232 -2.623 5.097
369 HA ALA 55 HA ALA 55 13.703 -2.432 6.737
370 1HB ALA 55 HB1 ALA 55 15.137 -4.725 5.337
371 2HB ALA 55 HB2 ALA 55 15.331 -4.239 7.038
372 3HB ALA 55 HB3 ALA 55 13.779 -4.905 6.474
373 H THR 56 HN THR 56 14.001 -0.601 4.554
374 HA THR 56 HA THR 56 15.344 1.162 4.375
375 HB THR 56 HB THR 56 16.949 0.025 6.705
376 HG1 THR 56 HG1 THR 56 14.265 1.192 6.493
377 1HG2 THR 56 HG21 THR 56 17.455 2.354 5.739
378 2HG2 THR 56 HG22 THR 56 15.798 2.815 6.200
379 3HG2 THR 56 HG23 THR 56 16.973 2.345 7.452
380 H ASN 57 HN ASN 57 15.863 -0.646 2.454
381 HA ASN 57 HA ASN 57 18.639 -1.356 2.602
382 1HB ASN 57 HB2 ASN 57 18.175 -2.473 0.393
383 2HB ASN 57 HB3 ASN 57 17.057 -2.988 1.640
384 1HD2 ASN 57 HD21 ASN 57 14.166 -1.826 0.114
385 2HD2 ASN 57 HD22 ASN 57 14.932 -2.610 1.455
386 H ILE 58 HN ILE 58 16.759 1.336 1.711
387 HA ILE 58 HA ILE 58 18.155 2.106 -0.651
388 HB ILE 58 HB ILE 58 16.331 3.589 1.242
389 1HG1 ILE 58 HG12 ILE 58 15.690 2.703 -1.565
390 2HG1 ILE 58 HG13 ILE 58 15.521 1.593 -0.220
391 1HG2 ILE 58 HG21 ILE 58 16.156 5.268 -0.598
392 2HG2 ILE 58 HG22 ILE 58 17.740 5.229 0.212
393 3HG2 ILE 58 HG23 ILE 58 17.540 4.476 -1.389
394 1HD1 ILE 58 HD11 ILE 58 14.241 4.363 -0.293
395 2HD1 ILE 58 HD12 ILE 58 13.407 2.863 -0.765
396 3HD1 ILE 58 HD13 ILE 58 13.956 3.085 0.914
397 H CYS 59 HN CYS 59 19.651 3.914 -0.850
398 HA CYS 59 HA CYS 59 21.851 3.691 0.636
399 1HB CYS 59 HB2 CYS 59 22.159 6.248 0.039
400 2HB CYS 59 HB3 CYS 59 22.251 4.982 -1.169
401 H GLY 60 HN GLY 60 19.297 6.250 1.131
402 1HA GLY 60 HA1 GLY 60 18.541 7.247 2.997
403 2HA GLY 60 HA2 GLY 60 19.132 5.870 3.906
Start of MODEL 20
1 H LYS 1 HN LYS 1 -0.423 0.906 0.000
2 HA LYS 1 HA LYS 1 1.780 -1.037 0.076
3 1HB LYS 1 HB2 LYS 1 1.506 0.034 -2.156
4 2HB LYS 1 HB3 LYS 1 1.738 1.604 -1.414
5 1HG LYS 1 HG2 LYS 1 3.997 0.999 -0.680
6 2HG LYS 1 HG3 LYS 1 3.768 -0.664 -1.181
7 1HD LYS 1 HD2 LYS 1 3.546 0.063 -3.554
8 2HD LYS 1 HD3 LYS 1 3.723 1.738 -3.070
9 1HE LYS 1 HE2 LYS 1 5.884 0.916 -3.877
10 2HE LYS 1 HE3 LYS 1 6.004 1.224 -2.156
11 1HZ LYS 1 HZ1 LYS 1 5.892 -1.084 -1.698
12 2HZ LYS 1 HZ2 LYS 1 5.351 -1.476 -3.183
13 H ASP 2 HN ASP 2 3.472 -0.606 1.513
14 HA ASP 2 HA ASP 2 3.218 1.780 3.104
15 1HB ASP 2 HB2 ASP 2 3.156 -0.998 4.367
16 2HB ASP 2 HB3 ASP 2 3.078 0.530 5.221
17 HD2 ASP 2 HD2 ASP 2 -0.254 -1.137 4.120
18 H GLY 3 HN GLY 3 5.217 2.166 4.365
19 1HA GLY 3 HA1 GLY 3 7.227 0.600 5.070
20 2HA GLY 3 HA2 GLY 3 7.523 0.695 3.345
21 H TYR 4 HN TYR 4 9.586 1.775 4.010
22 HA TYR 4 HA TYR 4 9.208 4.539 4.877
23 1HB TYR 4 HB2 TYR 4 11.738 2.911 4.233
24 2HB TYR 4 HB3 TYR 4 11.671 4.373 5.196
25 HD1 TYR 4 HD1 TYR 4 11.295 0.757 5.197
26 HD2 TYR 4 HD2 TYR 4 10.656 4.313 7.489
27 HE1 TYR 4 HE1 TYR 4 11.059 -0.638 7.309
28 HE2 TYR 4 HE2 TYR 4 10.422 2.906 9.593
29 HH TYR 4 HH TYR 4 10.727 -0.635 9.438
30 HA PRO 5 HA PRO 5 9.492 5.578 0.638
31 1HB PRO 5 HB2 PRO 5 8.823 8.216 0.884
32 2HB PRO 5 HB3 PRO 5 7.635 6.935 0.748
33 1HG PRO 5 HG2 PRO 5 8.436 8.475 3.142
34 2HG PRO 5 HG3 PRO 5 6.992 7.515 2.886
35 1HD PRO 5 HD2 PRO 5 9.295 6.773 4.425
36 2HD PRO 5 HD3 PRO 5 7.902 5.770 4.073
37 H VAL 6 HN VAL 6 11.181 5.973 -0.660
38 HA VAL 6 HA VAL 6 13.122 7.882 0.392
39 HB VAL 6 HB VAL 6 14.952 6.330 -0.062
40 1HG1 VAL 6 HG11 VAL 6 14.775 5.053 1.926
41 2HG1 VAL 6 HG12 VAL 6 13.795 6.513 2.206
42 3HG1 VAL 6 HG13 VAL 6 13.001 4.970 1.811
43 1HG2 VAL 6 HG21 VAL 6 14.068 4.895 -1.747
44 2HG2 VAL 6 HG22 VAL 6 14.385 3.873 -0.325
45 3HG2 VAL 6 HG23 VAL 6 12.721 4.380 -0.704
46 H ASP 7 HN ASP 7 13.747 9.285 -1.174
47 HA ASP 7 HA ASP 7 14.152 8.411 -3.809
48 1HB ASP 7 HB2 ASP 7 12.376 10.313 -4.579
49 2HB ASP 7 HB3 ASP 7 11.959 8.615 -4.467
50 HD2 ASP 7 HD2 ASP 7 11.016 11.604 -3.479
51 H SER 8 HN SER 8 12.836 11.465 -2.296
52 HA SER 8 HA SER 8 14.881 12.947 -3.615
53 1HB SER 8 HB2 SER 8 13.717 14.919 -2.551
54 2HB SER 8 HB3 SER 8 12.670 13.917 -3.537
55 HG SER 8 HG SER 8 11.705 14.491 -1.470
56 H LYS 9 HN LYS 9 14.072 11.826 -0.313
57 HA LYS 9 HA LYS 9 16.158 13.360 0.909
58 1HB LYS 9 HB2 LYS 9 15.506 12.244 2.938
59 2HB LYS 9 HB3 LYS 9 14.064 12.749 2.080
60 1HG LYS 9 HG2 LYS 9 14.460 10.215 1.028
61 2HG LYS 9 HG3 LYS 9 15.055 10.003 2.663
62 1HD LYS 9 HD2 LYS 9 12.772 9.540 2.940
63 2HD LYS 9 HD3 LYS 9 12.836 11.234 3.381
64 1HE LYS 9 HE2 LYS 9 12.150 11.875 1.067
65 2HE LYS 9 HE3 LYS 9 12.117 10.186 0.601
66 1HZ LYS 9 HZ1 LYS 9 10.399 11.403 2.699
67 2HZ LYS 9 HZ2 LYS 9 9.901 10.953 1.216
68 H GLY 10 HN GLY 10 15.894 10.375 -0.870
69 1HA GLY 10 HA1 GLY 10 17.688 9.235 -1.734
70 2HA GLY 10 HA2 GLY 10 18.763 10.020 -0.595
71 H CYS 11 HN CYS 11 18.200 9.426 1.869
72 HA CYS 11 HA CYS 11 17.716 6.552 1.960
73 1HB CYS 11 HB2 CYS 11 20.251 7.968 2.737
74 2HB CYS 11 HB3 CYS 11 19.768 6.496 3.556
75 H LYS 12 HN LYS 12 15.656 7.361 2.969
76 HA LYS 12 HA LYS 12 14.499 7.166 4.842
77 1HB LYS 12 HB2 LYS 12 17.203 6.829 6.172
78 2HB LYS 12 HB3 LYS 12 15.665 6.598 6.978
79 1HG LYS 12 HG2 LYS 12 16.447 5.097 4.438
80 2HG LYS 12 HG3 LYS 12 16.760 4.475 6.046
81 1HD LYS 12 HD2 LYS 12 14.176 4.939 6.440
82 2HD LYS 12 HD3 LYS 12 14.091 4.945 4.689
83 1HE LYS 12 HE2 LYS 12 15.256 2.669 6.366
84 2HE LYS 12 HE3 LYS 12 13.645 2.676 5.676
85 1HZ LYS 12 HZ1 LYS 12 14.818 3.012 3.454
86 2HZ LYS 12 HZ2 LYS 12 16.213 2.631 4.203
87 H LEU 13 HN LEU 13 14.025 8.377 6.994
88 HA LEU 13 HA LEU 13 15.464 10.896 7.181
89 1HB LEU 13 HB2 LEU 13 13.524 12.254 7.132
90 2HB LEU 13 HB3 LEU 13 13.569 11.303 5.660
91 HG LEU 13 HG LEU 13 12.012 9.734 7.312
92 1HD1 LEU 13 HD11 LEU 13 11.418 12.641 7.916
93 2HD1 LEU 13 HD12 LEU 13 10.290 11.299 8.224
94 3HD1 LEU 13 HD13 LEU 13 11.857 11.356 9.066
95 1HD2 LEU 13 HD21 LEU 13 11.515 10.092 5.006
96 2HD2 LEU 13 HD22 LEU 13 10.103 10.627 5.949
97 3HD2 LEU 13 HD23 LEU 13 11.229 11.828 5.272
98 H SER 14 HN SER 14 15.753 11.541 9.298
99 HA SER 14 HA SER 14 15.183 9.437 11.128
100 1HB SER 14 HB2 SER 14 16.652 12.086 11.504
101 2HB SER 14 HB3 SER 14 16.601 10.799 12.692
102 HG SER 14 HG SER 14 17.691 9.399 11.193
103 H CYS 15 HN CYS 15 12.780 9.717 11.140
104 HA CYS 15 HA CYS 15 11.574 11.988 12.198
105 1HB CYS 15 HB2 CYS 15 9.706 10.468 12.770
106 2HB CYS 15 HB3 CYS 15 10.241 10.358 11.105
107 H VAL 16 HN VAL 16 10.945 12.482 14.402
108 HA VAL 16 HA VAL 16 12.785 11.292 16.332
109 HB VAL 16 HB VAL 16 11.126 13.818 16.451
110 1HG1 VAL 16 HG11 VAL 16 13.249 12.684 18.294
111 2HG1 VAL 16 HG12 VAL 16 12.718 14.383 18.332
112 3HG1 VAL 16 HG13 VAL 16 11.558 13.079 18.681
113 1HG2 VAL 16 HG21 VAL 16 12.788 14.020 14.706
114 2HG2 VAL 16 HG22 VAL 16 13.310 14.975 16.115
115 3HG2 VAL 16 HG23 VAL 16 14.057 13.393 15.785
116 H ALA 17 HN ALA 17 9.525 11.104 15.255
117 HA ALA 17 HA ALA 17 8.574 9.729 17.525
118 1HB ALA 17 HB1 ALA 17 7.757 12.649 17.239
119 2HB ALA 17 HB2 ALA 17 6.995 11.471 18.334
120 3HB ALA 17 HB3 ALA 17 8.695 11.941 18.577
121 H ASN 18 HN ASN 18 6.136 9.344 17.294
122 HA ASN 18 HA ASN 18 5.764 8.448 14.711
123 1HB ASN 18 HB2 ASN 18 3.828 8.850 17.043
124 2HB ASN 18 HB3 ASN 18 3.329 8.089 15.545
125 1HD2 ASN 18 HD21 ASN 18 4.540 5.644 18.217
126 2HD2 ASN 18 HD22 ASN 18 3.479 7.013 18.243
127 H ASN 19 HN ASN 19 4.516 11.300 16.550
128 HA ASN 19 HA ASN 19 2.670 12.109 14.649
129 1HB ASN 19 HB2 ASN 19 2.906 14.376 15.831
130 2HB ASN 19 HB3 ASN 19 2.541 13.027 16.889
131 1HD2 ASN 19 HD21 ASN 19 5.429 13.206 18.799
132 2HD2 ASN 19 HD22 ASN 19 3.916 12.438 18.451
133 H TYR 20 HN TYR 20 6.188 12.541 15.052
134 HA TYR 20 HA TYR 20 6.424 14.778 13.314
135 1HB TYR 20 HB2 TYR 20 7.952 13.802 15.241
136 2HB TYR 20 HB3 TYR 20 8.481 12.619 14.062
137 HD1 TYR 20 HD1 TYR 20 8.865 16.000 15.279
138 HD2 TYR 20 HD2 TYR 20 9.671 13.416 11.965
139 HE1 TYR 20 HE1 TYR 20 10.630 17.623 14.433
140 HE2 TYR 20 HE2 TYR 20 11.433 15.048 11.130
141 HH TYR 20 HH TYR 20 12.100 18.050 12.918
142 H CYS 21 HN CYS 21 6.607 11.211 12.946
143 HA CYS 21 HA CYS 21 7.422 11.304 10.249
144 1HB CYS 21 HB2 CYS 21 7.772 9.276 11.358
145 2HB CYS 21 HB3 CYS 21 6.140 9.222 11.996
146 H ASP 22 HN ASP 22 4.215 11.188 11.978
147 HA ASP 22 HA ASP 22 2.918 10.125 9.803
148 1HB ASP 22 HB2 ASP 22 2.111 10.114 12.188
149 2HB ASP 22 HB3 ASP 22 1.758 11.826 12.062
150 HD2 ASP 22 HD2 ASP 22 0.127 12.428 10.862
151 H ASN 23 HN ASN 23 3.232 13.520 11.035
152 HA ASN 23 HA ASN 23 1.374 14.645 9.339
153 1HB ASN 23 HB2 ASN 23 2.257 16.754 10.069
154 2HB ASN 23 HB3 ASN 23 2.567 15.668 11.409
155 1HD2 ASN 23 HD21 ASN 23 6.074 15.494 11.029
156 2HD2 ASN 23 HD22 ASN 23 4.647 14.939 11.839
157 H GLN 24 HN GLN 24 4.783 13.690 8.949
158 HA GLN 24 HA GLN 24 5.147 15.258 6.598
159 1HB GLN 24 HB2 GLN 24 6.968 14.626 8.279
160 2HB GLN 24 HB3 GLN 24 6.902 12.996 7.640
161 1HG GLN 24 HG2 GLN 24 7.483 13.821 5.377
162 2HG GLN 24 HG3 GLN 24 7.449 15.479 5.945
163 1HE2 GLN 24 HE21 GLN 24 10.973 14.286 5.822
164 2HE2 GLN 24 HE22 GLN 24 9.652 14.437 4.712
165 H CYS 25 HN CYS 25 4.153 11.959 7.454
166 HA CYS 25 HA CYS 25 4.594 10.845 4.903
167 1HB CYS 25 HB2 CYS 25 2.816 9.994 7.195
168 2HB CYS 25 HB3 CYS 25 3.036 9.056 5.731
169 H LYS 26 HN LYS 26 1.765 12.327 6.624
170 HA LYS 26 HA LYS 26 -0.019 11.588 4.524
171 1HB LYS 26 HB2 LYS 26 -1.711 12.665 5.887
172 2HB LYS 26 HB3 LYS 26 -0.706 11.630 6.880
173 1HG LYS 26 HG2 LYS 26 -0.013 13.379 8.157
174 2HG LYS 26 HG3 LYS 26 0.442 14.316 6.748
175 1HD LYS 26 HD2 LYS 26 -2.465 14.022 7.611
176 2HD LYS 26 HD3 LYS 26 -1.433 15.283 8.255
177 1HE LYS 26 HE2 LYS 26 -0.940 15.995 5.847
178 2HE LYS 26 HE3 LYS 26 -2.156 14.848 5.320
179 1HZ LYS 26 HZ1 LYS 26 -3.788 16.048 6.698
180 2HZ LYS 26 HZ2 LYS 26 -2.656 17.120 7.169
181 H MET 27 HN MET 27 2.296 14.066 4.940
182 HA MET 27 HA MET 27 1.108 16.293 3.980
183 1HB MET 27 HB2 MET 27 3.560 15.863 4.709
184 2HB MET 27 HB3 MET 27 3.854 15.261 3.090
185 1HG MET 27 HG2 MET 27 2.747 17.595 2.368
186 2HG MET 27 HG3 MET 27 3.231 18.082 3.980
187 1HE MET 27 HE1 MET 27 5.596 17.643 4.942
188 2HE MET 27 HE2 MET 27 5.914 16.040 4.237
189 3HE MET 27 HE3 MET 27 7.063 17.373 3.972
190 H LYS 28 HN LYS 28 2.214 13.400 2.150
191 HA LYS 28 HA LYS 28 0.638 14.022 -0.093
192 1HB LYS 28 HB2 LYS 28 2.433 14.531 -1.708
193 2HB LYS 28 HB3 LYS 28 2.220 15.794 -0.513
194 1HG LYS 28 HG2 LYS 28 4.110 14.630 0.833
195 2HG LYS 28 HG3 LYS 28 4.417 13.685 -0.610
196 1HD LYS 28 HD2 LYS 28 4.752 15.798 -1.917
197 2HD LYS 28 HD3 LYS 28 4.458 16.737 -0.467
198 1HE LYS 28 HE2 LYS 28 6.869 16.541 -0.758
199 2HE LYS 28 HE3 LYS 28 6.415 15.584 0.638
200 1HZ LYS 28 HZ1 LYS 28 6.921 14.517 -2.088
201 2HZ LYS 28 HZ2 LYS 28 7.875 14.304 -0.786
202 H LYS 29 HN LYS 29 3.601 12.412 1.203
203 HA LYS 29 HA LYS 29 3.863 10.578 -0.843
204 1HB LYS 29 HB2 LYS 29 4.781 10.698 2.016
205 2HB LYS 29 HB3 LYS 29 5.050 9.239 1.084
206 1HG LYS 29 HG2 LYS 29 5.812 11.960 -0.038
207 2HG LYS 29 HG3 LYS 29 6.890 11.108 1.049
208 1HD LYS 29 HD2 LYS 29 6.956 9.161 -0.471
209 2HD LYS 29 HD3 LYS 29 5.767 9.901 -1.523
210 1HE LYS 29 HE2 LYS 29 7.872 10.350 -2.567
211 2HE LYS 29 HE3 LYS 29 7.415 11.864 -1.812
212 1HZ LYS 29 HZ1 LYS 29 9.330 9.882 -0.706
213 2HZ LYS 29 HZ2 LYS 29 9.693 11.371 -1.256
214 H ALA 30 HN ALA 30 1.846 10.469 2.149
215 HA ALA 30 HA ALA 30 0.818 7.880 1.293
216 1HB ALA 30 HB1 ALA 30 1.839 8.134 4.108
217 2HB ALA 30 HB2 ALA 30 1.656 6.685 3.090
218 3HB ALA 30 HB3 ALA 30 3.006 7.810 2.805
219 H SER 31 HN SER 31 -0.676 7.183 3.466
220 HA SER 31 HA SER 31 -2.475 9.410 3.699
221 1HB SER 31 HB2 SER 31 -3.368 7.154 3.219
222 2HB SER 31 HB3 SER 31 -2.662 6.533 4.698
223 HG SER 31 HG SER 31 -4.935 7.045 4.944
224 H GLY 32 HN GLY 32 -0.107 7.557 5.604
225 1HA GLY 32 HA1 GLY 32 0.189 9.553 7.548
226 2HA GLY 32 HA2 GLY 32 -0.899 8.335 8.185
227 H GLY 33 HN GLY 33 0.856 7.884 9.801
228 1HA GLY 33 HA1 GLY 33 1.532 5.367 9.649
229 2HA GLY 33 HA2 GLY 33 2.858 6.035 8.717
230 H HIS 34 HN HIS 34 4.411 5.338 10.365
231 HA HIS 34 HA HIS 34 4.195 6.771 12.885
232 1HB HIS 34 HB2 HIS 34 4.569 3.780 12.889
233 2HB HIS 34 HB3 HIS 34 4.187 4.839 14.232
234 HD1 HIS 34 HD1 HIS 34 1.696 6.212 13.691
235 HD2 HIS 34 HD2 HIS 34 2.370 2.385 12.113
236 HE1 HIS 34 HE1 HIS 34 -0.604 5.247 13.150
237 H CYS 35 HN CYS 35 6.244 6.148 14.299
238 HA CYS 35 HA CYS 35 8.439 6.474 12.398
239 1HB CYS 35 HB2 CYS 35 7.982 8.400 13.836
240 2HB CYS 35 HB3 CYS 35 8.185 7.406 15.265
241 H TYR 36 HN TYR 36 9.308 4.417 12.091
242 HA TYR 36 HA TYR 36 9.660 2.775 14.507
243 1HB TYR 36 HB2 TYR 36 8.121 2.086 12.504
244 2HB TYR 36 HB3 TYR 36 9.571 2.020 11.523
245 HD1 TYR 36 HD1 TYR 36 7.533 0.294 13.975
246 HD2 TYR 36 HD2 TYR 36 11.358 0.324 12.060
247 HE1 TYR 36 HE1 TYR 36 7.923 -2.112 14.700
248 HE2 TYR 36 HE2 TYR 36 11.735 -2.082 12.791
249 HH TYR 36 HH TYR 36 10.938 -3.788 13.836
250 H ALA 37 HN ALA 37 11.693 2.058 15.051
251 HA ALA 37 HA ALA 37 13.911 2.282 15.162
252 1HB ALA 37 HB1 ALA 37 13.589 0.296 13.723
253 2HB ALA 37 HB2 ALA 37 13.636 1.338 12.280
254 3HB ALA 37 HB3 ALA 37 15.083 1.168 13.302
255 H MET 38 HN MET 38 13.274 4.759 15.210
256 HA MET 38 HA MET 38 13.215 6.777 14.244
257 1HB MET 38 HB2 MET 38 15.661 7.534 13.896
258 2HB MET 38 HB3 MET 38 15.333 6.758 15.433
259 1HG MET 38 HG2 MET 38 16.224 4.612 14.594
260 2HG MET 38 HG3 MET 38 16.431 5.285 12.989
261 1HE MET 38 HE1 MET 38 18.751 3.859 14.582
262 2HE MET 38 HE2 MET 38 18.946 4.565 12.959
263 3HE MET 38 HE3 MET 38 20.111 4.958 14.247
264 H SER 39 HN SER 39 12.166 5.264 12.235
265 HA SER 39 HA SER 39 13.040 6.981 10.123
266 1HB SER 39 HB2 SER 39 13.172 3.963 9.921
267 2HB SER 39 HB3 SER 39 12.817 4.912 8.491
268 HG SER 39 HG SER 39 15.113 5.394 10.188
269 H CYS 40 HN CYS 40 11.288 7.477 8.659
270 HA CYS 40 HA CYS 40 8.838 7.231 10.075
271 1HB CYS 40 HB2 CYS 40 9.445 9.339 9.086
272 2HB CYS 40 HB3 CYS 40 9.572 8.620 7.493
273 H TYR 41 HN TYR 41 8.095 5.061 9.956
274 HA TYR 41 HA TYR 41 7.836 3.749 7.427
275 1HB TYR 41 HB2 TYR 41 8.085 2.655 9.712
276 2HB TYR 41 HB3 TYR 41 6.577 3.389 10.218
277 HD1 TYR 41 HD1 TYR 41 7.983 1.024 7.684
278 HD2 TYR 41 HD2 TYR 41 4.549 2.244 9.925
279 HE1 TYR 41 HE1 TYR 41 6.705 -1.008 6.846
280 HE2 TYR 41 HE2 TYR 41 3.282 0.208 9.079
281 HH TYR 41 HH TYR 41 4.853 -2.106 6.881
282 H CYS 42 HN CYS 42 6.560 4.869 5.950
283 HA CYS 42 HA CYS 42 4.180 6.158 6.961
284 1HB CYS 42 HB2 CYS 42 5.479 6.186 4.229
285 2HB CYS 42 HB3 CYS 42 4.024 7.070 4.647
286 H GLU 43 HN GLU 43 2.074 5.829 5.682
287 HA GLU 43 HA GLU 43 1.891 3.049 4.865
288 1HB GLU 43 HB2 GLU 43 0.355 4.367 7.136
289 2HB GLU 43 HB3 GLU 43 -0.203 2.897 6.363
290 1HG GLU 43 HG2 GLU 43 2.024 1.820 6.899
291 2HG GLU 43 HG3 GLU 43 2.488 3.274 7.758
292 HE2 GLU 43 HE2 GLU 43 0.150 2.647 10.367
293 H GLY 44 HN GLY 44 0.452 2.718 3.179
294 1HA GLY 44 HA1 GLY 44 -1.402 3.060 1.895
295 2HA GLY 44 HA2 GLY 44 -1.797 4.497 2.818
296 H LEU 45 HN LEU 45 0.965 3.375 0.720
297 HA LEU 45 HA LEU 45 1.032 6.053 -0.436
298 1HB LEU 45 HB2 LEU 45 2.962 3.734 -0.493
299 2HB LEU 45 HB3 LEU 45 3.170 5.185 -1.453
300 HG LEU 45 HG LEU 45 2.838 6.276 1.023
301 1HD1 LEU 45 HD11 LEU 45 4.261 3.633 1.441
302 2HD1 LEU 45 HD12 LEU 45 4.227 4.981 2.602
303 3HD1 LEU 45 HD13 LEU 45 2.718 4.145 2.166
304 1HD2 LEU 45 HD21 LEU 45 5.310 6.522 1.048
305 2HD2 LEU 45 HD22 LEU 45 5.407 5.355 -0.293
306 3HD2 LEU 45 HD23 LEU 45 4.571 6.909 -0.525
307 HA PRO 46 HA PRO 46 -0.203 4.353 -4.376
308 1HB PRO 46 HB2 PRO 46 0.953 6.178 -6.050
309 2HB PRO 46 HB3 PRO 46 -0.641 6.391 -5.354
310 1HG PRO 46 HG2 PRO 46 1.896 7.716 -4.616
311 2HG PRO 46 HG3 PRO 46 0.254 8.204 -4.244
312 1HD PRO 46 HD2 PRO 46 2.118 6.951 -2.460
313 2HD PRO 46 HD3 PRO 46 0.441 7.333 -2.125
314 H GLU 47 HN GLU 47 0.770 3.401 -6.389
315 HA GLU 47 HA GLU 47 2.782 1.828 -5.127
316 1HB GLU 47 HB2 GLU 47 1.257 1.554 -7.749
317 2HB GLU 47 HB3 GLU 47 2.470 0.397 -7.238
318 1HG GLU 47 HG2 GLU 47 1.192 -0.013 -5.126
319 2HG GLU 47 HG3 GLU 47 -0.020 1.147 -5.632
320 HE2 GLU 47 HE2 GLU 47 -1.537 -1.085 -7.819
321 H ASN 48 HN ASN 48 2.838 4.618 -7.013
322 HA ASN 48 HA ASN 48 5.010 3.888 -8.692
323 1HB ASN 48 HB2 ASN 48 4.992 6.291 -9.331
324 2HB ASN 48 HB3 ASN 48 3.362 5.649 -9.347
325 1HD2 ASN 48 HD21 ASN 48 3.740 8.990 -7.518
326 2HD2 ASN 48 HD22 ASN 48 4.358 8.383 -9.018
327 H ALA 49 HN ALA 49 4.554 4.817 -5.390
328 HA ALA 49 HA ALA 49 6.928 6.428 -5.165
329 1HB ALA 49 HB1 ALA 49 5.028 5.317 -3.059
330 2HB ALA 49 HB2 ALA 49 6.251 6.587 -2.810
331 3HB ALA 49 HB3 ALA 49 4.857 6.890 -3.875
332 H LYS 50 HN LYS 50 8.954 5.700 -4.722
333 HA LYS 50 HA LYS 50 9.333 2.882 -4.342
334 1HB LYS 50 HB2 LYS 50 10.851 4.026 -5.795
335 2HB LYS 50 HB3 LYS 50 11.213 5.241 -4.586
336 1HG LYS 50 HG2 LYS 50 13.054 3.665 -4.595
337 2HG LYS 50 HG3 LYS 50 12.165 3.418 -3.105
338 1HD LYS 50 HD2 LYS 50 11.005 1.466 -4.051
339 2HD LYS 50 HD3 LYS 50 11.706 1.763 -5.630
340 1HE LYS 50 HE2 LYS 50 13.031 0.017 -4.631
341 2HE LYS 50 HE3 LYS 50 14.015 1.465 -4.568
342 1HZ LYS 50 HZ1 LYS 50 13.426 1.757 -2.259
343 2HZ LYS 50 HZ2 LYS 50 12.340 0.544 -2.294
344 H VAL 51 HN VAL 51 9.285 1.854 -2.422
345 HA VAL 51 HA VAL 51 10.152 3.408 -0.085
346 HB VAL 51 HB VAL 51 8.480 2.416 1.246
347 1HG1 VAL 51 HG11 VAL 51 7.746 4.308 -0.193
348 2HG1 VAL 51 HG12 VAL 51 7.137 3.132 -1.381
349 3HG1 VAL 51 HG13 VAL 51 6.418 3.207 0.245
350 1HG2 VAL 51 HG21 VAL 51 7.964 0.594 -1.116
351 2HG2 VAL 51 HG22 VAL 51 8.439 0.155 0.543
352 3HG2 VAL 51 HG23 VAL 51 6.805 0.784 0.222
353 H SER 52 HN SER 52 11.473 2.225 1.455
354 HA SER 52 HA SER 52 12.111 -0.478 0.703
355 1HB SER 52 HB2 SER 52 13.975 0.648 1.624
356 2HB SER 52 HB3 SER 52 13.021 1.419 2.876
357 HG SER 52 HG SER 52 13.944 -1.301 2.732
358 H ASP 53 HN ASP 53 11.500 -2.346 1.972
359 HA ASP 53 HA ASP 53 9.776 -1.814 4.225
360 1HB ASP 53 HB2 ASP 53 8.165 -3.586 3.427
361 2HB ASP 53 HB3 ASP 53 8.161 -2.136 2.444
362 HD2 ASP 53 HD2 ASP 53 7.127 -4.004 1.406
363 H SER 54 HN SER 54 12.513 -2.662 4.151
364 HA SER 54 HA SER 54 12.288 -5.359 5.108
365 1HB SER 54 HB2 SER 54 14.321 -6.002 3.622
366 2HB SER 54 HB3 SER 54 12.734 -5.981 2.878
367 HG SER 54 HG SER 54 14.583 -3.752 2.794
368 H ALA 55 HN ALA 55 12.741 -3.201 6.724
369 HA ALA 55 HA ALA 55 14.067 -2.754 8.439
370 1HB ALA 55 HB1 ALA 55 14.042 -5.234 8.581
371 2HB ALA 55 HB2 ALA 55 15.504 -5.294 7.566
372 3HB ALA 55 HB3 ALA 55 15.571 -4.547 9.180
373 H THR 56 HN THR 56 14.627 -1.196 6.232
374 HA THR 56 HA THR 56 16.163 0.288 5.613
375 HB THR 56 HB THR 56 17.661 -0.679 8.104
376 HG1 THR 56 HG1 THR 56 16.156 0.768 9.144
377 1HG2 THR 56 HG21 THR 56 17.374 2.108 6.867
378 2HG2 THR 56 HG22 THR 56 18.370 1.664 8.274
379 3HG2 THR 56 HG23 THR 56 18.810 1.078 6.652
380 H ASN 57 HN ASN 57 16.308 -1.731 3.941
381 HA ASN 57 HA ASN 57 19.039 -2.531 3.743
382 1HB ASN 57 HB2 ASN 57 18.340 -3.413 1.511
383 2HB ASN 57 HB3 ASN 57 17.232 -3.934 2.766
384 1HD2 ASN 57 HD21 ASN 57 15.962 -1.827 -0.422
385 2HD2 ASN 57 HD22 ASN 57 17.572 -2.430 -0.211
386 H ILE 58 HN ILE 58 17.120 0.292 3.101
387 HA ILE 58 HA ILE 58 19.435 1.383 1.657
388 HB ILE 58 HB ILE 58 16.521 2.141 1.526
389 1HG1 ILE 58 HG12 ILE 58 18.368 1.498 -0.770
390 2HG1 ILE 58 HG13 ILE 58 17.554 0.226 0.120
391 1HG2 ILE 58 HG21 ILE 58 18.933 3.658 0.500
392 2HG2 ILE 58 HG22 ILE 58 17.255 3.964 -0.009
393 3HG2 ILE 58 HG23 ILE 58 17.728 4.208 1.689
394 1HD1 ILE 58 HD11 ILE 58 16.241 2.545 -1.365
395 2HD1 ILE 58 HD12 ILE 58 16.157 0.815 -1.776
396 3HD1 ILE 58 HD13 ILE 58 15.352 1.421 -0.309
397 H CYS 59 HN CYS 59 19.541 4.351 3.356
398 HA CYS 59 HA CYS 59 20.960 2.880 1.682
399 1HB CYS 59 HB2 CYS 59 21.780 4.527 4.037
400 2HB CYS 59 HB3 CYS 59 23.008 3.601 3.197
401 H GLY 60 HN GLY 60 20.856 2.394 5.285
402 1HA GLY 60 HA1 GLY 60 21.191 0.545 6.532
403 2HA GLY 60 HA2 GLY 60 21.118 -0.431 5.079