Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
505254 | 2ep2 RC | 10155 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 -14.390 -5.442 -8.090
2 HA2 GLY 1 1HA GLY 1 -14.899 -3.710 -6.393
3 HA3 GLY 1 2HA GLY 1 -16.100 -3.712 -7.676
4 H SER 2 H SER 2 -17.403 -2.682 -5.949
5 HA SER 2 HA SER 2 -19.037 -4.695 -4.658
6 HB2 SER 2 1HB SER 2 -17.698 -2.522 -3.026
7 HB3 SER 2 2HB SER 2 -18.901 -3.666 -2.429
8 HG SER 2 HG SER 2 -16.224 -4.097 -3.143
9 H SER 3 H SER 3 -21.005 -3.728 -3.675
10 HA SER 3 HA SER 3 -21.832 -1.376 -5.234
11 HB2 SER 3 1HB SER 3 -23.051 -3.614 -5.486
12 HB3 SER 3 2HB SER 3 -23.685 -3.325 -3.867
13 HG SER 3 HG SER 3 -24.109 -1.827 -6.223
14 H GLY 4 H GLY 4 -21.415 0.371 -3.990
15 HA2 GLY 4 1HA GLY 4 -23.099 0.955 -1.800
16 HA3 GLY 4 2HA GLY 4 -21.511 0.501 -1.200
17 H SER 5 H SER 5 -19.672 1.767 -1.873
18 HA SER 5 HA SER 5 -20.433 4.553 -2.426
19 HB2 SER 5 1HB SER 5 -18.294 5.165 -1.355
20 HB3 SER 5 2HB SER 5 -19.314 4.217 -0.274
21 HG SER 5 HG SER 5 -16.995 3.617 -0.476
22 H SER 6 H SER 6 -20.264 2.801 -4.586
23 HA SER 6 HA SER 6 -17.707 2.871 -5.833
24 HB2 SER 6 1HB SER 6 -20.469 2.113 -6.655
25 HB3 SER 6 2HB SER 6 -19.301 2.455 -7.931
26 HG SER 6 HG SER 6 -19.382 0.368 -6.100
27 H GLY 7 H GLY 7 -17.170 4.030 -7.804
28 HA2 GLY 7 1HA GLY 7 -16.932 5.952 -9.035
29 HA3 GLY 7 2HA GLY 7 -18.653 6.209 -8.788
30 H THR 8 H THR 8 -15.676 6.331 -6.825
31 HA THR 8 HA THR 8 -16.589 8.944 -5.809
32 HB THR 8 HB THR 8 -15.087 6.819 -4.266
33 HG1 THR 8 HG1 THR 8 -17.587 7.848 -3.505
34 HG21 THR 8 3HG2 THR 8 -16.027 9.569 -3.441
35 HG22 THR 8 1HG2 THR 8 -14.354 9.038 -3.609
36 HG23 THR 8 2HG2 THR 8 -15.374 8.351 -2.346
37 H GLY 9 H GLY 9 -13.718 6.877 -6.256
38 HA2 GLY 9 1HA GLY 9 -11.966 7.921 -7.708
39 HA3 GLY 9 2HA GLY 9 -12.154 9.346 -6.697
40 H GLU 10 H GLU 10 -11.877 5.887 -5.903
41 HA GLU 10 HA GLU 10 -10.498 6.056 -3.579
42 HB2 GLU 10 1HB GLU 10 -10.399 4.051 -5.800
43 HB3 GLU 10 2HB GLU 10 -9.303 3.880 -4.436
44 HG2 GLU 10 1HG GLU 10 -11.039 2.609 -3.707
45 HG3 GLU 10 2HG GLU 10 -11.514 4.172 -3.046
46 H LYS 11 H LYS 11 -8.215 5.709 -3.046
47 HA LYS 11 HA LYS 11 -6.514 7.650 -3.742
48 HB2 LYS 11 1HB LYS 11 -5.971 4.798 -2.998
49 HB3 LYS 11 2HB LYS 11 -4.631 5.868 -3.385
50 HG2 LYS 11 1HG LYS 11 -4.752 6.108 -1.112
51 HG3 LYS 11 2HG LYS 11 -5.768 7.449 -1.646
52 HD2 LYS 11 1HD LYS 11 -7.698 6.446 -0.942
53 HD3 LYS 11 2HD LYS 11 -7.067 4.815 -1.182
54 HE2 LYS 11 1HE LYS 11 -6.058 6.645 0.982
55 HE3 LYS 11 2HE LYS 11 -7.428 5.562 1.219
56 HZ1 LYS 11 3HZ LYS 11 -5.711 3.826 0.280
57 HZ2 LYS 11 1HZ LYS 11 -5.748 4.229 1.923
58 HZ3 LYS 11 2HZ LYS 11 -4.591 4.928 0.906
59 HA PRO 12 HA PRO 12 -5.209 7.269 -7.916
60 HB2 PRO 12 1HB PRO 12 -2.670 8.219 -7.762
61 HB3 PRO 12 2HB PRO 12 -4.094 9.257 -7.624
62 HG2 PRO 12 1HG PRO 12 -2.363 8.119 -5.463
63 HG3 PRO 12 2HG PRO 12 -3.034 9.753 -5.614
64 HD2 PRO 12 1HD PRO 12 -4.132 7.870 -4.008
65 HD3 PRO 12 2HD PRO 12 -5.102 9.113 -4.824
66 H TYR 13 H TYR 13 -3.573 5.583 -5.401
67 HA TYR 13 HA TYR 13 -2.334 3.805 -7.398
68 HB2 TYR 13 1HB TYR 13 -1.285 4.210 -4.601
69 HB3 TYR 13 2HB TYR 13 -0.484 3.422 -5.955
70 HD1 TYR 13 HD1 TYR 13 0.334 4.810 -7.871
71 HD2 TYR 13 HD2 TYR 13 -1.119 6.553 -4.272
72 HE1 TYR 13 HE1 TYR 13 1.434 6.929 -8.460
73 HE2 TYR 13 HE2 TYR 13 -0.024 8.678 -4.852
74 HH TYR 13 HH TYR 13 2.286 8.945 -7.302
75 H GLU 14 H GLU 14 -3.576 2.048 -7.507
76 HA GLU 14 HA GLU 14 -4.386 0.773 -4.979
77 HB2 GLU 14 1HB GLU 14 -6.254 1.871 -6.364
78 HB3 GLU 14 2HB GLU 14 -5.997 0.565 -7.512
79 HG2 GLU 14 1HG GLU 14 -6.528 -1.074 -5.807
80 HG3 GLU 14 2HG GLU 14 -6.723 0.208 -4.613
81 H CYS 15 H CYS 15 -3.576 -1.193 -4.719
82 HA CYS 15 HA CYS 15 -1.998 -2.462 -6.689
83 HB2 CYS 15 1HB CYS 15 -1.678 -2.737 -4.237
84 HB3 CYS 15 2HB CYS 15 -3.168 -3.673 -4.176
85 H SER 16 H SER 16 -2.341 -4.419 -7.806
86 HA SER 16 HA SER 16 -5.176 -4.957 -8.363
87 HB2 SER 16 1HB SER 16 -2.692 -5.046 -10.007
88 HB3 SER 16 2HB SER 16 -3.965 -6.204 -10.391
89 HG SER 16 HG SER 16 -3.992 -3.405 -10.543
90 H ILE 17 H ILE 17 -2.204 -6.390 -7.272
91 HA ILE 17 HA ILE 17 -2.837 -9.105 -7.603
92 HB ILE 17 HB ILE 17 -1.098 -7.778 -5.523
93 HG12 ILE 17 1HG1 ILE 17 -0.160 -9.341 -7.911
94 HG13 ILE 17 2HG1 ILE 17 -0.590 -7.642 -8.072
95 HG21 ILE 17 1HG2 ILE 17 -1.918 -10.041 -4.865
96 HG22 ILE 17 2HG2 ILE 17 -1.133 -10.686 -6.306
97 HG23 ILE 17 3HG2 ILE 17 -0.168 -9.926 -5.040
98 HD11 ILE 17 3HD1 ILE 17 1.879 -8.514 -7.505
99 HD12 ILE 17 1HD1 ILE 17 1.258 -6.942 -7.003
100 HD13 ILE 17 2HD1 ILE 17 1.250 -8.295 -5.872
101 H CYS 18 H CYS 18 -3.153 -7.048 -4.706
102 HA CYS 18 HA CYS 18 -4.995 -9.033 -3.571
103 HB2 CYS 18 1HB CYS 18 -4.635 -7.782 -1.432
104 HB3 CYS 18 2HB CYS 18 -3.173 -8.506 -2.094
105 H GLY 19 H GLY 19 -4.676 -5.562 -4.226
106 HA2 GLY 19 1HA GLY 19 -6.641 -4.456 -5.198
107 HA3 GLY 19 2HA GLY 19 -7.621 -5.376 -4.066
108 H LYS 20 H LYS 20 -4.744 -4.315 -2.666
109 HA LYS 20 HA LYS 20 -6.104 -2.588 -0.863
110 HB2 LYS 20 1HB LYS 20 -3.255 -3.387 -1.301
111 HB3 LYS 20 2HB LYS 20 -3.603 -2.006 -0.269
112 HG2 LYS 20 1HG LYS 20 -5.138 -3.508 1.040
113 HG3 LYS 20 2HG LYS 20 -4.480 -4.856 0.109
114 HD2 LYS 20 1HD LYS 20 -3.072 -4.921 1.904
115 HD3 LYS 20 2HD LYS 20 -2.182 -3.787 0.885
116 HE2 LYS 20 1HE LYS 20 -4.158 -2.962 3.007
117 HE3 LYS 20 2HE LYS 20 -2.419 -3.084 3.274
118 HZ1 LYS 20 3HZ LYS 20 -2.390 -1.534 1.166
119 HZ2 LYS 20 1HZ LYS 20 -2.579 -0.901 2.723
120 HZ3 LYS 20 2HZ LYS 20 -3.929 -1.115 1.728
121 H SER 21 H SER 21 -5.070 -0.347 -0.389
122 HA SER 21 HA SER 21 -4.493 1.090 -2.879
123 HB2 SER 21 1HB SER 21 -6.066 2.918 -2.086
124 HB3 SER 21 2HB SER 21 -6.843 1.438 -2.646
125 HG SER 21 HG SER 21 -6.218 1.684 0.072
126 H PHE 22 H PHE 22 -3.292 2.985 -2.634
127 HA PHE 22 HA PHE 22 -2.410 3.690 0.065
128 HB2 PHE 22 1HB PHE 22 -0.475 3.164 -2.199
129 HB3 PHE 22 2HB PHE 22 -0.064 3.644 -0.555
130 HD1 PHE 22 HD1 PHE 22 -1.633 0.924 -2.529
131 HD2 PHE 22 HD2 PHE 22 0.310 2.041 1.090
132 HE1 PHE 22 HE1 PHE 22 -1.486 -1.445 -1.880
133 HE2 PHE 22 HE2 PHE 22 0.461 -0.326 1.744
134 HZ PHE 22 HZ PHE 22 -0.437 -2.073 0.258
135 H THR 23 H THR 23 -1.984 5.826 0.348
136 HA THR 23 HA THR 23 -2.766 7.607 -1.795
137 HB THR 23 HB THR 23 -2.619 9.391 -0.135
138 HG1 THR 23 HG1 THR 23 -1.348 9.136 1.528
139 HG21 THR 23 3HG2 THR 23 -4.692 8.217 -0.133
140 HG22 THR 23 1HG2 THR 23 -4.238 8.452 1.554
141 HG23 THR 23 2HG2 THR 23 -4.007 6.880 0.789
142 H LYS 24 H LYS 24 0.123 6.293 -0.635
143 HA LYS 24 HA LYS 24 1.675 8.409 -1.979
144 HB2 LYS 24 1HB LYS 24 2.178 6.927 0.564
145 HB3 LYS 24 2HB LYS 24 3.560 7.397 -0.417
146 HG2 LYS 24 1HG LYS 24 2.342 9.740 -0.377
147 HG3 LYS 24 2HG LYS 24 1.649 9.079 1.107
148 HD2 LYS 24 1HD LYS 24 4.175 8.449 1.577
149 HD3 LYS 24 2HD LYS 24 4.468 9.792 0.470
150 HE2 LYS 24 1HE LYS 24 2.535 10.141 2.717
151 HE3 LYS 24 2HE LYS 24 4.264 10.200 3.053
152 HZ1 LYS 24 3HZ LYS 24 2.662 11.996 1.343
153 HZ2 LYS 24 1HZ LYS 24 4.339 11.882 1.156
154 HZ3 LYS 24 2HZ LYS 24 3.686 12.395 2.629
155 H LYS 25 H LYS 25 2.349 7.678 -3.880
156 HA LYS 25 HA LYS 25 2.339 5.213 -4.944
157 HB2 LYS 25 1HB LYS 25 3.007 7.133 -6.249
158 HB3 LYS 25 2HB LYS 25 4.483 7.311 -5.309
159 HG2 LYS 25 1HG LYS 25 5.426 5.356 -6.242
160 HG3 LYS 25 2HG LYS 25 3.885 4.864 -6.947
161 HD2 LYS 25 1HD LYS 25 5.095 5.740 -8.750
162 HD3 LYS 25 2HD LYS 25 4.008 7.049 -8.278
163 HE2 LYS 25 1HE LYS 25 6.019 8.158 -8.517
164 HE3 LYS 25 2HE LYS 25 5.999 7.809 -6.789
165 HZ1 LYS 25 3HZ LYS 25 7.169 5.652 -8.174
166 HZ2 LYS 25 1HZ LYS 25 7.863 6.661 -7.007
167 HZ3 LYS 25 2HZ LYS 25 7.935 7.086 -8.643
168 H SER 26 H SER 26 5.181 6.536 -3.241
169 HA SER 26 HA SER 26 6.884 4.424 -3.326
170 HB2 SER 26 1HB SER 26 6.314 6.307 -1.035
171 HB3 SER 26 2HB SER 26 7.643 5.148 -1.006
172 HG SER 26 HG SER 26 8.712 6.328 -2.400
173 H GLN 27 H GLN 27 4.352 4.876 -0.862
174 HA GLN 27 HA GLN 27 4.716 2.630 0.653
175 HB2 GLN 27 1HB GLN 27 2.105 3.880 -0.213
176 HB3 GLN 27 2HB GLN 27 2.251 2.688 1.071
177 HG2 GLN 27 1HG GLN 27 3.605 5.375 1.055
178 HG3 GLN 27 2HG GLN 27 2.104 5.000 1.900
179 HE21 GLN 27 1HE2 GLN 27 5.207 5.523 2.437
180 HE22 GLN 27 2HE2 GLN 27 5.494 4.483 3.786
181 H LEU 28 H LEU 28 2.809 2.860 -2.340
182 HA LEU 28 HA LEU 28 1.968 0.192 -2.429
183 HB2 LEU 28 1HB LEU 28 0.999 1.946 -3.816
184 HB3 LEU 28 2HB LEU 28 2.515 2.098 -4.701
185 HG LEU 28 HG LEU 28 2.196 -0.246 -5.503
186 HD11 LEU 28 1HD1 LEU 28 0.335 -0.422 -3.512
187 HD12 LEU 28 2HD1 LEU 28 0.487 -1.539 -4.868
188 HD13 LEU 28 3HD1 LEU 28 -0.672 -0.212 -4.945
189 HD21 LEU 28 3HD2 LEU 28 -0.160 1.459 -6.245
190 HD22 LEU 28 1HD2 LEU 28 0.781 0.367 -7.262
191 HD23 LEU 28 2HD2 LEU 28 1.485 1.890 -6.716
192 H HIS 29 H HIS 29 4.772 1.751 -3.968
193 HA HIS 29 HA HIS 29 5.837 -0.366 -5.344
194 HB2 HIS 29 1HB HIS 29 7.171 1.886 -3.856
195 HB3 HIS 29 2HB HIS 29 8.107 0.701 -4.762
196 HD2 HIS 29 HD2 HIS 29 4.773 2.087 -6.256
197 HE1 HIS 29 HE1 HIS 29 8.021 3.642 -8.499
198 HE2 HIS 29 HE2 HIS 29 5.515 3.506 -8.288
199 H VAL 30 H VAL 30 6.583 0.486 -1.962
200 HA VAL 30 HA VAL 30 8.179 -1.785 -1.457
201 HB VAL 30 HB VAL 30 6.633 -0.081 0.502
202 HG11 VAL 30 1HG1 VAL 30 7.673 -1.129 2.233
203 HG12 VAL 30 2HG1 VAL 30 7.607 -2.482 1.102
204 HG13 VAL 30 3HG1 VAL 30 9.093 -1.546 1.275
205 HG21 VAL 30 3HG2 VAL 30 8.155 1.498 0.152
206 HG22 VAL 30 1HG2 VAL 30 9.445 0.362 0.549
207 HG23 VAL 30 2HG2 VAL 30 8.882 0.510 -1.116
208 H HIS 31 H HIS 31 4.745 -1.121 -0.882
209 HA HIS 31 HA HIS 31 4.056 -3.393 0.540
210 HB2 HIS 31 1HB HIS 31 2.312 -1.894 0.405
211 HB3 HIS 31 2HB HIS 31 2.584 -1.567 -1.304
212 HD1 HIS 31 HD1 HIS 31 1.231 -4.358 0.892
213 HD2 HIS 31 HD2 HIS 31 0.852 -2.843 -2.958
214 HE1 HIS 31 HE1 HIS 31 -0.624 -5.681 -0.172
215 H GLN 32 H GLN 32 3.961 -2.949 -2.995
216 HA GLN 32 HA GLN 32 3.043 -5.321 -3.877
217 HB2 GLN 32 1HB GLN 32 5.392 -3.741 -4.916
218 HB3 GLN 32 2HB GLN 32 4.725 -5.126 -5.771
219 HG2 GLN 32 1HG GLN 32 2.531 -3.964 -5.818
220 HG3 GLN 32 2HG GLN 32 3.317 -2.552 -5.115
221 HE21 GLN 32 1HE2 GLN 32 2.000 -3.142 -7.766
222 HE22 GLN 32 2HE2 GLN 32 3.149 -2.603 -8.939
223 H GLN 33 H GLN 33 6.208 -4.753 -2.458
224 HA GLN 33 HA GLN 33 7.538 -7.075 -3.084
225 HB2 GLN 33 1HB GLN 33 7.556 -5.622 -0.433
226 HB3 GLN 33 2HB GLN 33 8.765 -6.785 -0.960
227 HG2 GLN 33 1HG GLN 33 9.359 -5.313 -2.823
228 HG3 GLN 33 2HG GLN 33 8.163 -4.142 -2.269
229 HE21 GLN 33 1HE2 GLN 33 11.068 -5.878 -1.262
230 HE22 GLN 33 2HE2 GLN 33 11.669 -4.633 -0.227
231 H ILE 34 H ILE 34 5.238 -6.553 -0.432
232 HA ILE 34 HA ILE 34 5.369 -8.910 0.921
233 HB ILE 34 HB ILE 34 3.781 -6.958 1.327
234 HG12 ILE 34 1HG1 ILE 34 2.359 -9.591 1.571
235 HG13 ILE 34 2HG1 ILE 34 3.849 -9.305 2.463
236 HG21 ILE 34 1HG2 ILE 34 2.790 -7.314 -1.048
237 HG22 ILE 34 2HG2 ILE 34 1.783 -8.522 -0.251
238 HG23 ILE 34 3HG2 ILE 34 1.726 -6.840 0.276
239 HD11 ILE 34 3HD1 ILE 34 2.014 -8.816 3.893
240 HD12 ILE 34 1HD1 ILE 34 2.781 -7.290 3.456
241 HD13 ILE 34 2HD1 ILE 34 1.273 -7.774 2.678
242 H HIS 35 H HIS 35 4.210 -8.421 -2.309
243 HA HIS 35 HA HIS 35 3.060 -11.101 -2.438
244 HB2 HIS 35 1HB HIS 35 3.238 -9.079 -4.672
245 HB3 HIS 35 2HB HIS 35 2.172 -10.477 -4.568
246 HD1 HIS 35 HD1 HIS 35 0.731 -10.189 -2.022
247 HD2 HIS 35 HD2 HIS 35 1.722 -6.880 -4.331
248 HE1 HIS 35 HE1 HIS 35 -0.866 -8.378 -1.321
249 H THR 36 H THR 36 5.772 -11.133 -1.953
250 HA THR 36 HA THR 36 6.977 -11.823 -4.545
251 HB THR 36 HB THR 36 8.232 -10.174 -3.216
252 HG1 THR 36 HG1 THR 36 9.716 -12.580 -3.130
253 HG21 THR 36 3HG2 THR 36 8.664 -10.396 -1.030
254 HG22 THR 36 1HG2 THR 36 9.211 -12.061 -1.225
255 HG23 THR 36 2HG2 THR 36 7.491 -11.712 -1.045
256 H GLY 37 H GLY 37 5.121 -13.608 -3.420
257 HA2 GLY 37 1HA GLY 37 6.896 -15.898 -2.921
258 HA3 GLY 37 2HA GLY 37 5.549 -15.609 -1.830
259 H GLU 38 H GLU 38 3.368 -15.487 -2.883
260 HA GLU 38 HA GLU 38 2.809 -17.845 -4.250
261 HB2 GLU 38 1HB GLU 38 1.220 -15.295 -3.978
262 HB3 GLU 38 2HB GLU 38 0.581 -16.740 -4.751
263 HG2 GLU 38 1HG GLU 38 0.555 -17.944 -2.765
264 HG3 GLU 38 2HG GLU 38 1.689 -16.850 -1.975
265 H LYS 39 H LYS 39 2.914 -18.441 -6.315
266 HA LYS 39 HA LYS 39 3.115 -16.348 -8.377
267 HB2 LYS 39 1HB LYS 39 4.735 -17.784 -9.581
268 HB3 LYS 39 2HB LYS 39 5.341 -17.231 -8.025
269 HG2 LYS 39 1HG LYS 39 4.547 -19.468 -7.105
270 HG3 LYS 39 2HG LYS 39 4.384 -19.968 -8.790
271 HD2 LYS 39 1HD LYS 39 6.941 -18.733 -7.866
272 HD3 LYS 39 2HD LYS 39 6.605 -20.423 -7.480
273 HE2 LYS 39 1HE LYS 39 6.183 -20.809 -9.912
274 HE3 LYS 39 2HE LYS 39 6.735 -19.163 -10.215
275 HZ1 LYS 39 3HZ LYS 39 8.887 -19.690 -9.688
276 HZ2 LYS 39 1HZ LYS 39 8.381 -21.146 -10.385
277 HZ3 LYS 39 2HZ LYS 39 8.460 -20.997 -8.702
278 HA PRO 40 HA PRO 40 -0.145 -18.514 -10.390
279 HB2 PRO 40 1HB PRO 40 0.250 -17.636 -12.928
280 HB3 PRO 40 2HB PRO 40 -0.426 -16.616 -11.653
281 HG2 PRO 40 1HG PRO 40 2.378 -16.736 -12.695
282 HG3 PRO 40 2HG PRO 40 1.396 -15.317 -12.288
283 HD2 PRO 40 1HD PRO 40 3.295 -16.299 -10.627
284 HD3 PRO 40 2HD PRO 40 1.818 -15.516 -10.031
285 H SER 41 H SER 41 3.165 -18.818 -11.477
286 HA SER 41 HA SER 41 2.587 -21.071 -13.201
287 HB2 SER 41 1HB SER 41 5.025 -21.121 -13.574
288 HB3 SER 41 2HB SER 41 4.366 -19.505 -13.827
289 HG SER 41 HG SER 41 5.945 -19.006 -12.504
290 H GLY 42 H GLY 42 2.708 -23.168 -12.672
291 HA2 GLY 42 1HA GLY 42 3.208 -23.853 -9.896
292 HA3 GLY 42 2HA GLY 42 2.590 -24.927 -11.143
293 HA PRO 43 HA PRO 43 6.515 -26.792 -11.681
294 HB2 PRO 43 1HB PRO 43 6.774 -27.003 -14.375
295 HB3 PRO 43 2HB PRO 43 5.640 -27.984 -13.440
296 HG2 PRO 43 1HG PRO 43 5.129 -25.505 -15.037
297 HG3 PRO 43 2HG PRO 43 4.172 -26.995 -14.948
298 HD2 PRO 43 1HD PRO 43 3.509 -24.754 -13.580
299 HD3 PRO 43 2HD PRO 43 3.173 -26.384 -12.962
300 H SER 44 H SER 44 8.660 -26.314 -11.875
301 HA SER 44 HA SER 44 9.342 -23.570 -12.461
302 HB2 SER 44 1HB SER 44 11.590 -24.194 -11.666
303 HB3 SER 44 2HB SER 44 10.344 -24.695 -10.523
304 HG SER 44 HG SER 44 11.823 -26.372 -10.858
305 H SER 45 H SER 45 9.585 -22.986 -14.515
306 HA SER 45 HA SER 45 9.991 -24.577 -16.715
307 HB2 SER 45 1HB SER 45 10.868 -21.719 -16.257
308 HB3 SER 45 2HB SER 45 10.891 -22.511 -17.832
309 HG SER 45 HG SER 45 8.955 -21.497 -17.729
310 H GLY 46 H GLY 46 11.783 -25.169 -17.972
311 HA2 GLY 46 1HA GLY 46 14.129 -25.811 -16.445
312 HA3 GLY 46 2HA GLY 46 13.847 -26.195 -18.136
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -21.745 6.965 -25.109
2 HA2 GLY 1 1HA GLY 1 -21.198 5.259 -23.201
3 HA3 GLY 1 2HA GLY 1 -19.683 5.150 -24.085
4 H SER 2 H SER 2 -21.853 7.696 -22.845
5 HA SER 2 HA SER 2 -19.569 9.409 -22.322
6 HB2 SER 2 1HB SER 2 -21.803 10.223 -23.247
7 HB3 SER 2 2HB SER 2 -22.450 9.984 -21.624
8 HG SER 2 HG SER 2 -21.766 11.999 -21.471
9 H SER 3 H SER 3 -18.457 8.436 -20.650
10 HA SER 3 HA SER 3 -19.629 8.796 -18.018
11 HB2 SER 3 1HB SER 3 -18.464 6.115 -18.800
12 HB3 SER 3 2HB SER 3 -19.176 6.550 -17.246
13 HG SER 3 HG SER 3 -21.130 7.018 -18.606
14 H GLY 4 H GLY 4 -18.171 10.018 -17.026
15 HA2 GLY 4 1HA GLY 4 -15.317 9.334 -17.381
16 HA3 GLY 4 2HA GLY 4 -15.885 10.993 -17.273
17 H SER 5 H SER 5 -13.980 10.484 -15.576
18 HA SER 5 HA SER 5 -15.359 10.286 -12.996
19 HB2 SER 5 1HB SER 5 -13.039 8.644 -13.928
20 HB3 SER 5 2HB SER 5 -13.120 9.113 -12.230
21 HG SER 5 HG SER 5 -14.149 7.083 -12.711
22 H SER 6 H SER 6 -14.938 11.994 -11.773
23 HA SER 6 HA SER 6 -12.303 13.208 -11.764
24 HB2 SER 6 1HB SER 6 -13.262 15.500 -12.160
25 HB3 SER 6 2HB SER 6 -13.289 14.448 -13.575
26 HG SER 6 HG SER 6 -15.506 14.638 -11.839
27 H GLY 7 H GLY 7 -11.979 14.672 -9.993
28 HA2 GLY 7 1HA GLY 7 -12.697 15.754 -7.995
29 HA3 GLY 7 2HA GLY 7 -14.114 14.714 -7.977
30 H THR 8 H THR 8 -11.971 15.317 -5.953
31 HA THR 8 HA THR 8 -10.326 13.074 -5.581
32 HB THR 8 HB THR 8 -9.939 15.163 -4.374
33 HG1 THR 8 HG1 THR 8 -10.529 13.343 -2.318
34 HG21 THR 8 3HG2 THR 8 -12.146 14.570 -2.462
35 HG22 THR 8 1HG2 THR 8 -12.540 15.386 -3.974
36 HG23 THR 8 2HG2 THR 8 -11.381 16.108 -2.858
37 H GLY 9 H GLY 9 -10.757 11.056 -4.969
38 HA2 GLY 9 1HA GLY 9 -12.852 10.447 -3.092
39 HA3 GLY 9 2HA GLY 9 -13.222 9.923 -4.728
40 H GLU 10 H GLU 10 -11.953 8.292 -5.696
41 HA GLU 10 HA GLU 10 -11.014 6.327 -3.849
42 HB2 GLU 10 1HB GLU 10 -10.722 4.909 -5.736
43 HB3 GLU 10 2HB GLU 10 -12.174 5.853 -6.038
44 HG2 GLU 10 1HG GLU 10 -9.510 6.692 -7.117
45 HG3 GLU 10 2HG GLU 10 -10.528 5.526 -7.961
46 H LYS 11 H LYS 11 -8.933 5.523 -3.570
47 HA LYS 11 HA LYS 11 -6.848 7.381 -3.523
48 HB2 LYS 11 1HB LYS 11 -7.047 4.428 -3.165
49 HB3 LYS 11 2HB LYS 11 -5.447 5.126 -3.378
50 HG2 LYS 11 1HG LYS 11 -5.638 5.154 -1.100
51 HG3 LYS 11 2HG LYS 11 -6.236 6.766 -1.501
52 HD2 LYS 11 1HD LYS 11 -8.481 6.122 -1.192
53 HD3 LYS 11 2HD LYS 11 -8.075 4.405 -1.213
54 HE2 LYS 11 1HE LYS 11 -8.505 4.998 1.049
55 HE3 LYS 11 2HE LYS 11 -6.762 4.788 0.889
56 HZ1 LYS 11 3HZ LYS 11 -7.380 7.463 0.349
57 HZ2 LYS 11 1HZ LYS 11 -6.484 6.836 1.639
58 HZ3 LYS 11 2HZ LYS 11 -8.156 7.038 1.791
59 HA PRO 12 HA PRO 12 -5.256 7.391 -7.623
60 HB2 PRO 12 1HB PRO 12 -2.686 8.098 -7.109
61 HB3 PRO 12 2HB PRO 12 -4.036 9.233 -6.991
62 HG2 PRO 12 1HG PRO 12 -2.636 7.722 -4.819
63 HG3 PRO 12 2HG PRO 12 -3.165 9.414 -4.842
64 HD2 PRO 12 1HD PRO 12 -4.565 7.468 -3.584
65 HD3 PRO 12 2HD PRO 12 -5.348 8.870 -4.341
66 H TYR 13 H TYR 13 -3.167 5.811 -5.206
67 HA TYR 13 HA TYR 13 -2.265 3.933 -7.271
68 HB2 TYR 13 1HB TYR 13 -1.143 4.149 -4.485
69 HB3 TYR 13 2HB TYR 13 -0.380 3.477 -5.922
70 HD1 TYR 13 HD1 TYR 13 0.436 5.003 -7.711
71 HD2 TYR 13 HD2 TYR 13 -1.007 6.473 -3.989
72 HE1 TYR 13 HE1 TYR 13 1.525 7.165 -8.150
73 HE2 TYR 13 HE2 TYR 13 0.077 8.639 -4.417
74 HH TYR 13 HH TYR 13 2.428 9.131 -6.533
75 H GLU 14 H GLU 14 -3.049 1.938 -7.335
76 HA GLU 14 HA GLU 14 -4.027 0.690 -4.873
77 HB2 GLU 14 1HB GLU 14 -5.979 1.699 -6.010
78 HB3 GLU 14 2HB GLU 14 -5.606 0.761 -7.450
79 HG2 GLU 14 1HG GLU 14 -5.759 -1.253 -5.758
80 HG3 GLU 14 2HG GLU 14 -6.758 -0.113 -4.858
81 H CYS 15 H CYS 15 -3.559 -1.433 -4.712
82 HA CYS 15 HA CYS 15 -1.821 -2.592 -6.678
83 HB2 CYS 15 1HB CYS 15 -1.367 -3.019 -4.348
84 HB3 CYS 15 2HB CYS 15 -2.981 -3.680 -4.108
85 H SER 16 H SER 16 -2.158 -4.650 -7.711
86 HA SER 16 HA SER 16 -4.988 -5.093 -8.381
87 HB2 SER 16 1HB SER 16 -4.219 -5.997 -10.506
88 HB3 SER 16 2HB SER 16 -3.509 -4.402 -10.256
89 HG SER 16 HG SER 16 -2.144 -6.749 -9.491
90 H ILE 17 H ILE 17 -2.053 -6.613 -7.270
91 HA ILE 17 HA ILE 17 -2.729 -9.303 -7.594
92 HB ILE 17 HB ILE 17 -1.064 -8.005 -5.435
93 HG12 ILE 17 1HG1 ILE 17 0.006 -9.594 -7.736
94 HG13 ILE 17 2HG1 ILE 17 -0.474 -7.921 -7.997
95 HG21 ILE 17 1HG2 ILE 17 -1.645 -10.096 -4.551
96 HG22 ILE 17 2HG2 ILE 17 -1.527 -10.889 -6.121
97 HG23 ILE 17 3HG2 ILE 17 -0.066 -10.351 -5.294
98 HD11 ILE 17 3HD1 ILE 17 1.709 -9.002 -6.264
99 HD12 ILE 17 1HD1 ILE 17 1.797 -7.796 -7.547
100 HD13 ILE 17 2HD1 ILE 17 1.046 -7.389 -6.004
101 H CYS 18 H CYS 18 -3.100 -7.281 -4.675
102 HA CYS 18 HA CYS 18 -5.041 -9.227 -3.647
103 HB2 CYS 18 1HB CYS 18 -4.739 -8.008 -1.481
104 HB3 CYS 18 2HB CYS 18 -3.267 -8.756 -2.092
105 H GLY 19 H GLY 19 -4.619 -5.754 -4.237
106 HA2 GLY 19 1HA GLY 19 -6.493 -4.566 -5.263
107 HA3 GLY 19 2HA GLY 19 -7.562 -5.511 -4.237
108 H LYS 20 H LYS 20 -4.588 -4.184 -3.006
109 HA LYS 20 HA LYS 20 -6.053 -2.675 -1.031
110 HB2 LYS 20 1HB LYS 20 -3.189 -3.379 -1.495
111 HB3 LYS 20 2HB LYS 20 -3.554 -2.003 -0.463
112 HG2 LYS 20 1HG LYS 20 -4.985 -3.485 0.919
113 HG3 LYS 20 2HG LYS 20 -4.453 -4.848 -0.068
114 HD2 LYS 20 1HD LYS 20 -2.191 -4.573 0.639
115 HD3 LYS 20 2HD LYS 20 -2.561 -3.034 1.420
116 HE2 LYS 20 1HE LYS 20 -2.357 -4.777 3.086
117 HE3 LYS 20 2HE LYS 20 -4.027 -4.219 3.004
118 HZ1 LYS 20 3HZ LYS 20 -4.375 -6.444 2.968
119 HZ2 LYS 20 1HZ LYS 20 -2.889 -6.797 2.240
120 HZ3 LYS 20 2HZ LYS 20 -4.171 -6.213 1.304
121 H SER 21 H SER 21 -5.007 -0.414 -0.500
122 HA SER 21 HA SER 21 -4.512 1.114 -2.944
123 HB2 SER 21 1HB SER 21 -6.225 2.743 -2.463
124 HB3 SER 21 2HB SER 21 -6.979 1.149 -2.486
125 HG SER 21 HG SER 21 -7.725 2.116 -0.668
126 H PHE 22 H PHE 22 -3.209 2.869 -2.667
127 HA PHE 22 HA PHE 22 -2.521 3.676 0.065
128 HB2 PHE 22 1HB PHE 22 -0.419 3.142 -2.038
129 HB3 PHE 22 2HB PHE 22 -0.160 3.543 -0.343
130 HD1 PHE 22 HD1 PHE 22 -1.343 0.925 -2.653
131 HD2 PHE 22 HD2 PHE 22 -0.191 1.875 1.333
132 HE1 PHE 22 HE1 PHE 22 -1.288 -1.472 -2.101
133 HE2 PHE 22 HE2 PHE 22 -0.133 -0.520 1.891
134 HZ PHE 22 HZ PHE 22 -0.681 -2.197 0.173
135 H THR 23 H THR 23 -1.795 5.799 0.280
136 HA THR 23 HA THR 23 -2.408 7.510 -2.021
137 HB THR 23 HB THR 23 -2.164 9.313 -0.088
138 HG1 THR 23 HG1 THR 23 -1.597 7.424 1.367
139 HG21 THR 23 3HG2 THR 23 -4.283 9.457 -0.785
140 HG22 THR 23 1HG2 THR 23 -4.685 8.310 0.492
141 HG23 THR 23 2HG2 THR 23 -4.358 7.732 -1.142
142 H LYS 24 H LYS 24 0.180 6.015 -1.390
143 HA LYS 24 HA LYS 24 1.934 8.269 -1.987
144 HB2 LYS 24 1HB LYS 24 2.156 6.495 0.409
145 HB3 LYS 24 2HB LYS 24 3.629 7.066 -0.363
146 HG2 LYS 24 1HG LYS 24 3.343 8.720 1.164
147 HG3 LYS 24 2HG LYS 24 2.404 9.399 -0.167
148 HD2 LYS 24 1HD LYS 24 0.935 9.646 1.589
149 HD3 LYS 24 2HD LYS 24 0.434 8.082 0.942
150 HE2 LYS 24 1HE LYS 24 0.559 7.796 3.278
151 HE3 LYS 24 2HE LYS 24 2.011 7.037 2.627
152 HZ1 LYS 24 3HZ LYS 24 2.717 8.295 4.455
153 HZ2 LYS 24 1HZ LYS 24 1.780 9.636 4.023
154 HZ3 LYS 24 2HZ LYS 24 3.144 9.227 3.109
155 H LYS 25 H LYS 25 2.798 7.725 -3.873
156 HA LYS 25 HA LYS 25 2.850 5.377 -5.186
157 HB2 LYS 25 1HB LYS 25 3.698 7.546 -6.069
158 HB3 LYS 25 2HB LYS 25 5.181 7.302 -5.157
159 HG2 LYS 25 1HG LYS 25 5.851 6.512 -7.175
160 HG3 LYS 25 2HG LYS 25 5.204 5.020 -6.489
161 HD2 LYS 25 1HD LYS 25 4.203 5.030 -8.563
162 HD3 LYS 25 2HD LYS 25 2.972 5.837 -7.588
163 HE2 LYS 25 1HE LYS 25 3.543 7.952 -8.421
164 HE3 LYS 25 2HE LYS 25 5.095 7.387 -9.038
165 HZ1 LYS 25 3HZ LYS 25 2.469 6.502 -10.100
166 HZ2 LYS 25 1HZ LYS 25 3.995 6.173 -10.751
167 HZ3 LYS 25 2HZ LYS 25 3.388 7.751 -10.774
168 H SER 26 H SER 26 5.231 6.393 -2.771
169 HA SER 26 HA SER 26 6.958 4.192 -3.018
170 HB2 SER 26 1HB SER 26 7.838 4.851 -0.842
171 HB3 SER 26 2HB SER 26 7.538 6.286 -1.821
172 HG SER 26 HG SER 26 6.598 6.804 0.046
173 H GLN 27 H GLN 27 4.129 4.730 -0.961
174 HA GLN 27 HA GLN 27 4.281 2.459 0.626
175 HB2 GLN 27 1HB GLN 27 1.943 4.054 -0.394
176 HB3 GLN 27 2HB GLN 27 1.713 2.657 0.650
177 HG2 GLN 27 1HG GLN 27 3.470 4.979 1.388
178 HG3 GLN 27 2HG GLN 27 1.754 4.899 1.786
179 HE21 GLN 27 1HE2 GLN 27 2.539 5.062 3.993
180 HE22 GLN 27 2HE2 GLN 27 3.041 3.628 4.816
181 H LEU 28 H LEU 28 2.742 2.863 -2.548
182 HA LEU 28 HA LEU 28 1.755 0.227 -2.746
183 HB2 LEU 28 1HB LEU 28 0.903 2.024 -4.129
184 HB3 LEU 28 2HB LEU 28 2.479 2.212 -4.895
185 HG LEU 28 HG LEU 28 2.125 -0.236 -5.668
186 HD11 LEU 28 1HD1 LEU 28 -0.146 -0.942 -5.912
187 HD12 LEU 28 2HD1 LEU 28 -0.744 0.568 -5.225
188 HD13 LEU 28 3HD1 LEU 28 0.135 -0.576 -4.210
189 HD21 LEU 28 3HD2 LEU 28 2.099 1.892 -7.042
190 HD22 LEU 28 1HD2 LEU 28 0.342 1.847 -6.900
191 HD23 LEU 28 2HD2 LEU 28 1.196 0.526 -7.698
192 H HIS 29 H HIS 29 4.616 1.726 -4.262
193 HA HIS 29 HA HIS 29 5.670 -0.493 -5.503
194 HB2 HIS 29 1HB HIS 29 6.965 1.918 -4.260
195 HB3 HIS 29 2HB HIS 29 7.942 0.655 -5.003
196 HD2 HIS 29 HD2 HIS 29 4.625 1.633 -6.776
197 HE1 HIS 29 HE1 HIS 29 7.854 3.236 -9.013
198 HE2 HIS 29 HE2 HIS 29 5.361 2.893 -8.912
199 H VAL 30 H VAL 30 6.240 0.587 -2.165
200 HA VAL 30 HA VAL 30 7.971 -1.555 -1.487
201 HB VAL 30 HB VAL 30 6.313 0.233 0.296
202 HG11 VAL 30 1HG1 VAL 30 8.459 -0.602 1.773
203 HG12 VAL 30 2HG1 VAL 30 6.825 -1.259 1.886
204 HG13 VAL 30 3HG1 VAL 30 8.031 -2.058 0.876
205 HG21 VAL 30 3HG2 VAL 30 7.854 1.801 -0.034
206 HG22 VAL 30 1HG2 VAL 30 9.144 0.675 0.389
207 HG23 VAL 30 2HG2 VAL 30 8.575 0.779 -1.277
208 H HIS 31 H HIS 31 4.492 -1.088 -1.290
209 HA HIS 31 HA HIS 31 3.867 -3.280 0.346
210 HB2 HIS 31 1HB HIS 31 2.069 -1.859 0.080
211 HB3 HIS 31 2HB HIS 31 2.365 -1.633 -1.641
212 HD1 HIS 31 HD1 HIS 31 1.101 -4.345 0.703
213 HD2 HIS 31 HD2 HIS 31 0.714 -3.078 -3.235
214 HE1 HIS 31 HE1 HIS 31 -0.673 -5.815 -0.305
215 H GLN 32 H GLN 32 4.074 -3.013 -3.189
216 HA GLN 32 HA GLN 32 3.218 -5.471 -3.991
217 HB2 GLN 32 1HB GLN 32 5.568 -3.876 -5.016
218 HB3 GLN 32 2HB GLN 32 4.933 -5.297 -5.835
219 HG2 GLN 32 1HG GLN 32 2.679 -4.035 -5.766
220 HG3 GLN 32 2HG GLN 32 3.677 -2.613 -5.465
221 HE21 GLN 32 1HE2 GLN 32 2.882 -1.792 -7.468
222 HE22 GLN 32 2HE2 GLN 32 3.568 -2.321 -8.962
223 H GLN 33 H GLN 33 6.195 -4.706 -2.334
224 HA GLN 33 HA GLN 33 7.682 -6.998 -2.820
225 HB2 GLN 33 1HB GLN 33 7.517 -5.355 -0.288
226 HB3 GLN 33 2HB GLN 33 8.769 -6.540 -0.633
227 HG2 GLN 33 1HG GLN 33 9.095 -5.086 -2.795
228 HG3 GLN 33 2HG GLN 33 8.332 -3.844 -1.803
229 HE21 GLN 33 1HE2 GLN 33 9.686 -2.616 -0.729
230 HE22 GLN 33 2HE2 GLN 33 11.259 -3.067 -0.174
231 H ILE 34 H ILE 34 5.117 -6.437 -0.458
232 HA ILE 34 HA ILE 34 5.317 -8.718 1.079
233 HB ILE 34 HB ILE 34 3.682 -6.805 1.375
234 HG12 ILE 34 1HG1 ILE 34 2.412 -9.536 1.580
235 HG13 ILE 34 2HG1 ILE 34 3.699 -9.000 2.655
236 HG21 ILE 34 1HG2 ILE 34 2.036 -6.465 -0.077
237 HG22 ILE 34 2HG2 ILE 34 2.743 -7.719 -1.094
238 HG23 ILE 34 3HG2 ILE 34 1.490 -8.135 0.075
239 HD11 ILE 34 3HD1 ILE 34 1.878 -8.475 3.910
240 HD12 ILE 34 1HD1 ILE 34 2.075 -6.963 3.024
241 HD13 ILE 34 2HD1 ILE 34 0.866 -8.139 2.505
242 H HIS 35 H HIS 35 4.322 -8.408 -2.217
243 HA HIS 35 HA HIS 35 3.133 -11.063 -2.289
244 HB2 HIS 35 1HB HIS 35 3.537 -8.972 -4.436
245 HB3 HIS 35 2HB HIS 35 2.773 -10.535 -4.712
246 HD1 HIS 35 HD1 HIS 35 0.696 -10.893 -2.765
247 HD2 HIS 35 HD2 HIS 35 1.663 -7.075 -4.086
248 HE1 HIS 35 HE1 HIS 35 -1.322 -9.478 -2.266
249 H THR 36 H THR 36 5.929 -9.352 -3.642
250 HA THR 36 HA THR 36 7.020 -11.905 -4.585
251 HB THR 36 HB THR 36 7.213 -10.388 -6.334
252 HG1 THR 36 HG1 THR 36 9.273 -11.310 -5.825
253 HG21 THR 36 3HG2 THR 36 8.004 -8.056 -6.054
254 HG22 THR 36 1HG2 THR 36 8.049 -8.308 -4.309
255 HG23 THR 36 2HG2 THR 36 6.512 -8.383 -5.172
256 H GLY 37 H GLY 37 7.524 -12.633 -2.419
257 HA2 GLY 37 1HA GLY 37 9.848 -11.247 -1.236
258 HA3 GLY 37 2HA GLY 37 8.711 -12.232 -0.326
259 H GLU 38 H GLU 38 10.796 -12.606 -3.200
260 HA GLU 38 HA GLU 38 11.689 -15.177 -2.069
261 HB2 GLU 38 1HB GLU 38 11.104 -14.416 -4.924
262 HB3 GLU 38 2HB GLU 38 12.103 -15.804 -4.518
263 HG2 GLU 38 1HG GLU 38 10.217 -16.721 -3.205
264 HG3 GLU 38 2HG GLU 38 9.224 -15.374 -3.759
265 H LYS 39 H LYS 39 13.499 -14.285 -1.069
266 HA LYS 39 HA LYS 39 15.332 -12.531 -2.250
267 HB2 LYS 39 1HB LYS 39 16.881 -13.231 -0.495
268 HB3 LYS 39 2HB LYS 39 15.268 -12.983 0.160
269 HG2 LYS 39 1HG LYS 39 14.903 -15.435 0.044
270 HG3 LYS 39 2HG LYS 39 16.584 -15.618 -0.461
271 HD2 LYS 39 1HD LYS 39 17.224 -14.398 1.655
272 HD3 LYS 39 2HD LYS 39 15.542 -14.565 2.162
273 HE2 LYS 39 1HE LYS 39 17.088 -16.966 1.274
274 HE3 LYS 39 2HE LYS 39 17.307 -16.331 2.904
275 HZ1 LYS 39 3HZ LYS 39 14.671 -17.066 1.757
276 HZ2 LYS 39 1HZ LYS 39 15.006 -16.650 3.363
277 HZ3 LYS 39 2HZ LYS 39 15.600 -18.098 2.723
278 HA PRO 40 HA PRO 40 17.488 -15.018 -5.171
279 HB2 PRO 40 1HB PRO 40 19.841 -13.667 -5.251
280 HB3 PRO 40 2HB PRO 40 18.355 -13.052 -5.984
281 HG2 PRO 40 1HG PRO 40 19.596 -12.358 -3.349
282 HG3 PRO 40 2HG PRO 40 18.866 -11.286 -4.559
283 HD2 PRO 40 1HD PRO 40 17.552 -12.070 -2.325
284 HD3 PRO 40 2HD PRO 40 16.719 -11.753 -3.860
285 H SER 41 H SER 41 19.782 -16.004 -5.440
286 HA SER 41 HA SER 41 20.216 -17.748 -3.244
287 HB2 SER 41 1HB SER 41 20.649 -18.596 -5.435
288 HB3 SER 41 2HB SER 41 21.755 -17.272 -5.801
289 HG SER 41 HG SER 41 22.319 -18.918 -3.610
290 H GLY 42 H GLY 42 21.213 -17.228 -1.418
291 HA2 GLY 42 1HA GLY 42 22.976 -16.574 -0.057
292 HA3 GLY 42 2HA GLY 42 23.813 -15.972 -1.481
293 HA PRO 43 HA PRO 43 20.767 -12.525 0.105
294 HB2 PRO 43 1HB PRO 43 20.039 -12.776 2.708
295 HB3 PRO 43 2HB PRO 43 19.090 -13.448 1.377
296 HG2 PRO 43 1HG PRO 43 21.040 -14.814 3.192
297 HG3 PRO 43 2HG PRO 43 19.455 -15.374 2.627
298 HD2 PRO 43 1HD PRO 43 21.778 -16.232 1.532
299 HD3 PRO 43 2HD PRO 43 20.284 -16.061 0.589
300 H SER 44 H SER 44 22.864 -14.009 2.567
301 HA SER 44 HA SER 44 24.482 -13.143 3.921
302 HB2 SER 44 1HB SER 44 25.326 -12.779 1.459
303 HB3 SER 44 2HB SER 44 25.078 -11.074 1.835
304 HG SER 44 HG SER 44 26.350 -11.848 3.873
305 H SER 45 H SER 45 21.997 -12.163 4.550
306 HA SER 45 HA SER 45 21.368 -9.563 4.618
307 HB2 SER 45 1HB SER 45 20.178 -11.359 5.877
308 HB3 SER 45 2HB SER 45 21.427 -11.269 7.119
309 HG SER 45 HG SER 45 20.116 -9.819 7.920
310 H GLY 46 H GLY 46 22.611 -7.821 4.795
311 HA2 GLY 46 1HA GLY 46 24.206 -7.440 7.185
312 HA3 GLY 46 2HA GLY 46 25.131 -7.520 5.693
Start of MODEL 3
1 H1 GLY 1 H GLY 1 -27.739 -6.998 -2.382
2 HA2 GLY 1 1HA GLY 1 -28.659 -9.425 -2.111
3 HA3 GLY 1 2HA GLY 1 -29.321 -9.086 -3.703
4 H SER 2 H SER 2 -27.346 -7.814 -5.005
5 HA SER 2 HA SER 2 -25.209 -9.836 -5.052
6 HB2 SER 2 1HB SER 2 -26.289 -8.044 -7.237
7 HB3 SER 2 2HB SER 2 -24.858 -9.059 -7.420
8 HG SER 2 HG SER 2 -26.534 -10.735 -6.564
9 H SER 3 H SER 3 -23.042 -9.141 -5.523
10 HA SER 3 HA SER 3 -22.363 -6.353 -5.396
11 HB2 SER 3 1HB SER 3 -22.833 -7.004 -2.987
12 HB3 SER 3 2HB SER 3 -21.437 -8.076 -3.092
13 HG SER 3 HG SER 3 -20.928 -5.989 -2.243
14 H GLY 4 H GLY 4 -20.205 -5.945 -5.937
15 HA2 GLY 4 1HA GLY 4 -18.096 -7.732 -5.998
16 HA3 GLY 4 2HA GLY 4 -18.959 -7.966 -7.511
17 H SER 5 H SER 5 -17.749 -7.046 -9.039
18 HA SER 5 HA SER 5 -15.940 -4.973 -8.738
19 HB2 SER 5 1HB SER 5 -16.099 -4.699 -11.201
20 HB3 SER 5 2HB SER 5 -15.959 -6.390 -10.720
21 HG SER 5 HG SER 5 -18.075 -5.043 -11.896
22 H SER 6 H SER 6 -16.481 -3.102 -7.783
23 HA SER 6 HA SER 6 -18.594 -1.504 -9.051
24 HB2 SER 6 1HB SER 6 -19.253 -0.651 -6.809
25 HB3 SER 6 2HB SER 6 -19.561 -2.377 -6.998
26 HG SER 6 HG SER 6 -18.565 -2.144 -5.049
27 H GLY 7 H GLY 7 -16.960 -0.370 -10.163
28 HA2 GLY 7 1HA GLY 7 -15.606 1.469 -10.447
29 HA3 GLY 7 2HA GLY 7 -15.960 1.905 -8.781
30 H THR 8 H THR 8 -13.433 2.043 -10.261
31 HA THR 8 HA THR 8 -11.784 0.001 -8.993
32 HB THR 8 HB THR 8 -10.747 2.265 -10.683
33 HG1 THR 8 HG1 THR 8 -12.552 0.767 -11.588
34 HG21 THR 8 3HG2 THR 8 -9.699 -0.524 -10.700
35 HG22 THR 8 1HG2 THR 8 -9.344 0.500 -9.310
36 HG23 THR 8 2HG2 THR 8 -8.845 1.003 -10.925
37 H GLY 9 H GLY 9 -12.927 1.519 -7.066
38 HA2 GLY 9 1HA GLY 9 -12.452 2.799 -5.221
39 HA3 GLY 9 2HA GLY 9 -10.769 2.408 -5.545
40 H GLU 10 H GLU 10 -11.530 4.841 -4.445
41 HA GLU 10 HA GLU 10 -11.158 6.725 -6.677
42 HB2 GLU 10 1HB GLU 10 -12.565 6.933 -4.053
43 HB3 GLU 10 2HB GLU 10 -11.845 8.386 -4.731
44 HG2 GLU 10 1HG GLU 10 -13.133 7.909 -6.837
45 HG3 GLU 10 2HG GLU 10 -13.988 6.660 -5.933
46 H LYS 11 H LYS 11 -8.959 5.295 -5.734
47 HA LYS 11 HA LYS 11 -7.447 7.379 -4.299
48 HB2 LYS 11 1HB LYS 11 -6.847 4.417 -4.327
49 HB3 LYS 11 2HB LYS 11 -6.033 5.650 -3.373
50 HG2 LYS 11 1HG LYS 11 -8.962 5.324 -3.019
51 HG3 LYS 11 2HG LYS 11 -7.893 4.092 -2.343
52 HD2 LYS 11 1HD LYS 11 -7.970 5.529 -0.572
53 HD3 LYS 11 2HD LYS 11 -6.607 6.230 -1.447
54 HE2 LYS 11 1HE LYS 11 -7.839 8.117 -1.103
55 HE3 LYS 11 2HE LYS 11 -8.539 7.592 -2.634
56 HZ1 LYS 11 3HZ LYS 11 -10.417 6.740 -1.555
57 HZ2 LYS 11 1HZ LYS 11 -10.141 8.233 -0.807
58 HZ3 LYS 11 2HZ LYS 11 -9.693 6.801 -0.027
59 HA PRO 12 HA PRO 12 -4.780 7.737 -7.771
60 HB2 PRO 12 1HB PRO 12 -2.449 8.403 -6.549
61 HB3 PRO 12 2HB PRO 12 -3.815 9.517 -6.684
62 HG2 PRO 12 1HG PRO 12 -2.980 7.818 -4.366
63 HG3 PRO 12 2HG PRO 12 -3.531 9.503 -4.377
64 HD2 PRO 12 1HD PRO 12 -5.154 7.444 -3.700
65 HD3 PRO 12 2HD PRO 12 -5.754 8.907 -4.506
66 H TYR 13 H TYR 13 -3.925 5.582 -5.158
67 HA TYR 13 HA TYR 13 -2.443 3.920 -7.077
68 HB2 TYR 13 1HB TYR 13 -1.602 4.145 -4.195
69 HB3 TYR 13 2HB TYR 13 -0.701 3.474 -5.550
70 HD1 TYR 13 HD1 TYR 13 0.337 4.982 -7.213
71 HD2 TYR 13 HD2 TYR 13 -1.568 6.489 -3.720
72 HE1 TYR 13 HE1 TYR 13 1.463 7.144 -7.539
73 HE2 TYR 13 HE2 TYR 13 -0.449 8.656 -4.037
74 HH TYR 13 HH TYR 13 2.058 9.101 -6.402
75 H GLU 14 H GLU 14 -3.237 1.933 -7.208
76 HA GLU 14 HA GLU 14 -4.402 0.671 -4.846
77 HB2 GLU 14 1HB GLU 14 -6.194 1.844 -6.264
78 HB3 GLU 14 2HB GLU 14 -5.881 0.599 -7.466
79 HG2 GLU 14 1HG GLU 14 -6.494 -1.125 -5.867
80 HG3 GLU 14 2HG GLU 14 -6.769 0.104 -4.633
81 H CYS 15 H CYS 15 -3.774 -1.380 -4.660
82 HA CYS 15 HA CYS 15 -2.124 -2.558 -6.695
83 HB2 CYS 15 1HB CYS 15 -1.569 -2.869 -4.341
84 HB3 CYS 15 2HB CYS 15 -3.117 -3.658 -4.057
85 H SER 16 H SER 16 -2.487 -4.564 -7.744
86 HA SER 16 HA SER 16 -5.337 -5.114 -8.195
87 HB2 SER 16 1HB SER 16 -2.898 -5.287 -9.902
88 HB3 SER 16 2HB SER 16 -4.207 -6.425 -10.219
89 HG SER 16 HG SER 16 -4.379 -3.592 -10.185
90 H ILE 17 H ILE 17 -2.297 -6.576 -7.272
91 HA ILE 17 HA ILE 17 -2.975 -9.276 -7.458
92 HB ILE 17 HB ILE 17 -1.161 -7.928 -5.454
93 HG12 ILE 17 1HG1 ILE 17 -0.332 -9.456 -7.911
94 HG13 ILE 17 2HG1 ILE 17 -0.719 -7.741 -7.995
95 HG21 ILE 17 1HG2 ILE 17 -1.531 -10.830 -6.162
96 HG22 ILE 17 2HG2 ILE 17 -0.113 -10.210 -5.318
97 HG23 ILE 17 3HG2 ILE 17 -1.709 -10.067 -4.582
98 HD11 ILE 17 3HD1 ILE 17 1.186 -8.529 -5.894
99 HD12 ILE 17 1HD1 ILE 17 1.744 -8.695 -7.559
100 HD13 ILE 17 2HD1 ILE 17 1.185 -7.130 -6.968
101 H CYS 18 H CYS 18 -3.057 -7.225 -4.536
102 HA CYS 18 HA CYS 18 -4.873 -9.148 -3.285
103 HB2 CYS 18 1HB CYS 18 -4.432 -7.894 -1.207
104 HB3 CYS 18 2HB CYS 18 -2.944 -8.457 -1.962
105 H GLY 19 H GLY 19 -4.654 -5.685 -4.043
106 HA2 GLY 19 1HA GLY 19 -6.629 -4.599 -4.970
107 HA3 GLY 19 2HA GLY 19 -7.600 -5.579 -3.881
108 H LYS 20 H LYS 20 -4.636 -4.067 -2.837
109 HA LYS 20 HA LYS 20 -6.114 -2.562 -0.847
110 HB2 LYS 20 1HB LYS 20 -3.250 -3.274 -1.292
111 HB3 LYS 20 2HB LYS 20 -3.616 -1.872 -0.296
112 HG2 LYS 20 1HG LYS 20 -5.152 -3.422 1.023
113 HG3 LYS 20 2HG LYS 20 -4.338 -4.742 0.181
114 HD2 LYS 20 1HD LYS 20 -2.161 -3.617 0.990
115 HD3 LYS 20 2HD LYS 20 -3.206 -2.759 2.125
116 HE2 LYS 20 1HE LYS 20 -3.960 -4.827 3.081
117 HE3 LYS 20 2HE LYS 20 -3.113 -5.759 1.847
118 HZ1 LYS 20 3HZ LYS 20 -1.174 -4.199 2.971
119 HZ2 LYS 20 1HZ LYS 20 -1.437 -5.841 3.281
120 HZ3 LYS 20 2HZ LYS 20 -2.120 -4.671 4.293
121 H SER 21 H SER 21 -5.165 -0.281 -0.372
122 HA SER 21 HA SER 21 -4.645 1.187 -2.853
123 HB2 SER 21 1HB SER 21 -6.379 2.783 -2.466
124 HB3 SER 21 2HB SER 21 -7.126 1.193 -2.317
125 HG SER 21 HG SER 21 -6.648 3.127 -0.382
126 H PHE 22 H PHE 22 -3.286 2.888 -2.630
127 HA PHE 22 HA PHE 22 -2.558 3.718 0.096
128 HB2 PHE 22 1HB PHE 22 -0.557 3.329 -2.133
129 HB3 PHE 22 2HB PHE 22 -0.219 3.698 -0.446
130 HD1 PHE 22 HD1 PHE 22 -1.590 1.092 -2.692
131 HD2 PHE 22 HD2 PHE 22 0.077 1.990 1.120
132 HE1 PHE 22 HE1 PHE 22 -1.409 -1.313 -2.209
133 HE2 PHE 22 HE2 PHE 22 0.262 -0.415 1.608
134 HZ PHE 22 HZ PHE 22 -0.480 -2.070 -0.057
135 H THR 23 H THR 23 -1.109 5.760 -0.041
136 HA THR 23 HA THR 23 -2.178 7.553 -2.122
137 HB THR 23 HB THR 23 -2.284 9.366 -0.498
138 HG1 THR 23 HG1 THR 23 -2.081 8.543 1.817
139 HG21 THR 23 3HG2 THR 23 -4.382 8.700 -0.161
140 HG22 THR 23 1HG2 THR 23 -3.829 7.700 1.181
141 HG23 THR 23 2HG2 THR 23 -3.922 7.021 -0.444
142 H LYS 24 H LYS 24 0.534 6.153 -0.893
143 HA LYS 24 HA LYS 24 2.232 8.348 -1.878
144 HB2 LYS 24 1HB LYS 24 2.855 6.491 0.425
145 HB3 LYS 24 2HB LYS 24 3.932 7.724 -0.217
146 HG2 LYS 24 1HG LYS 24 1.223 8.494 0.771
147 HG3 LYS 24 2HG LYS 24 2.532 8.198 1.918
148 HD2 LYS 24 1HD LYS 24 3.893 9.892 0.873
149 HD3 LYS 24 2HD LYS 24 2.694 10.119 -0.403
150 HE2 LYS 24 1HE LYS 24 1.141 11.077 1.098
151 HE3 LYS 24 2HE LYS 24 2.061 10.548 2.505
152 HZ1 LYS 24 3HZ LYS 24 2.959 12.579 0.533
153 HZ2 LYS 24 1HZ LYS 24 3.812 12.088 1.909
154 HZ3 LYS 24 2HZ LYS 24 2.345 12.914 2.073
155 H LYS 25 H LYS 25 3.230 7.749 -3.674
156 HA LYS 25 HA LYS 25 3.264 5.377 -4.940
157 HB2 LYS 25 1HB LYS 25 5.654 7.227 -4.828
158 HB3 LYS 25 2HB LYS 25 5.291 6.070 -6.103
159 HG2 LYS 25 1HG LYS 25 3.137 7.371 -6.458
160 HG3 LYS 25 2HG LYS 25 3.854 8.617 -5.434
161 HD2 LYS 25 1HD LYS 25 5.434 9.178 -6.991
162 HD3 LYS 25 2HD LYS 25 5.472 7.560 -7.695
163 HE2 LYS 25 1HE LYS 25 3.166 8.024 -8.596
164 HE3 LYS 25 2HE LYS 25 3.386 9.697 -8.084
165 HZ1 LYS 25 3HZ LYS 25 5.511 8.552 -9.708
166 HZ2 LYS 25 1HZ LYS 25 4.843 10.106 -9.737
167 HZ3 LYS 25 2HZ LYS 25 4.039 8.826 -10.495
168 H SER 26 H SER 26 5.660 6.379 -2.517
169 HA SER 26 HA SER 26 7.318 4.156 -2.607
170 HB2 SER 26 1HB SER 26 7.554 6.359 -1.259
171 HB3 SER 26 2HB SER 26 6.650 5.511 -0.004
172 HG SER 26 HG SER 26 8.928 5.286 0.231
173 H GLN 27 H GLN 27 4.518 4.706 -0.473
174 HA GLN 27 HA GLN 27 4.519 2.353 0.936
175 HB2 GLN 27 1HB GLN 27 2.216 4.005 -0.088
176 HB3 GLN 27 2HB GLN 27 1.982 2.617 0.967
177 HG2 GLN 27 1HG GLN 27 3.802 4.875 1.719
178 HG3 GLN 27 2HG GLN 27 2.069 4.931 2.033
179 HE21 GLN 27 1HE2 GLN 27 3.537 5.138 4.178
180 HE22 GLN 27 2HE2 GLN 27 3.589 3.672 5.089
181 H LEU 28 H LEU 28 2.956 2.936 -2.207
182 HA LEU 28 HA LEU 28 1.975 0.317 -2.543
183 HB2 LEU 28 1HB LEU 28 1.090 2.145 -3.830
184 HB3 LEU 28 2HB LEU 28 2.666 2.449 -4.557
185 HG LEU 28 HG LEU 28 2.463 0.133 -5.594
186 HD11 LEU 28 1HD1 LEU 28 0.122 -0.647 -5.888
187 HD12 LEU 28 2HD1 LEU 28 -0.377 0.522 -4.666
188 HD13 LEU 28 3HD1 LEU 28 0.720 -0.790 -4.235
189 HD21 LEU 28 3HD2 LEU 28 0.305 1.961 -6.567
190 HD22 LEU 28 1HD2 LEU 28 1.469 1.009 -7.489
191 HD23 LEU 28 2HD2 LEU 28 1.995 2.462 -6.639
192 H HIS 29 H HIS 29 4.875 1.892 -3.888
193 HA HIS 29 HA HIS 29 5.916 -0.206 -5.330
194 HB2 HIS 29 1HB HIS 29 7.461 1.806 -3.681
195 HB3 HIS 29 2HB HIS 29 8.128 0.825 -4.982
196 HD2 HIS 29 HD2 HIS 29 5.160 1.623 -6.741
197 HE1 HIS 29 HE1 HIS 29 7.277 5.292 -6.975
198 HE2 HIS 29 HE2 HIS 29 5.333 3.952 -7.853
199 H VAL 30 H VAL 30 6.578 0.542 -1.909
200 HA VAL 30 HA VAL 30 8.155 -1.763 -1.447
201 HB VAL 30 HB VAL 30 6.632 -0.069 0.538
202 HG11 VAL 30 1HG1 VAL 30 8.092 -2.511 0.862
203 HG12 VAL 30 2HG1 VAL 30 8.926 -1.202 1.701
204 HG13 VAL 30 3HG1 VAL 30 7.238 -1.555 2.072
205 HG21 VAL 30 3HG2 VAL 30 9.241 0.579 0.844
206 HG22 VAL 30 1HG2 VAL 30 9.180 0.270 -0.892
207 HG23 VAL 30 2HG2 VAL 30 8.113 1.475 -0.172
208 H HIS 31 H HIS 31 4.720 -1.070 -1.058
209 HA HIS 31 HA HIS 31 3.958 -3.333 0.379
210 HB2 HIS 31 1HB HIS 31 2.246 -1.800 0.209
211 HB3 HIS 31 2HB HIS 31 2.566 -1.470 -1.491
212 HD1 HIS 31 HD1 HIS 31 1.013 -4.143 0.698
213 HD2 HIS 31 HD2 HIS 31 0.956 -2.813 -3.237
214 HE1 HIS 31 HE1 HIS 31 -0.811 -5.457 -0.429
215 H GLN 32 H GLN 32 3.915 -2.856 -3.155
216 HA GLN 32 HA GLN 32 3.007 -5.226 -4.058
217 HB2 GLN 32 1HB GLN 32 5.399 -3.703 -5.097
218 HB3 GLN 32 2HB GLN 32 4.604 -5.003 -5.975
219 HG2 GLN 32 1HG GLN 32 2.469 -3.579 -5.674
220 HG3 GLN 32 2HG GLN 32 3.596 -2.266 -5.337
221 HE21 GLN 32 1HE2 GLN 32 4.898 -1.481 -6.975
222 HE22 GLN 32 2HE2 GLN 32 4.623 -1.852 -8.639
223 H GLN 33 H GLN 33 6.219 -4.642 -2.724
224 HA GLN 33 HA GLN 33 7.536 -6.959 -3.336
225 HB2 GLN 33 1HB GLN 33 7.571 -5.542 -0.666
226 HB3 GLN 33 2HB GLN 33 8.792 -6.668 -1.242
227 HG2 GLN 33 1HG GLN 33 8.887 -4.960 -3.260
228 HG3 GLN 33 2HG GLN 33 8.277 -3.858 -2.027
229 HE21 GLN 33 1HE2 GLN 33 9.767 -2.811 -0.940
230 HE22 GLN 33 2HE2 GLN 33 11.387 -3.338 -0.656
231 H ILE 34 H ILE 34 5.229 -6.461 -0.689
232 HA ILE 34 HA ILE 34 5.371 -8.787 0.694
233 HB ILE 34 HB ILE 34 3.736 -6.920 1.091
234 HG12 ILE 34 1HG1 ILE 34 2.408 -9.630 1.103
235 HG13 ILE 34 2HG1 ILE 34 3.708 -9.209 2.213
236 HG21 ILE 34 1HG2 ILE 34 1.769 -8.355 -0.617
237 HG22 ILE 34 2HG2 ILE 34 1.808 -6.666 -0.112
238 HG23 ILE 34 3HG2 ILE 34 2.892 -7.231 -1.383
239 HD11 ILE 34 3HD1 ILE 34 1.062 -7.793 1.991
240 HD12 ILE 34 1HD1 ILE 34 1.518 -8.949 3.242
241 HD13 ILE 34 2HD1 ILE 34 2.358 -7.403 3.121
242 H HIS 35 H HIS 35 4.123 -8.362 -2.542
243 HA HIS 35 HA HIS 35 3.221 -11.142 -2.645
244 HB2 HIS 35 1HB HIS 35 3.069 -9.206 -4.938
245 HB3 HIS 35 2HB HIS 35 2.037 -10.591 -4.591
246 HD1 HIS 35 HD1 HIS 35 0.644 -10.203 -2.170
247 HD2 HIS 35 HD2 HIS 35 1.848 -6.878 -4.351
248 HE1 HIS 35 HE1 HIS 35 -0.809 -8.312 -1.372
249 H THR 36 H THR 36 5.987 -10.760 -2.352
250 HA THR 36 HA THR 36 7.208 -11.071 -4.963
251 HB THR 36 HB THR 36 8.384 -9.839 -3.163
252 HG1 THR 36 HG1 THR 36 10.377 -11.309 -3.365
253 HG21 THR 36 3HG2 THR 36 7.639 -12.032 -1.592
254 HG22 THR 36 1HG2 THR 36 8.650 -10.670 -1.110
255 HG23 THR 36 2HG2 THR 36 9.392 -12.139 -1.745
256 H GLY 37 H GLY 37 8.088 -12.934 -5.798
257 HA2 GLY 37 1HA GLY 37 6.969 -15.405 -4.805
258 HA3 GLY 37 2HA GLY 37 7.934 -15.204 -6.260
259 H GLU 38 H GLU 38 9.387 -16.826 -5.978
260 HA GLU 38 HA GLU 38 10.554 -17.731 -3.669
261 HB2 GLU 38 1HB GLU 38 10.882 -18.894 -5.751
262 HB3 GLU 38 2HB GLU 38 11.744 -17.523 -6.436
263 HG2 GLU 38 1HG GLU 38 13.541 -17.850 -4.802
264 HG3 GLU 38 2HG GLU 38 12.683 -19.247 -4.154
265 H LYS 39 H LYS 39 12.476 -17.308 -2.554
266 HA LYS 39 HA LYS 39 13.102 -14.590 -2.176
267 HB2 LYS 39 1HB LYS 39 14.549 -17.100 -1.323
268 HB3 LYS 39 2HB LYS 39 15.013 -15.485 -0.802
269 HG2 LYS 39 1HG LYS 39 12.279 -16.646 -0.338
270 HG3 LYS 39 2HG LYS 39 13.608 -16.786 0.815
271 HD2 LYS 39 1HD LYS 39 13.554 -14.562 1.354
272 HD3 LYS 39 2HD LYS 39 12.935 -14.082 -0.227
273 HE2 LYS 39 1HE LYS 39 11.057 -13.759 1.026
274 HE3 LYS 39 2HE LYS 39 10.823 -15.450 0.586
275 HZ1 LYS 39 3HZ LYS 39 12.255 -15.694 2.823
276 HZ2 LYS 39 1HZ LYS 39 10.563 -15.692 2.789
277 HZ3 LYS 39 2HZ LYS 39 11.403 -14.274 3.170
278 HA PRO 40 HA PRO 40 16.150 -13.732 -5.220
279 HB2 PRO 40 1HB PRO 40 17.699 -11.940 -3.893
280 HB3 PRO 40 2HB PRO 40 16.081 -11.554 -4.492
281 HG2 PRO 40 1HG PRO 40 16.947 -12.312 -1.729
282 HG3 PRO 40 2HG PRO 40 15.810 -11.050 -2.238
283 HD2 PRO 40 1HD PRO 40 14.993 -13.454 -1.298
284 HD3 PRO 40 2HD PRO 40 14.080 -12.547 -2.521
285 H SER 41 H SER 41 17.142 -15.817 -5.286
286 HA SER 41 HA SER 41 19.795 -15.844 -4.038
287 HB2 SER 41 1HB SER 41 18.059 -17.311 -2.808
288 HB3 SER 41 2HB SER 41 18.167 -18.371 -4.214
289 HG SER 41 HG SER 41 19.632 -18.900 -2.474
290 H GLY 42 H GLY 42 20.949 -17.987 -5.006
291 HA2 GLY 42 1HA GLY 42 20.329 -18.239 -7.855
292 HA3 GLY 42 2HA GLY 42 21.901 -17.581 -7.426
293 HA PRO 43 HA PRO 43 23.466 -21.684 -7.366
294 HB2 PRO 43 1HB PRO 43 25.639 -21.310 -5.783
295 HB3 PRO 43 2HB PRO 43 25.556 -20.733 -7.452
296 HG2 PRO 43 1HG PRO 43 25.118 -19.227 -4.902
297 HG3 PRO 43 2HG PRO 43 26.010 -18.734 -6.353
298 HD2 PRO 43 1HD PRO 43 23.493 -17.883 -5.831
299 HD3 PRO 43 2HD PRO 43 24.091 -18.139 -7.483
300 H SER 44 H SER 44 23.439 -23.524 -6.120
301 HA SER 44 HA SER 44 22.060 -23.318 -3.581
302 HB2 SER 44 1HB SER 44 21.601 -25.051 -5.443
303 HB3 SER 44 2HB SER 44 23.026 -25.885 -4.824
304 HG SER 44 HG SER 44 20.550 -25.952 -3.879
305 H SER 45 H SER 45 23.415 -22.627 -2.004
306 HA SER 45 HA SER 45 26.025 -23.910 -1.702
307 HB2 SER 45 1HB SER 45 25.596 -21.355 -1.538
308 HB3 SER 45 2HB SER 45 24.976 -21.719 0.072
309 HG SER 45 HG SER 45 27.049 -21.455 0.509
310 H GLY 46 H GLY 46 23.133 -23.201 0.257
311 HA2 GLY 46 1HA GLY 46 22.203 -24.324 2.030
312 HA3 GLY 46 2HA GLY 46 23.056 -25.749 1.455
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -16.227 -16.527 -8.485
2 HA2 GLY 1 1HA GLY 1 -18.864 -16.675 -8.870
3 HA3 GLY 1 2HA GLY 1 -18.201 -16.499 -7.252
4 H SER 2 H SER 2 -18.266 -14.492 -6.227
5 HA SER 2 HA SER 2 -20.444 -12.819 -7.030
6 HB2 SER 2 1HB SER 2 -19.518 -13.417 -4.624
7 HB3 SER 2 2HB SER 2 -18.529 -11.982 -4.891
8 HG SER 2 HG SER 2 -21.086 -12.115 -4.167
9 H SER 3 H SER 3 -20.373 -11.127 -8.339
10 HA SER 3 HA SER 3 -17.873 -10.167 -9.374
11 HB2 SER 3 1HB SER 3 -19.891 -10.366 -10.794
12 HB3 SER 3 2HB SER 3 -20.676 -9.115 -9.831
13 HG SER 3 HG SER 3 -19.707 -7.720 -11.048
14 H GLY 4 H GLY 4 -16.807 -9.255 -7.595
15 HA2 GLY 4 1HA GLY 4 -18.086 -6.996 -6.248
16 HA3 GLY 4 2HA GLY 4 -16.571 -7.756 -5.787
17 H SER 5 H SER 5 -17.865 -6.113 -8.679
18 HA SER 5 HA SER 5 -15.633 -5.201 -9.857
19 HB2 SER 5 1HB SER 5 -17.937 -4.684 -10.623
20 HB3 SER 5 2HB SER 5 -18.064 -3.465 -9.355
21 HG SER 5 HG SER 5 -17.386 -2.770 -11.559
22 H SER 6 H SER 6 -13.840 -4.433 -8.958
23 HA SER 6 HA SER 6 -13.796 -2.983 -6.511
24 HB2 SER 6 1HB SER 6 -11.891 -4.335 -7.074
25 HB3 SER 6 2HB SER 6 -11.668 -3.482 -8.602
26 HG SER 6 HG SER 6 -10.954 -2.743 -6.031
27 H GLY 7 H GLY 7 -15.216 -1.214 -6.934
28 HA2 GLY 7 1HA GLY 7 -13.820 1.032 -8.187
29 HA3 GLY 7 2HA GLY 7 -15.420 0.635 -8.795
30 H THR 8 H THR 8 -14.250 0.538 -5.454
31 HA THR 8 HA THR 8 -16.101 2.737 -4.813
32 HB THR 8 HB THR 8 -16.563 1.561 -2.633
33 HG1 THR 8 HG1 THR 8 -15.506 -0.700 -4.010
34 HG21 THR 8 3HG2 THR 8 -18.106 1.557 -4.620
35 HG22 THR 8 1HG2 THR 8 -18.302 0.189 -3.526
36 HG23 THR 8 2HG2 THR 8 -17.438 -0.017 -5.050
37 H GLY 9 H GLY 9 -13.318 2.987 -5.268
38 HA2 GLY 9 1HA GLY 9 -12.377 3.595 -2.532
39 HA3 GLY 9 2HA GLY 9 -11.302 3.040 -3.806
40 H GLU 10 H GLU 10 -10.632 5.305 -2.519
41 HA GLU 10 HA GLU 10 -11.091 7.346 -4.580
42 HB2 GLU 10 1HB GLU 10 -12.381 7.601 -2.281
43 HB3 GLU 10 2HB GLU 10 -10.827 8.219 -1.738
44 HG2 GLU 10 1HG GLU 10 -10.944 10.081 -3.060
45 HG3 GLU 10 2HG GLU 10 -11.998 9.310 -4.244
46 H LYS 11 H LYS 11 -8.897 5.548 -4.265
47 HA LYS 11 HA LYS 11 -6.750 7.411 -3.486
48 HB2 LYS 11 1HB LYS 11 -7.055 4.465 -3.182
49 HB3 LYS 11 2HB LYS 11 -5.442 5.087 -3.506
50 HG2 LYS 11 1HG LYS 11 -5.671 4.899 -1.156
51 HG3 LYS 11 2HG LYS 11 -5.733 6.619 -1.549
52 HD2 LYS 11 1HD LYS 11 -8.117 6.653 -1.309
53 HD3 LYS 11 2HD LYS 11 -8.174 4.896 -1.144
54 HE2 LYS 11 1HE LYS 11 -7.208 4.952 0.987
55 HE3 LYS 11 2HE LYS 11 -6.608 6.595 0.770
56 HZ1 LYS 11 3HZ LYS 11 -9.281 5.675 1.507
57 HZ2 LYS 11 1HZ LYS 11 -9.176 7.068 0.552
58 HZ3 LYS 11 2HZ LYS 11 -8.409 7.016 2.058
59 HA PRO 12 HA PRO 12 -5.442 7.490 -7.687
60 HB2 PRO 12 1HB PRO 12 -2.835 8.156 -7.323
61 HB3 PRO 12 2HB PRO 12 -4.161 9.305 -7.100
62 HG2 PRO 12 1HG PRO 12 -2.647 7.736 -5.047
63 HG3 PRO 12 2HG PRO 12 -3.154 9.435 -5.007
64 HD2 PRO 12 1HD PRO 12 -4.499 7.482 -3.699
65 HD3 PRO 12 2HD PRO 12 -5.309 8.908 -4.379
66 H TYR 13 H TYR 13 -3.266 5.815 -5.419
67 HA TYR 13 HA TYR 13 -2.458 4.001 -7.575
68 HB2 TYR 13 1HB TYR 13 -1.295 4.114 -4.794
69 HB3 TYR 13 2HB TYR 13 -0.579 3.413 -6.241
70 HD1 TYR 13 HD1 TYR 13 0.333 4.883 -8.008
71 HD2 TYR 13 HD2 TYR 13 -1.107 6.452 -4.325
72 HE1 TYR 13 HE1 TYR 13 1.509 6.996 -8.456
73 HE2 TYR 13 HE2 TYR 13 0.063 8.571 -4.764
74 HH TYR 13 HH TYR 13 2.337 9.113 -6.390
75 H GLU 14 H GLU 14 -3.101 1.939 -7.652
76 HA GLU 14 HA GLU 14 -4.278 0.724 -5.255
77 HB2 GLU 14 1HB GLU 14 -6.033 1.679 -6.852
78 HB3 GLU 14 2HB GLU 14 -5.543 0.417 -7.972
79 HG2 GLU 14 1HG GLU 14 -6.291 -1.292 -6.544
80 HG3 GLU 14 2HG GLU 14 -6.433 -0.192 -5.174
81 H CYS 15 H CYS 15 -3.804 -1.393 -4.969
82 HA CYS 15 HA CYS 15 -1.808 -2.551 -6.701
83 HB2 CYS 15 1HB CYS 15 -1.728 -2.708 -4.199
84 HB3 CYS 15 2HB CYS 15 -3.125 -3.778 -4.272
85 H SER 16 H SER 16 -2.337 -3.631 -8.472
86 HA SER 16 HA SER 16 -4.978 -4.781 -8.780
87 HB2 SER 16 1HB SER 16 -4.132 -5.345 -11.090
88 HB3 SER 16 2HB SER 16 -4.110 -3.626 -10.695
89 HG SER 16 HG SER 16 -2.118 -4.966 -11.593
90 H ILE 17 H ILE 17 -2.945 -5.909 -6.883
91 HA ILE 17 HA ILE 17 -2.698 -8.612 -8.021
92 HB ILE 17 HB ILE 17 -1.219 -7.426 -5.669
93 HG12 ILE 17 1HG1 ILE 17 -0.132 -8.131 -8.399
94 HG13 ILE 17 2HG1 ILE 17 -0.643 -6.506 -7.956
95 HG21 ILE 17 1HG2 ILE 17 0.218 -9.495 -6.029
96 HG22 ILE 17 2HG2 ILE 17 -1.368 -9.742 -5.300
97 HG23 ILE 17 3HG2 ILE 17 -1.114 -10.114 -7.005
98 HD11 ILE 17 3HD1 ILE 17 1.859 -7.744 -7.537
99 HD12 ILE 17 1HD1 ILE 17 1.348 -6.117 -7.090
100 HD13 ILE 17 2HD1 ILE 17 1.132 -7.452 -5.957
101 H CYS 18 H CYS 18 -3.156 -7.108 -4.814
102 HA CYS 18 HA CYS 18 -4.861 -9.377 -4.069
103 HB2 CYS 18 1HB CYS 18 -4.559 -8.519 -1.738
104 HB3 CYS 18 2HB CYS 18 -3.058 -9.000 -2.521
105 H GLY 19 H GLY 19 -4.789 -5.835 -4.115
106 HA2 GLY 19 1HA GLY 19 -6.926 -4.822 -4.919
107 HA3 GLY 19 2HA GLY 19 -7.724 -5.871 -3.756
108 H LYS 20 H LYS 20 -4.753 -4.006 -3.306
109 HA LYS 20 HA LYS 20 -6.054 -2.638 -1.057
110 HB2 LYS 20 1HB LYS 20 -3.256 -3.470 -1.647
111 HB3 LYS 20 2HB LYS 20 -3.489 -2.020 -0.678
112 HG2 LYS 20 1HG LYS 20 -5.022 -3.457 0.777
113 HG3 LYS 20 2HG LYS 20 -4.306 -4.836 -0.061
114 HD2 LYS 20 1HD LYS 20 -2.175 -4.398 0.794
115 HD3 LYS 20 2HD LYS 20 -2.589 -2.737 1.223
116 HE2 LYS 20 1HE LYS 20 -2.468 -4.048 3.232
117 HE3 LYS 20 2HE LYS 20 -4.152 -3.622 2.933
118 HZ1 LYS 20 3HZ LYS 20 -4.637 -5.786 2.221
119 HZ2 LYS 20 1HZ LYS 20 -3.683 -5.995 3.603
120 HZ3 LYS 20 2HZ LYS 20 -3.007 -6.209 2.068
121 H SER 21 H SER 21 -5.018 -0.387 -0.633
122 HA SER 21 HA SER 21 -4.525 1.075 -3.115
123 HB2 SER 21 1HB SER 21 -6.198 2.822 -2.417
124 HB3 SER 21 2HB SER 21 -6.911 1.283 -2.899
125 HG SER 21 HG SER 21 -7.769 2.192 -0.923
126 H PHE 22 H PHE 22 -3.310 2.924 -2.869
127 HA PHE 22 HA PHE 22 -2.562 3.716 -0.147
128 HB2 PHE 22 1HB PHE 22 -0.533 3.265 -2.342
129 HB3 PHE 22 2HB PHE 22 -0.206 3.712 -0.671
130 HD1 PHE 22 HD1 PHE 22 -1.409 1.000 -2.862
131 HD2 PHE 22 HD2 PHE 22 -0.064 2.080 1.029
132 HE1 PHE 22 HE1 PHE 22 -1.224 -1.381 -2.269
133 HE2 PHE 22 HE2 PHE 22 0.125 -0.299 1.628
134 HZ PHE 22 HZ PHE 22 -0.454 -2.033 -0.022
135 H THR 23 H THR 23 -1.661 5.845 0.011
136 HA THR 23 HA THR 23 -2.636 7.605 -2.118
137 HB THR 23 HB THR 23 -2.309 9.426 -0.415
138 HG1 THR 23 HG1 THR 23 -0.869 8.552 1.016
139 HG21 THR 23 3HG2 THR 23 -4.136 8.184 1.179
140 HG22 THR 23 1HG2 THR 23 -4.243 7.218 -0.291
141 HG23 THR 23 2HG2 THR 23 -4.513 8.960 -0.359
142 H LYS 24 H LYS 24 0.238 6.281 -0.968
143 HA LYS 24 HA LYS 24 1.810 8.405 -2.275
144 HB2 LYS 24 1HB LYS 24 2.388 6.752 0.164
145 HB3 LYS 24 2HB LYS 24 3.707 7.422 -0.788
146 HG2 LYS 24 1HG LYS 24 3.130 9.614 -0.278
147 HG3 LYS 24 2HG LYS 24 1.489 9.172 0.200
148 HD2 LYS 24 1HD LYS 24 3.907 8.206 1.703
149 HD3 LYS 24 2HD LYS 24 3.133 9.751 2.064
150 HE2 LYS 24 1HE LYS 24 0.986 8.507 2.371
151 HE3 LYS 24 2HE LYS 24 1.896 7.006 2.207
152 HZ1 LYS 24 3HZ LYS 24 3.320 8.003 4.094
153 HZ2 LYS 24 1HZ LYS 24 1.824 7.309 4.474
154 HZ3 LYS 24 2HZ LYS 24 1.977 8.991 4.379
155 H LYS 25 H LYS 25 3.025 7.826 -3.963
156 HA LYS 25 HA LYS 25 2.788 5.379 -5.237
157 HB2 LYS 25 1HB LYS 25 3.703 7.647 -6.100
158 HB3 LYS 25 2HB LYS 25 5.260 7.061 -5.529
159 HG2 LYS 25 1HG LYS 25 5.082 5.122 -6.990
160 HG3 LYS 25 2HG LYS 25 3.503 5.679 -7.548
161 HD2 LYS 25 1HD LYS 25 4.654 7.800 -8.297
162 HD3 LYS 25 2HD LYS 25 6.185 6.981 -7.976
163 HE2 LYS 25 1HE LYS 25 5.893 5.478 -9.703
164 HE3 LYS 25 2HE LYS 25 4.139 5.655 -9.699
165 HZ1 LYS 25 3HZ LYS 25 5.503 8.092 -10.344
166 HZ2 LYS 25 1HZ LYS 25 4.248 7.308 -11.164
167 HZ3 LYS 25 2HZ LYS 25 5.853 6.849 -11.436
168 H SER 26 H SER 26 5.398 6.526 -3.120
169 HA SER 26 HA SER 26 7.107 4.352 -3.317
170 HB2 SER 26 1HB SER 26 7.579 6.518 -2.128
171 HB3 SER 26 2HB SER 26 6.594 5.930 -0.788
172 HG SER 26 HG SER 26 8.641 4.282 -1.731
173 H GLN 27 H GLN 27 4.397 4.851 -1.078
174 HA GLN 27 HA GLN 27 4.640 2.583 0.473
175 HB2 GLN 27 1HB GLN 27 2.143 3.979 -0.495
176 HB3 GLN 27 2HB GLN 27 2.146 2.730 0.743
177 HG2 GLN 27 1HG GLN 27 3.633 5.340 0.923
178 HG3 GLN 27 2HG GLN 27 2.068 5.009 1.663
179 HE21 GLN 27 1HE2 GLN 27 4.712 5.696 2.818
180 HE22 GLN 27 2HE2 GLN 27 5.038 4.453 3.972
181 H LEU 28 H LEU 28 2.848 2.928 -2.583
182 HA LEU 28 HA LEU 28 1.878 0.334 -2.780
183 HB2 LEU 28 1HB LEU 28 1.179 2.153 -4.245
184 HB3 LEU 28 2HB LEU 28 2.774 2.174 -4.994
185 HG LEU 28 HG LEU 28 2.291 -0.212 -5.733
186 HD11 LEU 28 1HD1 LEU 28 -0.321 -0.424 -6.001
187 HD12 LEU 28 2HD1 LEU 28 -0.319 0.554 -4.534
188 HD13 LEU 28 3HD1 LEU 28 0.504 -1.006 -4.555
189 HD21 LEU 28 3HD2 LEU 28 1.361 0.525 -7.726
190 HD22 LEU 28 1HD2 LEU 28 2.103 1.987 -7.076
191 HD23 LEU 28 2HD2 LEU 28 0.363 1.741 -6.929
192 H HIS 29 H HIS 29 4.902 1.659 -4.117
193 HA HIS 29 HA HIS 29 5.877 -0.655 -5.295
194 HB2 HIS 29 1HB HIS 29 7.356 1.637 -3.994
195 HB3 HIS 29 2HB HIS 29 8.151 0.373 -4.928
196 HD2 HIS 29 HD2 HIS 29 5.686 0.462 -7.311
197 HE1 HIS 29 HE1 HIS 29 7.344 4.318 -7.931
198 HE2 HIS 29 HE2 HIS 29 5.835 2.528 -8.860
199 H VAL 30 H VAL 30 6.253 0.485 -1.960
200 HA VAL 30 HA VAL 30 7.939 -1.623 -1.109
201 HB VAL 30 HB VAL 30 6.083 0.112 0.527
202 HG11 VAL 30 1HG1 VAL 30 8.519 -1.181 1.644
203 HG12 VAL 30 2HG1 VAL 30 7.022 -0.705 2.448
204 HG13 VAL 30 3HG1 VAL 30 7.063 -2.156 1.444
205 HG21 VAL 30 3HG2 VAL 30 7.528 1.675 -0.262
206 HG22 VAL 30 1HG2 VAL 30 8.524 1.058 1.056
207 HG23 VAL 30 2HG2 VAL 30 8.797 0.495 -0.593
208 H HIS 31 H HIS 31 4.430 -1.160 -1.016
209 HA HIS 31 HA HIS 31 3.717 -3.368 0.509
210 HB2 HIS 31 1HB HIS 31 1.987 -1.860 0.017
211 HB3 HIS 31 2HB HIS 31 2.325 -1.894 -1.711
212 HD1 HIS 31 HD1 HIS 31 0.976 -4.209 0.982
213 HD2 HIS 31 HD2 HIS 31 0.719 -3.570 -3.115
214 HE1 HIS 31 HE1 HIS 31 -0.779 -5.812 0.160
215 H GLN 32 H GLN 32 4.118 -3.153 -3.020
216 HA GLN 32 HA GLN 32 3.395 -5.599 -3.880
217 HB2 GLN 32 1HB GLN 32 5.932 -4.146 -4.647
218 HB3 GLN 32 2HB GLN 32 5.218 -5.468 -5.561
219 HG2 GLN 32 1HG GLN 32 3.121 -4.000 -5.670
220 HG3 GLN 32 2HG GLN 32 4.183 -2.688 -5.163
221 HE21 GLN 32 1HE2 GLN 32 3.385 -1.885 -7.300
222 HE22 GLN 32 2HE2 GLN 32 4.314 -2.299 -8.696
223 H GLN 33 H GLN 33 6.302 -4.854 -2.045
224 HA GLN 33 HA GLN 33 7.758 -7.164 -2.293
225 HB2 GLN 33 1HB GLN 33 7.303 -5.554 0.225
226 HB3 GLN 33 2HB GLN 33 8.594 -6.725 -0.003
227 HG2 GLN 33 1HG GLN 33 9.497 -5.371 -1.828
228 HG3 GLN 33 2HG GLN 33 8.209 -4.193 -1.583
229 HE21 GLN 33 1HE2 GLN 33 10.120 -2.773 -1.347
230 HE22 GLN 33 2HE2 GLN 33 10.819 -2.612 0.225
231 H ILE 34 H ILE 34 5.062 -6.574 -0.057
232 HA ILE 34 HA ILE 34 5.019 -8.853 1.420
233 HB ILE 34 HB ILE 34 3.354 -6.972 1.536
234 HG12 ILE 34 1HG1 ILE 34 1.837 -9.549 1.461
235 HG13 ILE 34 2HG1 ILE 34 3.194 -9.393 2.571
236 HG21 ILE 34 1HG2 ILE 34 1.604 -8.458 -0.349
237 HG22 ILE 34 2HG2 ILE 34 1.619 -6.746 0.072
238 HG23 ILE 34 3HG2 ILE 34 2.840 -7.395 -1.022
239 HD11 ILE 34 3HD1 ILE 34 2.037 -7.242 3.354
240 HD12 ILE 34 1HD1 ILE 34 0.615 -7.882 2.529
241 HD13 ILE 34 2HD1 ILE 34 1.355 -8.792 3.846
242 H HIS 35 H HIS 35 4.138 -8.521 -1.956
243 HA HIS 35 HA HIS 35 3.155 -11.246 -2.121
244 HB2 HIS 35 1HB HIS 35 3.645 -9.296 -4.377
245 HB3 HIS 35 2HB HIS 35 2.653 -10.751 -4.425
246 HD1 HIS 35 HD1 HIS 35 0.665 -10.569 -2.364
247 HD2 HIS 35 HD2 HIS 35 2.081 -7.115 -4.189
248 HE1 HIS 35 HE1 HIS 35 -1.099 -8.823 -1.960
249 H THR 36 H THR 36 5.918 -9.364 -3.302
250 HA THR 36 HA THR 36 7.289 -11.908 -3.888
251 HB THR 36 HB THR 36 6.988 -10.842 -5.985
252 HG1 THR 36 HG1 THR 36 9.034 -11.042 -6.498
253 HG21 THR 36 3HG2 THR 36 8.155 -8.304 -4.849
254 HG22 THR 36 1HG2 THR 36 6.424 -8.597 -5.010
255 HG23 THR 36 2HG2 THR 36 7.447 -8.541 -6.446
256 H GLY 37 H GLY 37 9.088 -12.298 -2.767
257 HA2 GLY 37 1HA GLY 37 10.918 -10.238 -1.998
258 HA3 GLY 37 2HA GLY 37 9.971 -10.807 -0.632
259 H GLU 38 H GLU 38 11.384 -12.515 -3.417
260 HA GLU 38 HA GLU 38 12.909 -14.204 -3.544
261 HB2 GLU 38 1HB GLU 38 14.122 -12.633 -1.865
262 HB3 GLU 38 2HB GLU 38 13.627 -13.809 -0.656
263 HG2 GLU 38 1HG GLU 38 15.871 -14.276 -1.382
264 HG3 GLU 38 2HG GLU 38 14.793 -15.567 -1.909
265 H LYS 39 H LYS 39 10.313 -14.888 -3.103
266 HA LYS 39 HA LYS 39 10.427 -17.039 -1.099
267 HB2 LYS 39 1HB LYS 39 8.588 -15.522 -0.714
268 HB3 LYS 39 2HB LYS 39 8.067 -15.660 -2.388
269 HG2 LYS 39 1HG LYS 39 7.820 -18.186 -1.823
270 HG3 LYS 39 2HG LYS 39 7.792 -17.616 -0.152
271 HD2 LYS 39 1HD LYS 39 6.015 -16.406 -2.247
272 HD3 LYS 39 2HD LYS 39 5.551 -17.876 -1.387
273 HE2 LYS 39 1HE LYS 39 4.591 -16.282 -0.048
274 HE3 LYS 39 2HE LYS 39 6.164 -16.453 0.729
275 HZ1 LYS 39 3HZ LYS 39 5.387 -14.115 0.317
276 HZ2 LYS 39 1HZ LYS 39 5.618 -14.400 -1.335
277 HZ3 LYS 39 2HZ LYS 39 6.930 -14.481 -0.271
278 HA PRO 40 HA PRO 40 10.789 -19.228 -5.143
279 HB2 PRO 40 1HB PRO 40 12.487 -21.128 -4.206
280 HB3 PRO 40 2HB PRO 40 13.037 -19.554 -4.793
281 HG2 PRO 40 1HG PRO 40 12.598 -20.478 -1.980
282 HG3 PRO 40 2HG PRO 40 13.933 -19.521 -2.648
283 HD2 PRO 40 1HD PRO 40 11.881 -18.403 -1.280
284 HD3 PRO 40 2HD PRO 40 12.720 -17.562 -2.600
285 H SER 41 H SER 41 10.112 -20.291 -1.874
286 HA SER 41 HA SER 41 9.377 -22.888 -2.115
287 HB2 SER 41 1HB SER 41 8.110 -20.642 -0.566
288 HB3 SER 41 2HB SER 41 7.463 -22.280 -0.475
289 HG SER 41 HG SER 41 9.406 -21.339 0.938
290 H GLY 42 H GLY 42 7.485 -20.088 -3.162
291 HA2 GLY 42 1HA GLY 42 5.325 -21.782 -4.116
292 HA3 GLY 42 2HA GLY 42 5.393 -20.028 -4.202
293 HA PRO 43 HA PRO 43 6.774 -22.282 -8.235
294 HB2 PRO 43 1HB PRO 43 4.397 -22.651 -9.493
295 HB3 PRO 43 2HB PRO 43 5.138 -23.879 -8.460
296 HG2 PRO 43 1HG PRO 43 2.961 -21.927 -7.818
297 HG3 PRO 43 2HG PRO 43 3.081 -23.646 -7.401
298 HD2 PRO 43 1HD PRO 43 3.662 -21.675 -5.638
299 HD3 PRO 43 2HD PRO 43 4.490 -23.245 -5.622
300 H SER 44 H SER 44 5.094 -19.606 -7.163
301 HA SER 44 HA SER 44 4.980 -17.469 -7.961
302 HB2 SER 44 1HB SER 44 7.175 -18.222 -9.153
303 HB3 SER 44 2HB SER 44 6.159 -18.313 -10.592
304 HG SER 44 HG SER 44 5.973 -16.193 -10.616
305 H SER 45 H SER 45 2.810 -19.190 -8.172
306 HA SER 45 HA SER 45 1.612 -19.336 -10.695
307 HB2 SER 45 1HB SER 45 -0.433 -19.823 -9.547
308 HB3 SER 45 2HB SER 45 0.870 -20.529 -8.591
309 HG SER 45 HG SER 45 -0.936 -18.682 -7.870
310 H GLY 46 H GLY 46 1.520 -16.802 -8.231
311 HA2 GLY 46 1HA GLY 46 1.464 -14.493 -9.077
312 HA3 GLY 46 2HA GLY 46 0.267 -15.036 -10.242
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -19.505 -3.200 -8.361
2 HA2 GLY 1 1HA GLY 1 -20.212 -5.420 -6.689
3 HA3 GLY 1 2HA GLY 1 -18.601 -4.812 -6.340
4 H SER 2 H SER 2 -21.850 -4.516 -5.630
5 HA SER 2 HA SER 2 -21.824 -1.715 -4.928
6 HB2 SER 2 1HB SER 2 -23.842 -3.921 -4.485
7 HB3 SER 2 2HB SER 2 -24.082 -2.267 -3.925
8 HG SER 2 HG SER 2 -24.960 -2.162 -5.872
9 H SER 3 H SER 3 -19.725 -2.968 -3.680
10 HA SER 3 HA SER 3 -20.190 -3.976 -1.121
11 HB2 SER 3 1HB SER 3 -17.864 -3.386 -0.639
12 HB3 SER 3 2HB SER 3 -17.998 -4.068 -2.260
13 HG SER 3 HG SER 3 -17.185 -2.284 -2.980
14 H GLY 4 H GLY 4 -21.589 -2.938 0.198
15 HA2 GLY 4 1HA GLY 4 -22.239 -1.394 1.778
16 HA3 GLY 4 2HA GLY 4 -20.720 -0.555 1.504
17 H SER 5 H SER 5 -23.783 0.106 1.631
18 HA SER 5 HA SER 5 -24.327 1.331 -0.892
19 HB2 SER 5 1HB SER 5 -26.062 0.543 0.781
20 HB3 SER 5 2HB SER 5 -25.663 1.966 1.743
21 HG SER 5 HG SER 5 -26.272 2.315 -0.964
22 H SER 6 H SER 6 -23.276 2.528 2.275
23 HA SER 6 HA SER 6 -22.742 5.150 1.056
24 HB2 SER 6 1HB SER 6 -24.222 5.122 3.056
25 HB3 SER 6 2HB SER 6 -22.897 4.435 3.994
26 HG SER 6 HG SER 6 -22.291 6.415 4.290
27 H GLY 7 H GLY 7 -20.725 6.088 1.166
28 HA2 GLY 7 1HA GLY 7 -18.500 6.139 2.200
29 HA3 GLY 7 2HA GLY 7 -18.566 4.384 2.247
30 H THR 8 H THR 8 -18.566 7.129 -0.002
31 HA THR 8 HA THR 8 -17.382 5.382 -2.048
32 HB THR 8 HB THR 8 -18.558 8.146 -2.402
33 HG1 THR 8 HG1 THR 8 -20.154 6.643 -3.585
34 HG21 THR 8 3HG2 THR 8 -16.789 7.286 -4.043
35 HG22 THR 8 1HG2 THR 8 -18.322 7.834 -4.719
36 HG23 THR 8 2HG2 THR 8 -18.003 6.109 -4.542
37 H GLY 9 H GLY 9 -15.335 5.657 -2.720
38 HA2 GLY 9 1HA GLY 9 -13.963 8.183 -2.311
39 HA3 GLY 9 2HA GLY 9 -13.350 6.838 -1.360
40 H GLU 10 H GLU 10 -11.559 7.917 -2.952
41 HA GLU 10 HA GLU 10 -11.014 5.819 -4.851
42 HB2 GLU 10 1HB GLU 10 -12.450 7.640 -6.015
43 HB3 GLU 10 2HB GLU 10 -10.986 8.611 -5.956
44 HG2 GLU 10 1HG GLU 10 -9.818 7.133 -7.355
45 HG3 GLU 10 2HG GLU 10 -11.025 5.864 -7.157
46 H LYS 11 H LYS 11 -8.869 5.490 -5.084
47 HA LYS 11 HA LYS 11 -7.071 7.478 -3.859
48 HB2 LYS 11 1HB LYS 11 -7.162 4.507 -3.742
49 HB3 LYS 11 2HB LYS 11 -5.575 5.264 -3.763
50 HG2 LYS 11 1HG LYS 11 -6.002 5.076 -1.509
51 HG3 LYS 11 2HG LYS 11 -6.521 6.729 -1.848
52 HD2 LYS 11 1HD LYS 11 -8.822 6.060 -1.915
53 HD3 LYS 11 2HD LYS 11 -8.379 4.354 -1.815
54 HE2 LYS 11 1HE LYS 11 -7.648 4.581 0.423
55 HE3 LYS 11 2HE LYS 11 -7.676 6.341 0.331
56 HZ1 LYS 11 3HZ LYS 11 -10.138 6.125 -0.012
57 HZ2 LYS 11 1HZ LYS 11 -9.582 5.695 1.527
58 HZ3 LYS 11 2HZ LYS 11 -9.990 4.493 0.409
59 HA PRO 12 HA PRO 12 -4.869 7.896 -7.633
60 HB2 PRO 12 1HB PRO 12 -2.328 8.239 -6.742
61 HB3 PRO 12 2HB PRO 12 -3.580 9.476 -6.574
62 HG2 PRO 12 1HG PRO 12 -2.585 7.501 -4.556
63 HG3 PRO 12 2HG PRO 12 -2.960 9.222 -4.347
64 HD2 PRO 12 1HD PRO 12 -4.663 7.258 -3.589
65 HD3 PRO 12 2HD PRO 12 -5.225 8.837 -4.174
66 H TYR 13 H TYR 13 -3.298 5.706 -5.308
67 HA TYR 13 HA TYR 13 -2.509 4.000 -7.579
68 HB2 TYR 13 1HB TYR 13 -1.140 3.964 -4.899
69 HB3 TYR 13 2HB TYR 13 -0.545 3.367 -6.444
70 HD1 TYR 13 HD1 TYR 13 0.371 4.906 -8.104
71 HD2 TYR 13 HD2 TYR 13 -0.991 6.310 -4.325
72 HE1 TYR 13 HE1 TYR 13 1.546 7.034 -8.478
73 HE2 TYR 13 HE2 TYR 13 0.180 8.442 -4.689
74 HH TYR 13 HH TYR 13 1.437 9.641 -6.064
75 H GLU 14 H GLU 14 -3.079 1.891 -7.555
76 HA GLU 14 HA GLU 14 -4.154 0.717 -5.107
77 HB2 GLU 14 1HB GLU 14 -6.101 1.681 -6.236
78 HB3 GLU 14 2HB GLU 14 -5.686 0.821 -7.711
79 HG2 GLU 14 1HG GLU 14 -5.859 -1.289 -6.189
80 HG3 GLU 14 2HG GLU 14 -6.820 -0.225 -5.164
81 H CYS 15 H CYS 15 -3.957 -1.498 -4.987
82 HA CYS 15 HA CYS 15 -2.117 -2.683 -6.889
83 HB2 CYS 15 1HB CYS 15 -1.907 -2.939 -4.381
84 HB3 CYS 15 2HB CYS 15 -3.329 -3.975 -4.443
85 H SER 16 H SER 16 -2.499 -4.554 -8.087
86 HA SER 16 HA SER 16 -5.349 -5.175 -8.499
87 HB2 SER 16 1HB SER 16 -4.260 -4.147 -10.454
88 HB3 SER 16 2HB SER 16 -3.051 -5.430 -10.456
89 HG SER 16 HG SER 16 -5.772 -5.540 -11.134
90 H ILE 17 H ILE 17 -2.992 -6.357 -6.789
91 HA ILE 17 HA ILE 17 -3.183 -9.135 -7.705
92 HB ILE 17 HB ILE 17 -1.372 -7.841 -5.667
93 HG12 ILE 17 1HG1 ILE 17 -0.648 -9.240 -8.242
94 HG13 ILE 17 2HG1 ILE 17 -0.948 -7.507 -8.154
95 HG21 ILE 17 1HG2 ILE 17 -1.770 -9.988 -4.804
96 HG22 ILE 17 2HG2 ILE 17 -1.751 -10.726 -6.405
97 HG23 ILE 17 3HG2 ILE 17 -0.253 -10.128 -5.693
98 HD11 ILE 17 3HD1 ILE 17 0.888 -7.252 -6.592
99 HD12 ILE 17 1HD1 ILE 17 1.170 -8.992 -6.617
100 HD13 ILE 17 2HD1 ILE 17 1.432 -8.035 -8.075
101 H CYS 18 H CYS 18 -3.417 -7.287 -4.663
102 HA CYS 18 HA CYS 18 -5.096 -9.429 -3.561
103 HB2 CYS 18 1HB CYS 18 -4.682 -8.223 -1.371
104 HB3 CYS 18 2HB CYS 18 -3.264 -8.951 -2.119
105 H GLY 19 H GLY 19 -4.964 -5.892 -3.898
106 HA2 GLY 19 1HA GLY 19 -7.109 -4.918 -4.751
107 HA3 GLY 19 2HA GLY 19 -7.890 -5.851 -3.483
108 H LYS 20 H LYS 20 -4.827 -4.371 -2.844
109 HA LYS 20 HA LYS 20 -6.076 -2.673 -0.843
110 HB2 LYS 20 1HB LYS 20 -3.324 -3.661 -1.389
111 HB3 LYS 20 2HB LYS 20 -3.476 -2.130 -0.537
112 HG2 LYS 20 1HG LYS 20 -4.957 -3.285 1.109
113 HG3 LYS 20 2HG LYS 20 -4.558 -4.806 0.308
114 HD2 LYS 20 1HD LYS 20 -2.133 -4.257 0.726
115 HD3 LYS 20 2HD LYS 20 -2.692 -2.930 1.748
116 HE2 LYS 20 1HE LYS 20 -3.753 -4.430 3.255
117 HE3 LYS 20 2HE LYS 20 -3.542 -5.789 2.153
118 HZ1 LYS 20 3HZ LYS 20 -1.255 -5.856 2.570
119 HZ2 LYS 20 1HZ LYS 20 -1.953 -5.632 4.095
120 HZ3 LYS 20 2HZ LYS 20 -1.237 -4.327 3.293
121 H SER 21 H SER 21 -4.756 -0.469 -0.581
122 HA SER 21 HA SER 21 -4.208 0.826 -3.111
123 HB2 SER 21 1HB SER 21 -6.496 1.808 -1.389
124 HB3 SER 21 2HB SER 21 -5.917 2.546 -2.882
125 HG SER 21 HG SER 21 -7.368 1.302 -3.764
126 H PHE 22 H PHE 22 -2.966 2.654 -2.901
127 HA PHE 22 HA PHE 22 -2.409 3.610 -0.181
128 HB2 PHE 22 1HB PHE 22 -0.250 3.104 -2.233
129 HB3 PHE 22 2HB PHE 22 -0.034 3.584 -0.553
130 HD1 PHE 22 HD1 PHE 22 -1.383 0.832 -2.656
131 HD2 PHE 22 HD2 PHE 22 0.312 1.977 1.077
132 HE1 PHE 22 HE1 PHE 22 -1.224 -1.536 -2.006
133 HE2 PHE 22 HE2 PHE 22 0.474 -0.389 1.732
134 HZ PHE 22 HZ PHE 22 -0.294 -2.149 0.190
135 H THR 23 H THR 23 -1.775 5.769 -0.016
136 HA THR 23 HA THR 23 -2.445 7.387 -2.366
137 HB THR 23 HB THR 23 -2.531 9.286 -0.712
138 HG1 THR 23 HG1 THR 23 -2.850 8.308 1.541
139 HG21 THR 23 3HG2 THR 23 -4.662 8.625 -1.152
140 HG22 THR 23 1HG2 THR 23 -4.592 8.120 0.536
141 HG23 THR 23 2HG2 THR 23 -4.339 6.939 -0.748
142 H LYS 24 H LYS 24 0.175 6.025 -1.876
143 HA LYS 24 HA LYS 24 1.843 8.243 -2.627
144 HB2 LYS 24 1HB LYS 24 2.042 6.998 0.073
145 HB3 LYS 24 2HB LYS 24 3.539 7.413 -0.752
146 HG2 LYS 24 1HG LYS 24 2.663 9.733 -1.017
147 HG3 LYS 24 2HG LYS 24 1.295 9.271 -0.000
148 HD2 LYS 24 1HD LYS 24 2.778 10.243 1.508
149 HD3 LYS 24 2HD LYS 24 3.094 8.516 1.689
150 HE2 LYS 24 1HE LYS 24 4.927 8.871 -0.071
151 HE3 LYS 24 2HE LYS 24 4.733 10.590 0.266
152 HZ1 LYS 24 3HZ LYS 24 6.506 9.561 1.584
153 HZ2 LYS 24 1HZ LYS 24 5.377 8.526 2.302
154 HZ3 LYS 24 2HZ LYS 24 5.280 10.194 2.562
155 H LYS 25 H LYS 25 3.041 7.505 -4.239
156 HA LYS 25 HA LYS 25 3.202 4.946 -5.161
157 HB2 LYS 25 1HB LYS 25 4.945 7.339 -5.453
158 HB3 LYS 25 2HB LYS 25 5.591 5.799 -6.007
159 HG2 LYS 25 1HG LYS 25 3.349 5.591 -7.279
160 HG3 LYS 25 2HG LYS 25 3.235 7.333 -7.019
161 HD2 LYS 25 1HD LYS 25 5.718 6.107 -8.168
162 HD3 LYS 25 2HD LYS 25 4.328 6.466 -9.195
163 HE2 LYS 25 1HE LYS 25 5.311 8.594 -7.367
164 HE3 LYS 25 2HE LYS 25 6.271 8.223 -8.798
165 HZ1 LYS 25 3HZ LYS 25 3.996 8.429 -9.992
166 HZ2 LYS 25 1HZ LYS 25 4.851 9.829 -9.576
167 HZ3 LYS 25 2HZ LYS 25 3.549 9.319 -8.624
168 H SER 26 H SER 26 5.399 6.494 -2.852
169 HA SER 26 HA SER 26 7.275 4.451 -2.615
170 HB2 SER 26 1HB SER 26 6.316 6.367 -0.475
171 HB3 SER 26 2HB SER 26 7.804 5.424 -0.409
172 HG SER 26 HG SER 26 7.398 7.010 -2.661
173 H GLN 27 H GLN 27 4.268 4.975 -0.803
174 HA GLN 27 HA GLN 27 4.499 2.829 0.966
175 HB2 GLN 27 1HB GLN 27 1.983 4.011 -0.222
176 HB3 GLN 27 2HB GLN 27 2.054 2.990 1.208
177 HG2 GLN 27 1HG GLN 27 3.352 5.691 0.931
178 HG3 GLN 27 2HG GLN 27 1.831 5.364 1.759
179 HE21 GLN 27 1HE2 GLN 27 2.019 5.267 3.867
180 HE22 GLN 27 2HE2 GLN 27 3.397 4.712 4.750
181 H LEU 28 H LEU 28 2.833 2.970 -2.178
182 HA LEU 28 HA LEU 28 1.973 0.316 -2.249
183 HB2 LEU 28 1HB LEU 28 1.185 2.056 -3.781
184 HB3 LEU 28 2HB LEU 28 2.769 2.093 -4.552
185 HG LEU 28 HG LEU 28 2.322 -0.386 -5.099
186 HD11 LEU 28 1HD1 LEU 28 -0.554 0.386 -4.956
187 HD12 LEU 28 2HD1 LEU 28 0.242 -0.263 -3.523
188 HD13 LEU 28 3HD1 LEU 28 0.183 -1.216 -5.006
189 HD21 LEU 28 3HD2 LEU 28 2.419 1.265 -6.821
190 HD22 LEU 28 1HD2 LEU 28 0.824 1.884 -6.394
191 HD23 LEU 28 2HD2 LEU 28 0.984 0.277 -7.103
192 H HIS 29 H HIS 29 4.918 1.760 -3.637
193 HA HIS 29 HA HIS 29 6.059 -0.429 -4.813
194 HB2 HIS 29 1HB HIS 29 7.322 1.850 -3.299
195 HB3 HIS 29 2HB HIS 29 8.290 0.623 -4.111
196 HD2 HIS 29 HD2 HIS 29 5.527 1.055 -6.481
197 HE1 HIS 29 HE1 HIS 29 8.202 4.200 -7.454
198 HE2 HIS 29 HE2 HIS 29 6.159 2.912 -8.167
199 H VAL 30 H VAL 30 6.263 0.481 -1.387
200 HA VAL 30 HA VAL 30 7.895 -1.709 -0.620
201 HB VAL 30 HB VAL 30 6.007 -0.115 1.119
202 HG11 VAL 30 1HG1 VAL 30 8.401 -0.976 2.418
203 HG12 VAL 30 2HG1 VAL 30 6.725 -1.357 2.814
204 HG13 VAL 30 3HG1 VAL 30 7.613 -2.366 1.673
205 HG21 VAL 30 3HG2 VAL 30 8.530 0.837 1.592
206 HG22 VAL 30 1HG2 VAL 30 8.546 0.575 -0.152
207 HG23 VAL 30 2HG2 VAL 30 7.320 1.616 0.572
208 H HIS 31 H HIS 31 4.528 -1.387 -1.249
209 HA HIS 31 HA HIS 31 3.758 -3.721 0.277
210 HB2 HIS 31 1HB HIS 31 2.043 -2.133 0.184
211 HB3 HIS 31 2HB HIS 31 2.311 -1.803 -1.525
212 HD1 HIS 31 HD1 HIS 31 0.848 -4.458 0.735
213 HD2 HIS 31 HD2 HIS 31 0.761 -3.267 -3.244
214 HE1 HIS 31 HE1 HIS 31 -0.943 -5.854 -0.346
215 H GLN 32 H GLN 32 4.278 -2.865 -3.112
216 HA GLN 32 HA GLN 32 3.358 -5.174 -4.335
217 HB2 GLN 32 1HB GLN 32 5.737 -3.484 -5.124
218 HB3 GLN 32 2HB GLN 32 4.915 -4.634 -6.170
219 HG2 GLN 32 1HG GLN 32 2.822 -3.271 -5.813
220 HG3 GLN 32 2HG GLN 32 3.855 -2.052 -5.068
221 HE21 GLN 32 1HE2 GLN 32 4.388 -0.483 -6.388
222 HE22 GLN 32 2HE2 GLN 32 4.633 -0.615 -8.093
223 H GLN 33 H GLN 33 6.319 -4.608 -2.573
224 HA GLN 33 HA GLN 33 7.646 -6.983 -3.442
225 HB2 GLN 33 1HB GLN 33 9.195 -6.513 -1.556
226 HB3 GLN 33 2HB GLN 33 8.961 -5.136 -2.625
227 HG2 GLN 33 1HG GLN 33 7.862 -3.917 -1.050
228 HG3 GLN 33 2HG GLN 33 7.218 -5.342 -0.236
229 HE21 GLN 33 1HE2 GLN 33 9.198 -2.833 0.184
230 HE22 GLN 33 2HE2 GLN 33 10.327 -3.501 1.308
231 H ILE 34 H ILE 34 5.228 -6.289 -1.110
232 HA ILE 34 HA ILE 34 5.674 -8.319 0.767
233 HB ILE 34 HB ILE 34 3.962 -6.380 0.819
234 HG12 ILE 34 1HG1 ILE 34 2.849 -8.995 1.792
235 HG13 ILE 34 2HG1 ILE 34 4.341 -8.354 2.471
236 HG21 ILE 34 1HG2 ILE 34 2.881 -7.532 -1.316
237 HG22 ILE 34 2HG2 ILE 34 1.960 -8.376 -0.072
238 HG23 ILE 34 3HG2 ILE 34 1.920 -6.615 -0.156
239 HD11 ILE 34 3HD1 ILE 34 2.350 -7.796 3.799
240 HD12 ILE 34 1HD1 ILE 34 3.200 -6.369 3.208
241 HD13 ILE 34 2HD1 ILE 34 1.711 -6.897 2.423
242 H HIS 35 H HIS 35 4.235 -8.386 -2.416
243 HA HIS 35 HA HIS 35 3.191 -11.063 -2.102
244 HB2 HIS 35 1HB HIS 35 3.479 -9.440 -4.636
245 HB3 HIS 35 2HB HIS 35 2.463 -10.858 -4.400
246 HD1 HIS 35 HD1 HIS 35 0.519 -10.472 -2.482
247 HD2 HIS 35 HD2 HIS 35 2.174 -7.100 -4.257
248 HE1 HIS 35 HE1 HIS 35 -1.113 -8.611 -2.041
249 H THR 36 H THR 36 5.723 -9.543 -4.097
250 HA THR 36 HA THR 36 6.812 -12.151 -4.772
251 HB THR 36 HB THR 36 6.756 -10.513 -6.551
252 HG1 THR 36 HG1 THR 36 8.738 -11.946 -6.062
253 HG21 THR 36 3HG2 THR 36 8.818 -8.728 -5.541
254 HG22 THR 36 1HG2 THR 36 7.344 -8.668 -4.574
255 HG23 THR 36 2HG2 THR 36 7.275 -8.350 -6.307
256 H GLY 37 H GLY 37 7.674 -12.958 -2.871
257 HA2 GLY 37 1HA GLY 37 10.264 -12.678 -2.239
258 HA3 GLY 37 2HA GLY 37 9.546 -11.353 -1.336
259 H GLU 38 H GLU 38 7.138 -12.571 -0.574
260 HA GLU 38 HA GLU 38 6.225 -13.954 0.992
261 HB2 GLU 38 1HB GLU 38 7.477 -15.696 -0.492
262 HB3 GLU 38 2HB GLU 38 8.610 -15.767 0.851
263 HG2 GLU 38 1HG GLU 38 6.906 -17.528 0.950
264 HG3 GLU 38 2HG GLU 38 6.863 -16.461 2.352
265 H LYS 39 H LYS 39 7.764 -11.761 1.791
266 HA LYS 39 HA LYS 39 8.975 -12.759 4.287
267 HB2 LYS 39 1HB LYS 39 9.787 -10.555 2.440
268 HB3 LYS 39 2HB LYS 39 10.115 -10.379 4.159
269 HG2 LYS 39 1HG LYS 39 11.295 -12.584 4.071
270 HG3 LYS 39 2HG LYS 39 11.114 -12.535 2.315
271 HD2 LYS 39 1HD LYS 39 13.217 -11.626 2.590
272 HD3 LYS 39 2HD LYS 39 12.210 -10.177 2.554
273 HE2 LYS 39 1HE LYS 39 12.773 -11.488 5.172
274 HE3 LYS 39 2HE LYS 39 14.033 -10.514 4.416
275 HZ1 LYS 39 3HZ LYS 39 13.031 -8.788 5.365
276 HZ2 LYS 39 1HZ LYS 39 11.645 -9.678 5.750
277 HZ3 LYS 39 2HZ LYS 39 11.798 -8.971 4.222
278 HA PRO 40 HA PRO 40 5.859 -10.537 6.462
279 HB2 PRO 40 1HB PRO 40 7.131 -10.223 8.840
280 HB3 PRO 40 2HB PRO 40 6.472 -11.772 8.300
281 HG2 PRO 40 1HG PRO 40 9.292 -10.773 8.194
282 HG3 PRO 40 2HG PRO 40 8.690 -12.376 8.654
283 HD2 PRO 40 1HD PRO 40 9.731 -11.857 6.209
284 HD3 PRO 40 2HD PRO 40 8.440 -13.049 6.464
285 H SER 41 H SER 41 5.926 -8.598 5.209
286 HA SER 41 HA SER 41 7.783 -6.567 5.333
287 HB2 SER 41 1HB SER 41 5.957 -5.049 4.647
288 HB3 SER 41 2HB SER 41 5.920 -6.562 3.744
289 HG SER 41 HG SER 41 4.164 -5.600 5.692
290 H GLY 42 H GLY 42 8.320 -5.000 6.744
291 HA2 GLY 42 1HA GLY 42 6.849 -3.668 8.589
292 HA3 GLY 42 2HA GLY 42 7.251 -5.164 9.421
293 HA PRO 43 HA PRO 43 11.215 -3.679 10.544
294 HB2 PRO 43 1HB PRO 43 12.912 -5.709 9.936
295 HB3 PRO 43 2HB PRO 43 11.757 -5.789 11.272
296 HG2 PRO 43 1HG PRO 43 11.548 -6.936 8.515
297 HG3 PRO 43 2HG PRO 43 11.118 -7.674 10.069
298 HD2 PRO 43 1HD PRO 43 9.272 -6.590 8.412
299 HD3 PRO 43 2HD PRO 43 9.098 -6.569 10.178
300 H SER 44 H SER 44 11.697 -1.949 9.234
301 HA SER 44 HA SER 44 13.743 -2.359 7.258
302 HB2 SER 44 1HB SER 44 12.619 -1.484 5.351
303 HB3 SER 44 2HB SER 44 11.544 -2.711 6.020
304 HG SER 44 HG SER 44 10.177 -1.090 5.854
305 H SER 45 H SER 45 15.072 -0.638 7.145
306 HA SER 45 HA SER 45 14.987 1.385 9.037
307 HB2 SER 45 1HB SER 45 16.402 1.365 6.360
308 HB3 SER 45 2HB SER 45 16.733 2.506 7.663
309 HG SER 45 HG SER 45 17.727 0.072 7.328
310 H GLY 46 H GLY 46 14.157 1.600 5.576
311 HA2 GLY 46 1HA GLY 46 13.068 3.274 4.409
312 HA3 GLY 46 2HA GLY 46 11.893 3.078 5.702
Start of MODEL 6
1 H1 GLY 1 H GLY 1 -17.317 -7.796 -6.579
2 HA2 GLY 1 1HA GLY 1 -18.640 -7.420 -8.964
3 HA3 GLY 1 2HA GLY 1 -19.422 -8.809 -8.224
4 H SER 2 H SER 2 -19.249 -8.026 -5.529
5 HA SER 2 HA SER 2 -21.569 -6.697 -5.079
6 HB2 SER 2 1HB SER 2 -20.838 -6.299 -2.832
7 HB3 SER 2 2HB SER 2 -20.092 -7.809 -3.354
8 HG SER 2 HG SER 2 -18.797 -5.951 -2.293
9 H SER 3 H SER 3 -22.244 -4.593 -4.739
10 HA SER 3 HA SER 3 -21.355 -2.600 -6.373
11 HB2 SER 3 1HB SER 3 -23.477 -2.693 -4.911
12 HB3 SER 3 2HB SER 3 -22.486 -1.947 -3.657
13 HG SER 3 HG SER 3 -23.596 -0.838 -5.883
14 H GLY 4 H GLY 4 -19.709 -1.197 -6.429
15 HA2 GLY 4 1HA GLY 4 -17.952 -1.078 -4.058
16 HA3 GLY 4 2HA GLY 4 -17.383 -0.948 -5.715
17 H SER 5 H SER 5 -19.624 0.657 -3.459
18 HA SER 5 HA SER 5 -18.725 3.233 -4.578
19 HB2 SER 5 1HB SER 5 -21.473 2.455 -3.579
20 HB3 SER 5 2HB SER 5 -20.993 4.112 -3.946
21 HG SER 5 HG SER 5 -21.351 3.692 -5.962
22 H SER 6 H SER 6 -17.194 3.742 -3.076
23 HA SER 6 HA SER 6 -18.153 4.600 -0.493
24 HB2 SER 6 1HB SER 6 -16.033 2.447 -0.687
25 HB3 SER 6 2HB SER 6 -16.469 3.308 0.788
26 HG SER 6 HG SER 6 -18.059 1.534 -0.739
27 H GLY 7 H GLY 7 -17.319 6.560 -0.267
28 HA2 GLY 7 1HA GLY 7 -15.422 7.962 0.157
29 HA3 GLY 7 2HA GLY 7 -14.490 6.976 -0.960
30 H THR 8 H THR 8 -15.091 9.929 -0.784
31 HA THR 8 HA THR 8 -16.662 10.513 -3.122
32 HB THR 8 HB THR 8 -14.882 12.300 -1.454
33 HG1 THR 8 HG1 THR 8 -17.720 12.259 -1.553
34 HG21 THR 8 3HG2 THR 8 -16.713 13.911 -2.705
35 HG22 THR 8 1HG2 THR 8 -16.311 12.750 -3.968
36 HG23 THR 8 2HG2 THR 8 -15.036 13.699 -3.205
37 H GLY 9 H GLY 9 -13.207 10.844 -2.291
38 HA2 GLY 9 1HA GLY 9 -12.582 11.243 -5.121
39 HA3 GLY 9 2HA GLY 9 -11.475 11.460 -3.773
40 H GLU 10 H GLU 10 -11.361 9.884 -6.354
41 HA GLU 10 HA GLU 10 -11.236 7.134 -5.480
42 HB2 GLU 10 1HB GLU 10 -11.936 7.725 -7.774
43 HB3 GLU 10 2HB GLU 10 -10.337 8.388 -8.080
44 HG2 GLU 10 1HG GLU 10 -10.249 6.286 -9.044
45 HG3 GLU 10 2HG GLU 10 -9.468 6.054 -7.481
46 H LYS 11 H LYS 11 -9.525 6.133 -4.653
47 HA LYS 11 HA LYS 11 -7.229 7.387 -3.801
48 HB2 LYS 11 1HB LYS 11 -6.516 5.327 -3.087
49 HB3 LYS 11 2HB LYS 11 -8.220 4.978 -3.349
50 HG2 LYS 11 1HG LYS 11 -5.965 4.368 -5.250
51 HG3 LYS 11 2HG LYS 11 -6.837 3.207 -4.246
52 HD2 LYS 11 1HD LYS 11 -8.403 4.931 -6.100
53 HD3 LYS 11 2HD LYS 11 -7.472 3.595 -6.783
54 HE2 LYS 11 1HE LYS 11 -8.596 2.134 -5.022
55 HE3 LYS 11 2HE LYS 11 -9.697 3.487 -4.764
56 HZ1 LYS 11 3HZ LYS 11 -9.813 3.260 -7.408
57 HZ2 LYS 11 1HZ LYS 11 -10.863 2.444 -6.361
58 HZ3 LYS 11 2HZ LYS 11 -9.516 1.645 -7.001
59 HA PRO 12 HA PRO 12 -4.730 7.993 -7.375
60 HB2 PRO 12 1HB PRO 12 -2.296 8.123 -6.181
61 HB3 PRO 12 2HB PRO 12 -3.487 9.425 -6.078
62 HG2 PRO 12 1HG PRO 12 -2.849 7.280 -4.090
63 HG3 PRO 12 2HG PRO 12 -3.148 9.007 -3.816
64 HD2 PRO 12 1HD PRO 12 -5.037 7.115 -3.384
65 HD3 PRO 12 2HD PRO 12 -5.437 8.757 -3.927
66 H TYR 13 H TYR 13 -3.420 5.650 -5.025
67 HA TYR 13 HA TYR 13 -2.629 3.953 -7.303
68 HB2 TYR 13 1HB TYR 13 -1.287 3.826 -4.617
69 HB3 TYR 13 2HB TYR 13 -0.687 3.274 -6.177
70 HD1 TYR 13 HD1 TYR 13 0.270 4.854 -7.773
71 HD2 TYR 13 HD2 TYR 13 -1.096 6.145 -3.956
72 HE1 TYR 13 HE1 TYR 13 1.489 6.971 -8.060
73 HE2 TYR 13 HE2 TYR 13 0.118 8.266 -4.232
74 HH TYR 13 HH TYR 13 0.939 9.664 -6.280
75 H GLU 14 H GLU 14 -2.733 1.657 -6.966
76 HA GLU 14 HA GLU 14 -3.959 0.534 -4.656
77 HB2 GLU 14 1HB GLU 14 -5.909 1.668 -5.751
78 HB3 GLU 14 2HB GLU 14 -5.674 0.618 -7.141
79 HG2 GLU 14 1HG GLU 14 -5.920 -1.319 -5.500
80 HG3 GLU 14 2HG GLU 14 -6.543 -0.118 -4.370
81 H CYS 15 H CYS 15 -3.480 -1.578 -4.539
82 HA CYS 15 HA CYS 15 -1.940 -2.768 -6.647
83 HB2 CYS 15 1HB CYS 15 -1.398 -3.145 -4.272
84 HB3 CYS 15 2HB CYS 15 -2.939 -3.968 -4.055
85 H SER 16 H SER 16 -2.412 -4.732 -7.737
86 HA SER 16 HA SER 16 -5.296 -5.152 -8.126
87 HB2 SER 16 1HB SER 16 -3.680 -4.480 -10.056
88 HB3 SER 16 2HB SER 16 -3.181 -6.171 -10.004
89 HG SER 16 HG SER 16 -4.884 -6.544 -11.161
90 H ILE 17 H ILE 17 -2.320 -6.705 -7.233
91 HA ILE 17 HA ILE 17 -3.080 -9.392 -7.548
92 HB ILE 17 HB ILE 17 -1.153 -8.158 -5.578
93 HG12 ILE 17 1HG1 ILE 17 -0.355 -9.753 -7.976
94 HG13 ILE 17 2HG1 ILE 17 -0.869 -8.085 -8.208
95 HG21 ILE 17 1HG2 ILE 17 -1.635 -11.041 -6.302
96 HG22 ILE 17 2HG2 ILE 17 -0.206 -10.465 -5.445
97 HG23 ILE 17 3HG2 ILE 17 -1.803 -10.289 -4.716
98 HD11 ILE 17 3HD1 ILE 17 1.165 -8.638 -6.123
99 HD12 ILE 17 1HD1 ILE 17 1.653 -8.725 -7.815
100 HD13 ILE 17 2HD1 ILE 17 0.965 -7.234 -7.171
101 H CYS 18 H CYS 18 -2.999 -7.453 -4.550
102 HA CYS 18 HA CYS 18 -4.815 -9.364 -3.295
103 HB2 CYS 18 1HB CYS 18 -4.318 -8.139 -1.213
104 HB3 CYS 18 2HB CYS 18 -2.851 -8.696 -2.012
105 H GLY 19 H GLY 19 -4.611 -5.904 -4.052
106 HA2 GLY 19 1HA GLY 19 -6.611 -4.807 -4.905
107 HA3 GLY 19 2HA GLY 19 -7.550 -5.788 -3.790
108 H LYS 20 H LYS 20 -4.553 -4.312 -2.809
109 HA LYS 20 HA LYS 20 -5.961 -2.805 -0.774
110 HB2 LYS 20 1HB LYS 20 -3.117 -3.525 -1.316
111 HB3 LYS 20 2HB LYS 20 -3.440 -2.119 -0.311
112 HG2 LYS 20 1HG LYS 20 -4.995 -3.732 0.998
113 HG3 LYS 20 2HG LYS 20 -4.048 -4.995 0.208
114 HD2 LYS 20 1HD LYS 20 -2.008 -3.614 1.061
115 HD3 LYS 20 2HD LYS 20 -3.180 -2.930 2.190
116 HE2 LYS 20 1HE LYS 20 -3.046 -5.889 1.879
117 HE3 LYS 20 2HE LYS 20 -1.780 -5.078 2.799
118 HZ1 LYS 20 3HZ LYS 20 -3.198 -4.545 4.456
119 HZ2 LYS 20 1HZ LYS 20 -4.035 -5.902 3.891
120 HZ3 LYS 20 2HZ LYS 20 -4.530 -4.352 3.431
121 H SER 21 H SER 21 -5.052 -0.525 -0.319
122 HA SER 21 HA SER 21 -4.588 0.958 -2.805
123 HB2 SER 21 1HB SER 21 -6.247 2.692 -1.986
124 HB3 SER 21 2HB SER 21 -6.952 1.172 -2.537
125 HG SER 21 HG SER 21 -7.557 2.212 -0.356
126 H PHE 22 H PHE 22 -3.260 2.695 -2.606
127 HA PHE 22 HA PHE 22 -2.461 3.511 0.102
128 HB2 PHE 22 1HB PHE 22 -0.515 3.107 -2.174
129 HB3 PHE 22 2HB PHE 22 -0.130 3.514 -0.505
130 HD1 PHE 22 HD1 PHE 22 -1.372 0.853 -2.730
131 HD2 PHE 22 HD2 PHE 22 0.045 1.841 1.160
132 HE1 PHE 22 HE1 PHE 22 -1.160 -1.541 -2.202
133 HE2 PHE 22 HE2 PHE 22 0.259 -0.551 1.694
134 HZ PHE 22 HZ PHE 22 -0.343 -2.246 0.012
135 H THR 23 H THR 23 -1.856 5.658 0.344
136 HA THR 23 HA THR 23 -2.808 7.423 -1.769
137 HB THR 23 HB THR 23 -2.482 9.223 -0.035
138 HG1 THR 23 HG1 THR 23 -1.016 8.341 1.363
139 HG21 THR 23 3HG2 THR 23 -4.685 8.614 -0.114
140 HG22 THR 23 1HG2 THR 23 -4.310 8.102 1.531
141 HG23 THR 23 2HG2 THR 23 -4.343 6.918 0.224
142 H LYS 24 H LYS 24 0.122 6.164 -0.667
143 HA LYS 24 HA LYS 24 1.609 8.312 -2.031
144 HB2 LYS 24 1HB LYS 24 2.274 6.779 0.467
145 HB3 LYS 24 2HB LYS 24 3.546 7.502 -0.510
146 HG2 LYS 24 1HG LYS 24 1.242 9.181 0.357
147 HG3 LYS 24 2HG LYS 24 2.525 8.798 1.507
148 HD2 LYS 24 1HD LYS 24 3.095 9.930 -1.220
149 HD3 LYS 24 2HD LYS 24 2.769 10.958 0.178
150 HE2 LYS 24 1HE LYS 24 4.904 8.836 0.161
151 HE3 LYS 24 2HE LYS 24 5.204 10.502 -0.331
152 HZ1 LYS 24 3HZ LYS 24 4.441 11.217 1.874
153 HZ2 LYS 24 1HZ LYS 24 5.796 10.207 1.966
154 HZ3 LYS 24 2HZ LYS 24 4.261 9.600 2.336
155 H LYS 25 H LYS 25 2.668 7.682 -3.787
156 HA LYS 25 HA LYS 25 2.581 5.206 -4.935
157 HB2 LYS 25 1HB LYS 25 3.335 7.239 -6.098
158 HB3 LYS 25 2HB LYS 25 4.836 7.207 -5.182
159 HG2 LYS 25 1HG LYS 25 5.459 5.108 -6.222
160 HG3 LYS 25 2HG LYS 25 3.926 5.068 -7.097
161 HD2 LYS 25 1HD LYS 25 5.646 7.475 -7.394
162 HD3 LYS 25 2HD LYS 25 6.147 5.992 -8.209
163 HE2 LYS 25 1HE LYS 25 4.034 5.871 -9.371
164 HE3 LYS 25 2HE LYS 25 3.424 7.262 -8.476
165 HZ1 LYS 25 3HZ LYS 25 4.367 8.634 -9.920
166 HZ2 LYS 25 1HZ LYS 25 4.743 7.300 -10.889
167 HZ3 LYS 25 2HZ LYS 25 5.874 7.879 -9.773
168 H SER 26 H SER 26 5.121 6.460 -2.800
169 HA SER 26 HA SER 26 6.930 4.384 -2.918
170 HB2 SER 26 1HB SER 26 7.504 6.353 -1.689
171 HB3 SER 26 2HB SER 26 6.140 6.143 -0.591
172 HG SER 26 HG SER 26 7.255 4.744 0.531
173 H GLN 27 H GLN 27 4.156 4.693 -0.709
174 HA GLN 27 HA GLN 27 4.451 2.362 0.729
175 HB2 GLN 27 1HB GLN 27 1.918 3.719 -0.201
176 HB3 GLN 27 2HB GLN 27 1.953 2.416 0.980
177 HG2 GLN 27 1HG GLN 27 3.603 4.860 1.422
178 HG3 GLN 27 2HG GLN 27 1.873 4.890 1.761
179 HE21 GLN 27 1HE2 GLN 27 1.912 4.995 3.934
180 HE22 GLN 27 2HE2 GLN 27 2.592 3.783 4.959
181 H LEU 28 H LEU 28 2.781 2.802 -2.375
182 HA LEU 28 HA LEU 28 1.909 0.150 -2.671
183 HB2 LEU 28 1HB LEU 28 0.990 1.921 -4.014
184 HB3 LEU 28 2HB LEU 28 2.567 2.250 -4.729
185 HG LEU 28 HG LEU 28 2.429 -0.114 -5.691
186 HD11 LEU 28 1HD1 LEU 28 -0.471 0.285 -4.973
187 HD12 LEU 28 2HD1 LEU 28 0.612 -0.922 -4.282
188 HD13 LEU 28 3HD1 LEU 28 0.176 -1.003 -5.989
189 HD21 LEU 28 3HD2 LEU 28 0.254 1.489 -6.888
190 HD22 LEU 28 1HD2 LEU 28 1.683 0.774 -7.634
191 HD23 LEU 28 2HD2 LEU 28 1.823 2.279 -6.726
192 H HIS 29 H HIS 29 4.804 1.776 -3.954
193 HA HIS 29 HA HIS 29 5.923 -0.317 -5.357
194 HB2 HIS 29 1HB HIS 29 7.022 2.069 -3.956
195 HB3 HIS 29 2HB HIS 29 8.163 0.822 -4.453
196 HD2 HIS 29 HD2 HIS 29 6.482 0.250 -7.366
197 HE1 HIS 29 HE1 HIS 29 7.743 4.227 -8.135
198 HE2 HIS 29 HE2 HIS 29 6.794 2.116 -9.129
199 H VAL 30 H VAL 30 6.635 0.541 -1.966
200 HA VAL 30 HA VAL 30 8.217 -1.717 -1.425
201 HB VAL 30 HB VAL 30 6.592 -0.054 0.505
202 HG11 VAL 30 1HG1 VAL 30 9.046 -1.607 1.224
203 HG12 VAL 30 2HG1 VAL 30 7.750 -1.015 2.265
204 HG13 VAL 30 3HG1 VAL 30 7.468 -2.394 1.203
205 HG21 VAL 30 3HG2 VAL 30 8.514 0.917 -1.054
206 HG22 VAL 30 1HG2 VAL 30 8.307 1.439 0.618
207 HG23 VAL 30 2HG2 VAL 30 9.531 0.235 0.215
208 H HIS 31 H HIS 31 4.753 -1.167 -1.206
209 HA HIS 31 HA HIS 31 4.046 -3.439 0.274
210 HB2 HIS 31 1HB HIS 31 2.333 -1.874 0.032
211 HB3 HIS 31 2HB HIS 31 2.593 -1.711 -1.702
212 HD1 HIS 31 HD1 HIS 31 1.213 -4.219 0.785
213 HD2 HIS 31 HD2 HIS 31 0.935 -3.230 -3.240
214 HE1 HIS 31 HE1 HIS 31 -0.616 -5.676 -0.141
215 H GLN 32 H GLN 32 4.083 -2.974 -3.261
216 HA GLN 32 HA GLN 32 3.260 -5.367 -4.185
217 HB2 GLN 32 1HB GLN 32 5.647 -3.787 -5.151
218 HB3 GLN 32 2HB GLN 32 4.917 -5.111 -6.049
219 HG2 GLN 32 1HG GLN 32 2.733 -3.700 -5.754
220 HG3 GLN 32 2HG GLN 32 3.873 -2.377 -5.514
221 HE21 GLN 32 1HE2 GLN 32 2.752 -1.603 -7.479
222 HE22 GLN 32 2HE2 GLN 32 3.370 -2.102 -9.013
223 H GLN 33 H GLN 33 6.331 -4.724 -2.616
224 HA GLN 33 HA GLN 33 7.732 -7.031 -3.222
225 HB2 GLN 33 1HB GLN 33 7.700 -5.549 -0.587
226 HB3 GLN 33 2HB GLN 33 8.946 -6.672 -1.115
227 HG2 GLN 33 1HG GLN 33 9.414 -5.163 -3.029
228 HG3 GLN 33 2HG GLN 33 8.268 -4.012 -2.343
229 HE21 GLN 33 1HE2 GLN 33 11.038 -3.567 -2.841
230 HE22 GLN 33 2HE2 GLN 33 11.790 -3.240 -1.321
231 H ILE 34 H ILE 34 5.460 -6.488 -0.541
232 HA ILE 34 HA ILE 34 5.582 -8.789 0.858
233 HB ILE 34 HB ILE 34 3.937 -6.919 1.213
234 HG12 ILE 34 1HG1 ILE 34 2.429 -9.499 1.309
235 HG13 ILE 34 2HG1 ILE 34 3.927 -9.361 2.224
236 HG21 ILE 34 1HG2 ILE 34 1.858 -8.315 -0.314
237 HG22 ILE 34 2HG2 ILE 34 2.148 -6.589 -0.102
238 HG23 ILE 34 3HG2 ILE 34 3.075 -7.499 -1.294
239 HD11 ILE 34 3HD1 ILE 34 1.461 -7.666 2.509
240 HD12 ILE 34 1HD1 ILE 34 2.096 -8.840 3.661
241 HD13 ILE 34 2HD1 ILE 34 2.986 -7.352 3.336
242 H HIS 35 H HIS 35 4.491 -8.459 -2.419
243 HA HIS 35 HA HIS 35 3.493 -11.209 -2.470
244 HB2 HIS 35 1HB HIS 35 3.497 -9.215 -4.738
245 HB3 HIS 35 2HB HIS 35 2.551 -10.695 -4.612
246 HD1 HIS 35 HD1 HIS 35 1.028 -10.540 -2.149
247 HD2 HIS 35 HD2 HIS 35 1.884 -7.103 -4.322
248 HE1 HIS 35 HE1 HIS 35 -0.690 -8.849 -1.436
249 H THR 36 H THR 36 6.191 -11.075 -2.012
250 HA THR 36 HA THR 36 7.478 -11.600 -4.593
251 HB THR 36 HB THR 36 8.732 -10.081 -3.219
252 HG1 THR 36 HG1 THR 36 9.744 -12.149 -4.248
253 HG21 THR 36 3HG2 THR 36 7.860 -11.822 -1.088
254 HG22 THR 36 1HG2 THR 36 8.512 -10.186 -1.001
255 HG23 THR 36 2HG2 THR 36 9.604 -11.571 -1.022
256 H GLY 37 H GLY 37 6.207 -13.192 -1.838
257 HA2 GLY 37 1HA GLY 37 6.161 -15.394 -1.191
258 HA3 GLY 37 2HA GLY 37 6.403 -15.752 -2.894
259 H GLU 38 H GLU 38 7.891 -15.484 0.222
260 HA GLU 38 HA GLU 38 10.097 -17.113 -0.646
261 HB2 GLU 38 1HB GLU 38 10.749 -14.719 -1.208
262 HB3 GLU 38 2HB GLU 38 10.774 -14.418 0.523
263 HG2 GLU 38 1HG GLU 38 12.395 -16.415 0.625
264 HG3 GLU 38 2HG GLU 38 12.572 -16.160 -1.110
265 H LYS 39 H LYS 39 10.967 -18.275 1.008
266 HA LYS 39 HA LYS 39 9.736 -17.888 3.640
267 HB2 LYS 39 1HB LYS 39 11.107 -20.258 2.368
268 HB3 LYS 39 2HB LYS 39 10.633 -20.220 4.061
269 HG2 LYS 39 1HG LYS 39 8.597 -19.634 1.965
270 HG3 LYS 39 2HG LYS 39 9.079 -21.305 2.270
271 HD2 LYS 39 1HD LYS 39 8.182 -21.321 4.381
272 HD3 LYS 39 2HD LYS 39 8.379 -19.580 4.595
273 HE2 LYS 39 1HE LYS 39 6.464 -19.091 3.366
274 HE3 LYS 39 2HE LYS 39 6.454 -20.665 2.573
275 HZ1 LYS 39 3HZ LYS 39 4.716 -20.445 4.268
276 HZ2 LYS 39 1HZ LYS 39 5.899 -20.219 5.456
277 HZ3 LYS 39 2HZ LYS 39 5.799 -21.692 4.632
278 HA PRO 40 HA PRO 40 13.479 -16.483 5.470
279 HB2 PRO 40 1HB PRO 40 13.098 -17.331 8.022
280 HB3 PRO 40 2HB PRO 40 12.217 -15.969 7.320
281 HG2 PRO 40 1HG PRO 40 11.342 -18.809 7.677
282 HG3 PRO 40 2HG PRO 40 10.435 -17.314 7.969
283 HD2 PRO 40 1HD PRO 40 10.109 -18.802 5.730
284 HD3 PRO 40 2HD PRO 40 9.930 -17.036 5.737
285 H SER 41 H SER 41 12.734 -19.751 5.083
286 HA SER 41 HA SER 41 14.374 -21.302 6.500
287 HB2 SER 41 1HB SER 41 13.027 -21.854 4.348
288 HB3 SER 41 2HB SER 41 14.544 -21.535 3.507
289 HG SER 41 HG SER 41 14.112 -23.446 5.561
290 H GLY 42 H GLY 42 16.478 -21.522 6.958
291 HA2 GLY 42 1HA GLY 42 18.694 -21.257 5.459
292 HA3 GLY 42 2HA GLY 42 18.333 -19.585 5.858
293 HA PRO 43 HA PRO 43 19.250 -21.768 10.074
294 HB2 PRO 43 1HB PRO 43 20.161 -24.323 9.954
295 HB3 PRO 43 2HB PRO 43 18.444 -23.920 10.077
296 HG2 PRO 43 1HG PRO 43 20.047 -24.663 7.661
297 HG3 PRO 43 2HG PRO 43 18.423 -25.196 8.133
298 HD2 PRO 43 1HD PRO 43 18.842 -23.265 6.281
299 HD3 PRO 43 2HD PRO 43 17.428 -23.268 7.353
300 H SER 44 H SER 44 20.991 -20.354 10.086
301 HA SER 44 HA SER 44 23.584 -21.526 9.314
302 HB2 SER 44 1HB SER 44 22.610 -19.407 8.063
303 HB3 SER 44 2HB SER 44 23.236 -18.560 9.477
304 HG SER 44 HG SER 44 24.929 -18.598 8.125
305 H SER 45 H SER 45 22.335 -18.861 11.334
306 HA SER 45 HA SER 45 24.310 -18.504 13.111
307 HB2 SER 45 1HB SER 45 22.173 -17.307 13.243
308 HB3 SER 45 2HB SER 45 21.382 -18.764 13.845
309 HG SER 45 HG SER 45 22.029 -17.247 15.498
310 H GLY 46 H GLY 46 21.772 -20.970 13.603
311 HA2 GLY 46 1HA GLY 46 22.794 -23.240 14.138
312 HA3 GLY 46 2HA GLY 46 23.634 -22.370 15.413
Start of MODEL 7
1 H1 GLY 1 H GLY 1 -15.738 -2.014 -18.552
2 HA2 GLY 1 1HA GLY 1 -14.519 -0.319 -19.819
3 HA3 GLY 1 2HA GLY 1 -16.032 0.070 -20.624
4 H SER 2 H SER 2 -14.608 -0.042 -17.362
5 HA SER 2 HA SER 2 -16.422 1.553 -16.036
6 HB2 SER 2 1HB SER 2 -13.528 0.955 -15.673
7 HB3 SER 2 2HB SER 2 -14.198 2.303 -14.756
8 HG SER 2 HG SER 2 -14.281 -0.038 -13.923
9 H SER 3 H SER 3 -16.061 3.815 -15.233
10 HA SER 3 HA SER 3 -15.125 5.524 -17.444
11 HB2 SER 3 1HB SER 3 -17.637 5.463 -16.916
12 HB3 SER 3 2HB SER 3 -17.225 6.329 -15.436
13 HG SER 3 HG SER 3 -17.185 8.064 -16.599
14 H GLY 4 H GLY 4 -14.046 7.455 -16.937
15 HA2 GLY 4 1HA GLY 4 -12.769 7.406 -14.289
16 HA3 GLY 4 2HA GLY 4 -12.122 8.189 -15.723
17 H SER 5 H SER 5 -14.254 9.694 -16.569
18 HA SER 5 HA SER 5 -14.042 12.059 -15.296
19 HB2 SER 5 1HB SER 5 -15.264 11.971 -17.343
20 HB3 SER 5 2HB SER 5 -16.475 10.891 -16.653
21 HG SER 5 HG SER 5 -16.279 13.622 -16.524
22 H SER 6 H SER 6 -16.694 9.766 -14.628
23 HA SER 6 HA SER 6 -17.500 11.208 -12.279
24 HB2 SER 6 1HB SER 6 -18.363 8.599 -13.521
25 HB3 SER 6 2HB SER 6 -18.998 9.145 -11.970
26 HG SER 6 HG SER 6 -20.335 9.815 -13.680
27 H GLY 7 H GLY 7 -16.590 11.057 -10.345
28 HA2 GLY 7 1HA GLY 7 -15.536 8.475 -9.451
29 HA3 GLY 7 2HA GLY 7 -14.434 9.843 -9.469
30 H THR 8 H THR 8 -15.889 8.081 -7.352
31 HA THR 8 HA THR 8 -16.915 10.306 -5.717
32 HB THR 8 HB THR 8 -18.561 8.526 -6.097
33 HG1 THR 8 HG1 THR 8 -18.009 9.619 -3.867
34 HG21 THR 8 3HG2 THR 8 -18.182 6.314 -5.784
35 HG22 THR 8 1HG2 THR 8 -17.119 6.582 -4.404
36 HG23 THR 8 2HG2 THR 8 -16.503 6.785 -6.044
37 H GLY 9 H GLY 9 -14.772 10.928 -5.087
38 HA2 GLY 9 1HA GLY 9 -12.787 10.749 -3.892
39 HA3 GLY 9 2HA GLY 9 -13.918 10.287 -2.628
40 H GLU 10 H GLU 10 -11.649 9.130 -5.023
41 HA GLU 10 HA GLU 10 -11.567 6.557 -3.597
42 HB2 GLU 10 1HB GLU 10 -12.650 6.632 -5.995
43 HB3 GLU 10 2HB GLU 10 -10.975 6.672 -6.526
44 HG2 GLU 10 1HG GLU 10 -11.808 4.407 -6.530
45 HG3 GLU 10 2HG GLU 10 -10.542 4.592 -5.317
46 H LYS 11 H LYS 11 -9.541 5.573 -3.425
47 HA LYS 11 HA LYS 11 -7.351 7.245 -3.064
48 HB2 LYS 11 1HB LYS 11 -7.378 4.265 -3.574
49 HB3 LYS 11 2HB LYS 11 -6.008 5.167 -2.939
50 HG2 LYS 11 1HG LYS 11 -8.631 5.303 -1.528
51 HG3 LYS 11 2HG LYS 11 -7.602 3.882 -1.331
52 HD2 LYS 11 1HD LYS 11 -5.751 5.351 -0.630
53 HD3 LYS 11 2HD LYS 11 -6.823 6.746 -0.776
54 HE2 LYS 11 1HE LYS 11 -7.301 4.390 1.045
55 HE3 LYS 11 2HE LYS 11 -6.581 5.918 1.550
56 HZ1 LYS 11 3HZ LYS 11 -8.896 5.943 2.077
57 HZ2 LYS 11 1HZ LYS 11 -9.326 5.507 0.500
58 HZ3 LYS 11 2HZ LYS 11 -8.644 7.025 0.802
59 HA PRO 12 HA PRO 12 -5.738 7.925 -7.103
60 HB2 PRO 12 1HB PRO 12 -3.158 8.467 -6.455
61 HB3 PRO 12 2HB PRO 12 -4.481 9.600 -6.157
62 HG2 PRO 12 1HG PRO 12 -3.146 7.707 -4.261
63 HG3 PRO 12 2HG PRO 12 -3.633 9.392 -4.002
64 HD2 PRO 12 1HD PRO 12 -5.096 7.298 -3.104
65 HD3 PRO 12 2HD PRO 12 -5.835 8.828 -3.618
66 H TYR 13 H TYR 13 -3.742 5.889 -4.966
67 HA TYR 13 HA TYR 13 -2.913 4.334 -7.320
68 HB2 TYR 13 1HB TYR 13 -1.654 4.114 -4.598
69 HB3 TYR 13 2HB TYR 13 -0.964 3.711 -6.166
70 HD1 TYR 13 HD1 TYR 13 -0.082 5.463 -7.625
71 HD2 TYR 13 HD2 TYR 13 -1.648 6.387 -3.779
72 HE1 TYR 13 HE1 TYR 13 0.985 7.676 -7.729
73 HE2 TYR 13 HE2 TYR 13 -0.586 8.603 -3.872
74 HH TYR 13 HH TYR 13 1.470 9.606 -5.126
75 H GLU 14 H GLU 14 -2.928 2.040 -7.224
76 HA GLU 14 HA GLU 14 -4.278 0.732 -5.024
77 HB2 GLU 14 1HB GLU 14 -6.125 1.599 -6.458
78 HB3 GLU 14 2HB GLU 14 -5.490 0.645 -7.791
79 HG2 GLU 14 1HG GLU 14 -5.734 -1.325 -6.076
80 HG3 GLU 14 2HG GLU 14 -6.902 -0.237 -5.329
81 H CYS 15 H CYS 15 -3.758 -1.400 -4.857
82 HA CYS 15 HA CYS 15 -1.642 -2.356 -6.573
83 HB2 CYS 15 1HB CYS 15 -1.618 -2.673 -4.097
84 HB3 CYS 15 2HB CYS 15 -2.993 -3.760 -4.260
85 H SER 16 H SER 16 -2.026 -3.389 -8.407
86 HA SER 16 HA SER 16 -4.609 -4.593 -8.918
87 HB2 SER 16 1HB SER 16 -3.505 -3.268 -10.674
88 HB3 SER 16 2HB SER 16 -2.153 -4.400 -10.681
89 HG SER 16 HG SER 16 -4.846 -5.084 -11.263
90 H ILE 17 H ILE 17 -2.765 -5.776 -6.924
91 HA ILE 17 HA ILE 17 -2.374 -8.421 -8.163
92 HB ILE 17 HB ILE 17 -0.983 -7.273 -5.739
93 HG12 ILE 17 1HG1 ILE 17 0.199 -7.955 -8.434
94 HG13 ILE 17 2HG1 ILE 17 -0.339 -6.335 -8.004
95 HG21 ILE 17 1HG2 ILE 17 0.330 -9.278 -5.706
96 HG22 ILE 17 2HG2 ILE 17 -1.374 -9.729 -5.677
97 HG23 ILE 17 3HG2 ILE 17 -0.450 -9.869 -7.172
98 HD11 ILE 17 3HD1 ILE 17 1.366 -7.265 -5.942
99 HD12 ILE 17 1HD1 ILE 17 2.154 -7.567 -7.491
100 HD13 ILE 17 2HD1 ILE 17 1.622 -5.938 -7.075
101 H CYS 18 H CYS 18 -2.852 -7.121 -4.873
102 HA CYS 18 HA CYS 18 -4.571 -9.411 -4.273
103 HB2 CYS 18 1HB CYS 18 -4.363 -8.628 -1.912
104 HB3 CYS 18 2HB CYS 18 -2.819 -9.019 -2.663
105 H GLY 19 H GLY 19 -4.586 -5.861 -4.047
106 HA2 GLY 19 1HA GLY 19 -6.774 -4.939 -4.972
107 HA3 GLY 19 2HA GLY 19 -7.521 -5.977 -3.766
108 H LYS 20 H LYS 20 -4.531 -4.342 -3.084
109 HA LYS 20 HA LYS 20 -5.846 -2.861 -0.955
110 HB2 LYS 20 1HB LYS 20 -3.019 -3.554 -1.631
111 HB3 LYS 20 2HB LYS 20 -3.323 -2.169 -0.590
112 HG2 LYS 20 1HG LYS 20 -4.851 -3.927 0.672
113 HG3 LYS 20 2HG LYS 20 -3.723 -5.060 -0.076
114 HD2 LYS 20 1HD LYS 20 -1.845 -3.839 0.916
115 HD3 LYS 20 2HD LYS 20 -2.975 -2.707 1.662
116 HE2 LYS 20 1HE LYS 20 -3.278 -5.632 2.171
117 HE3 LYS 20 2HE LYS 20 -2.020 -4.734 3.020
118 HZ1 LYS 20 3HZ LYS 20 -4.861 -4.723 3.424
119 HZ2 LYS 20 1HZ LYS 20 -4.213 -3.165 3.304
120 HZ3 LYS 20 2HZ LYS 20 -3.621 -4.240 4.468
121 H SER 21 H SER 21 -4.652 -0.594 -0.585
122 HA SER 21 HA SER 21 -4.234 0.885 -3.031
123 HB2 SER 21 1HB SER 21 -6.575 1.605 -1.251
124 HB3 SER 21 2HB SER 21 -6.063 2.456 -2.709
125 HG SER 21 HG SER 21 -7.554 1.160 -3.519
126 H PHE 22 H PHE 22 -3.108 2.767 -2.715
127 HA PHE 22 HA PHE 22 -2.623 3.615 0.054
128 HB2 PHE 22 1HB PHE 22 -0.446 3.292 -2.021
129 HB3 PHE 22 2HB PHE 22 -0.238 3.804 -0.350
130 HD1 PHE 22 HD1 PHE 22 -1.466 0.947 -2.390
131 HD2 PHE 22 HD2 PHE 22 0.268 2.240 1.275
132 HE1 PHE 22 HE1 PHE 22 -1.143 -1.399 -1.720
133 HE2 PHE 22 HE2 PHE 22 0.595 -0.103 1.951
134 HZ PHE 22 HZ PHE 22 -0.110 -1.926 0.453
135 H THR 23 H THR 23 -1.163 5.725 -0.085
136 HA THR 23 HA THR 23 -2.389 7.469 -2.122
137 HB THR 23 HB THR 23 -2.075 9.316 -0.389
138 HG1 THR 23 HG1 THR 23 -0.966 8.586 1.281
139 HG21 THR 23 3HG2 THR 23 -4.113 7.235 -0.547
140 HG22 THR 23 1HG2 THR 23 -4.292 8.987 -0.451
141 HG23 THR 23 2HG2 THR 23 -4.071 8.041 1.021
142 H LYS 24 H LYS 24 0.313 5.994 -1.782
143 HA LYS 24 HA LYS 24 1.899 8.155 -2.872
144 HB2 LYS 24 1HB LYS 24 2.400 6.974 -0.186
145 HB3 LYS 24 2HB LYS 24 3.797 7.302 -1.203
146 HG2 LYS 24 1HG LYS 24 1.706 9.355 -0.525
147 HG3 LYS 24 2HG LYS 24 3.202 9.129 0.384
148 HD2 LYS 24 1HD LYS 24 3.400 9.474 -2.562
149 HD3 LYS 24 2HD LYS 24 3.007 10.893 -1.589
150 HE2 LYS 24 1HE LYS 24 5.277 11.040 -1.530
151 HE3 LYS 24 2HE LYS 24 5.036 9.985 -0.139
152 HZ1 LYS 24 3HZ LYS 24 5.200 8.199 -2.109
153 HZ2 LYS 24 1HZ LYS 24 6.532 8.718 -1.205
154 HZ3 LYS 24 2HZ LYS 24 6.220 9.402 -2.720
155 H LYS 25 H LYS 25 3.034 7.394 -4.529
156 HA LYS 25 HA LYS 25 2.958 4.835 -5.487
157 HB2 LYS 25 1HB LYS 25 4.801 7.132 -5.899
158 HB3 LYS 25 2HB LYS 25 5.323 5.566 -6.504
159 HG2 LYS 25 1HG LYS 25 2.621 6.676 -7.171
160 HG3 LYS 25 2HG LYS 25 4.060 7.111 -8.098
161 HD2 LYS 25 1HD LYS 25 4.420 4.534 -8.227
162 HD3 LYS 25 2HD LYS 25 2.701 4.458 -7.833
163 HE2 LYS 25 1HE LYS 25 3.820 6.086 -10.107
164 HE3 LYS 25 2HE LYS 25 3.252 4.427 -10.287
165 HZ1 LYS 25 3HZ LYS 25 1.745 6.860 -10.066
166 HZ2 LYS 25 1HZ LYS 25 1.199 5.653 -9.013
167 HZ3 LYS 25 2HZ LYS 25 1.279 5.353 -10.676
168 H SER 26 H SER 26 5.420 6.237 -3.357
169 HA SER 26 HA SER 26 7.198 4.106 -3.272
170 HB2 SER 26 1HB SER 26 7.638 6.328 -2.272
171 HB3 SER 26 2HB SER 26 6.480 5.966 -0.992
172 HG SER 26 HG SER 26 8.559 5.490 -0.280
173 H GLN 27 H GLN 27 4.393 4.739 -1.179
174 HA GLN 27 HA GLN 27 4.632 2.545 0.506
175 HB2 GLN 27 1HB GLN 27 2.167 3.979 -0.486
176 HB3 GLN 27 2HB GLN 27 2.137 2.765 0.785
177 HG2 GLN 27 1HG GLN 27 3.973 5.093 1.048
178 HG3 GLN 27 2HG GLN 27 2.252 5.309 1.359
179 HE21 GLN 27 1HE2 GLN 27 4.018 5.747 3.358
180 HE22 GLN 27 2HE2 GLN 27 3.904 4.499 4.546
181 H LEU 28 H LEU 28 2.777 2.806 -2.522
182 HA LEU 28 HA LEU 28 1.832 0.169 -2.562
183 HB2 LEU 28 1HB LEU 28 0.935 1.954 -3.971
184 HB3 LEU 28 2HB LEU 28 2.444 1.998 -4.879
185 HG LEU 28 HG LEU 28 1.975 -0.372 -5.577
186 HD11 LEU 28 1HD1 LEU 28 0.297 -0.666 -3.658
187 HD12 LEU 28 2HD1 LEU 28 -0.103 -1.362 -5.228
188 HD13 LEU 28 3HD1 LEU 28 -0.848 0.153 -4.720
189 HD21 LEU 28 3HD2 LEU 28 1.518 1.665 -6.963
190 HD22 LEU 28 1HD2 LEU 28 -0.151 1.598 -6.397
191 HD23 LEU 28 2HD2 LEU 28 0.512 0.267 -7.346
192 H HIS 29 H HIS 29 4.621 1.587 -4.273
193 HA HIS 29 HA HIS 29 5.597 -0.646 -5.529
194 HB2 HIS 29 1HB HIS 29 7.036 1.686 -4.278
195 HB3 HIS 29 2HB HIS 29 7.897 0.430 -5.162
196 HD2 HIS 29 HD2 HIS 29 4.540 1.389 -6.759
197 HE1 HIS 29 HE1 HIS 29 7.587 3.419 -8.901
198 HE2 HIS 29 HE2 HIS 29 5.132 2.867 -8.797
199 H VAL 30 H VAL 30 6.462 0.448 -2.249
200 HA VAL 30 HA VAL 30 8.088 -1.775 -1.636
201 HB VAL 30 HB VAL 30 6.621 0.135 0.185
202 HG11 VAL 30 1HG1 VAL 30 7.937 -0.691 2.004
203 HG12 VAL 30 2HG1 VAL 30 7.123 -2.066 1.254
204 HG13 VAL 30 3HG1 VAL 30 8.832 -1.770 0.935
205 HG21 VAL 30 3HG2 VAL 30 9.166 0.195 -1.264
206 HG22 VAL 30 1HG2 VAL 30 8.198 1.517 -0.610
207 HG23 VAL 30 2HG2 VAL 30 9.292 0.620 0.443
208 H HIS 31 H HIS 31 4.670 -1.084 -1.003
209 HA HIS 31 HA HIS 31 4.010 -3.214 0.614
210 HB2 HIS 31 1HB HIS 31 2.243 -1.767 0.324
211 HB3 HIS 31 2HB HIS 31 2.512 -1.614 -1.410
212 HD1 HIS 31 HD1 HIS 31 1.045 -4.023 1.109
213 HD2 HIS 31 HD2 HIS 31 0.958 -3.242 -2.970
214 HE1 HIS 31 HE1 HIS 31 -0.748 -5.519 0.176
215 H GLN 32 H GLN 32 4.142 -3.143 -2.934
216 HA GLN 32 HA GLN 32 3.180 -5.590 -3.607
217 HB2 GLN 32 1HB GLN 32 5.674 -4.299 -4.726
218 HB3 GLN 32 2HB GLN 32 4.765 -5.590 -5.502
219 HG2 GLN 32 1HG GLN 32 3.015 -4.212 -6.058
220 HG3 GLN 32 2HG GLN 32 3.369 -3.064 -4.769
221 HE21 GLN 32 1HE2 GLN 32 2.851 -2.183 -7.296
222 HE22 GLN 32 2HE2 GLN 32 4.291 -1.542 -8.002
223 H GLN 33 H GLN 33 6.223 -4.898 -2.028
224 HA GLN 33 HA GLN 33 7.625 -7.234 -2.378
225 HB2 GLN 33 1HB GLN 33 7.393 -5.476 0.062
226 HB3 GLN 33 2HB GLN 33 8.543 -6.801 -0.058
227 HG2 GLN 33 1HG GLN 33 9.190 -5.550 -2.297
228 HG3 GLN 33 2HG GLN 33 8.522 -4.172 -1.425
229 HE21 GLN 33 1HE2 GLN 33 10.475 -3.134 -1.206
230 HE22 GLN 33 2HE2 GLN 33 11.732 -3.708 -0.170
231 H ILE 34 H ILE 34 5.209 -6.568 0.151
232 HA ILE 34 HA ILE 34 5.198 -8.794 1.643
233 HB ILE 34 HB ILE 34 3.482 -6.844 1.572
234 HG12 ILE 34 1HG1 ILE 34 2.262 -9.498 2.258
235 HG13 ILE 34 2HG1 ILE 34 3.670 -8.922 3.144
236 HG21 ILE 34 1HG2 ILE 34 2.560 -7.324 -0.618
237 HG22 ILE 34 2HG2 ILE 34 2.051 -8.922 -0.077
238 HG23 ILE 34 3HG2 ILE 34 1.309 -7.480 0.615
239 HD11 ILE 34 3HD1 ILE 34 1.167 -7.294 2.847
240 HD12 ILE 34 1HD1 ILE 34 1.420 -8.437 4.166
241 HD13 ILE 34 2HD1 ILE 34 2.501 -7.056 3.976
242 H HIS 35 H HIS 35 3.955 -8.581 -1.653
243 HA HIS 35 HA HIS 35 2.966 -11.267 -1.703
244 HB2 HIS 35 1HB HIS 35 3.625 -9.495 -4.062
245 HB3 HIS 35 2HB HIS 35 2.544 -10.885 -4.046
246 HD1 HIS 35 HD1 HIS 35 0.568 -10.430 -1.980
247 HD2 HIS 35 HD2 HIS 35 2.162 -7.238 -4.108
248 HE1 HIS 35 HE1 HIS 35 -1.099 -8.563 -1.740
249 H THR 36 H THR 36 5.654 -9.713 -3.467
250 HA THR 36 HA THR 36 6.804 -12.158 -4.306
251 HB THR 36 HB THR 36 7.197 -9.925 -5.392
252 HG1 THR 36 HG1 THR 36 9.631 -11.189 -4.645
253 HG21 THR 36 3HG2 THR 36 8.084 -8.233 -4.249
254 HG22 THR 36 1HG2 THR 36 9.508 -9.200 -3.866
255 HG23 THR 36 2HG2 THR 36 8.100 -9.245 -2.805
256 H GLY 37 H GLY 37 8.742 -13.168 -3.620
257 HA2 GLY 37 1HA GLY 37 10.363 -12.454 -1.499
258 HA3 GLY 37 2HA GLY 37 9.017 -13.334 -0.790
259 H GLU 38 H GLU 38 10.631 -13.879 -3.897
260 HA GLU 38 HA GLU 38 11.256 -16.604 -2.979
261 HB2 GLU 38 1HB GLU 38 9.734 -16.450 -4.916
262 HB3 GLU 38 2HB GLU 38 10.966 -15.564 -5.803
263 HG2 GLU 38 1HG GLU 38 10.865 -17.916 -6.455
264 HG3 GLU 38 2HG GLU 38 12.429 -17.483 -5.766
265 H LYS 39 H LYS 39 13.246 -16.254 -2.040
266 HA LYS 39 HA LYS 39 15.376 -15.312 -3.848
267 HB2 LYS 39 1HB LYS 39 14.927 -13.893 -1.814
268 HB3 LYS 39 2HB LYS 39 15.437 -15.258 -0.828
269 HG2 LYS 39 1HG LYS 39 17.311 -13.858 -0.987
270 HG3 LYS 39 2HG LYS 39 17.622 -15.187 -2.107
271 HD2 LYS 39 1HD LYS 39 18.177 -13.423 -3.449
272 HD3 LYS 39 2HD LYS 39 16.454 -13.537 -3.817
273 HE2 LYS 39 1HE LYS 39 16.138 -11.866 -1.896
274 HE3 LYS 39 2HE LYS 39 17.873 -11.584 -2.032
275 HZ1 LYS 39 3HZ LYS 39 15.782 -10.567 -3.637
276 HZ2 LYS 39 1HZ LYS 39 16.852 -11.455 -4.601
277 HZ3 LYS 39 2HZ LYS 39 17.427 -10.172 -3.660
278 HA PRO 40 HA PRO 40 16.186 -19.786 -3.085
279 HB2 PRO 40 1HB PRO 40 17.107 -20.265 -5.593
280 HB3 PRO 40 2HB PRO 40 15.390 -20.307 -5.176
281 HG2 PRO 40 1HG PRO 40 16.972 -18.119 -6.467
282 HG3 PRO 40 2HG PRO 40 15.355 -18.721 -6.876
283 HD2 PRO 40 1HD PRO 40 15.747 -16.460 -5.439
284 HD3 PRO 40 2HD PRO 40 14.344 -17.518 -5.190
285 H SER 41 H SER 41 18.210 -17.611 -5.065
286 HA SER 41 HA SER 41 20.608 -18.833 -3.921
287 HB2 SER 41 1HB SER 41 21.829 -17.824 -5.699
288 HB3 SER 41 2HB SER 41 20.341 -18.436 -6.421
289 HG SER 41 HG SER 41 19.499 -16.287 -6.221
290 H GLY 42 H GLY 42 22.439 -17.281 -3.414
291 HA2 GLY 42 1HA GLY 42 21.954 -14.604 -2.699
292 HA3 GLY 42 2HA GLY 42 21.694 -15.615 -1.286
293 HA PRO 43 HA PRO 43 26.366 -15.923 -2.622
294 HB2 PRO 43 1HB PRO 43 27.252 -13.796 -4.057
295 HB3 PRO 43 2HB PRO 43 26.624 -15.267 -4.808
296 HG2 PRO 43 1HG PRO 43 25.249 -12.653 -4.324
297 HG3 PRO 43 2HG PRO 43 25.208 -13.689 -5.763
298 HD2 PRO 43 1HD PRO 43 23.212 -13.657 -3.933
299 HD3 PRO 43 2HD PRO 43 23.649 -15.116 -4.844
300 H SER 44 H SER 44 24.893 -12.747 -2.097
301 HA SER 44 HA SER 44 27.091 -11.823 -0.471
302 HB2 SER 44 1HB SER 44 25.721 -9.808 -0.148
303 HB3 SER 44 2HB SER 44 25.811 -10.241 -1.855
304 HG SER 44 HG SER 44 23.645 -9.987 -0.300
305 H SER 45 H SER 45 27.196 -11.716 1.718
306 HA SER 45 HA SER 45 25.623 -13.517 3.235
307 HB2 SER 45 1HB SER 45 27.973 -12.943 3.787
308 HB3 SER 45 2HB SER 45 27.452 -11.319 4.234
309 HG SER 45 HG SER 45 25.929 -12.611 5.683
310 H GLY 46 H GLY 46 23.611 -13.213 3.907
311 HA2 GLY 46 1HA GLY 46 22.230 -10.774 3.780
312 HA3 GLY 46 2HA GLY 46 21.696 -12.199 4.660
Start of MODEL 8
1 H1 GLY 1 H GLY 1 -26.564 -16.075 -10.661
2 HA2 GLY 1 1HA GLY 1 -29.145 -16.048 -9.223
3 HA3 GLY 1 2HA GLY 1 -27.608 -16.101 -8.373
4 H SER 2 H SER 2 -26.914 -14.224 -7.620
5 HA SER 2 HA SER 2 -27.248 -11.796 -9.178
6 HB2 SER 2 1HB SER 2 -28.389 -10.552 -7.461
7 HB3 SER 2 2HB SER 2 -29.326 -12.012 -7.779
8 HG SER 2 HG SER 2 -28.628 -11.261 -5.470
9 H SER 3 H SER 3 -26.259 -9.887 -7.872
10 HA SER 3 HA SER 3 -24.199 -10.608 -5.993
11 HB2 SER 3 1HB SER 3 -23.529 -9.880 -8.839
12 HB3 SER 3 2HB SER 3 -22.394 -9.585 -7.522
13 HG SER 3 HG SER 3 -23.030 -11.990 -7.095
14 H GLY 4 H GLY 4 -22.736 -8.587 -5.611
15 HA2 GLY 4 1HA GLY 4 -23.384 -6.011 -6.256
16 HA3 GLY 4 2HA GLY 4 -24.519 -6.426 -4.980
17 H SER 5 H SER 5 -21.501 -5.173 -5.648
18 HA SER 5 HA SER 5 -20.602 -5.649 -2.881
19 HB2 SER 5 1HB SER 5 -19.191 -6.595 -4.826
20 HB3 SER 5 2HB SER 5 -18.745 -4.918 -5.137
21 HG SER 5 HG SER 5 -17.641 -4.846 -3.298
22 H SER 6 H SER 6 -19.581 -3.908 -1.790
23 HA SER 6 HA SER 6 -20.572 -1.302 -2.667
24 HB2 SER 6 1HB SER 6 -21.046 -2.140 -0.347
25 HB3 SER 6 2HB SER 6 -19.318 -2.032 -0.012
26 HG SER 6 HG SER 6 -21.152 -0.097 0.075
27 H GLY 7 H GLY 7 -19.083 0.596 -1.997
28 HA2 GLY 7 1HA GLY 7 -16.252 0.118 -2.152
29 HA3 GLY 7 2HA GLY 7 -16.918 0.748 -3.652
30 H THR 8 H THR 8 -15.329 1.656 -0.989
31 HA THR 8 HA THR 8 -16.087 4.427 -1.317
32 HB THR 8 HB THR 8 -17.699 3.693 0.383
33 HG1 THR 8 HG1 THR 8 -16.811 5.185 2.105
34 HG21 THR 8 3HG2 THR 8 -15.757 3.321 2.524
35 HG22 THR 8 1HG2 THR 8 -15.659 2.069 1.287
36 HG23 THR 8 2HG2 THR 8 -17.186 2.371 2.117
37 H GLY 9 H GLY 9 -14.229 5.491 -1.452
38 HA2 GLY 9 1HA GLY 9 -12.286 6.261 -0.121
39 HA3 GLY 9 2HA GLY 9 -11.973 4.565 0.220
40 H GLU 10 H GLU 10 -12.150 6.929 -2.414
41 HA GLU 10 HA GLU 10 -10.690 5.214 -4.217
42 HB2 GLU 10 1HB GLU 10 -11.616 8.080 -4.425
43 HB3 GLU 10 2HB GLU 10 -10.725 7.258 -5.698
44 HG2 GLU 10 1HG GLU 10 -12.536 5.546 -5.757
45 HG3 GLU 10 2HG GLU 10 -13.446 6.552 -4.632
46 H LYS 11 H LYS 11 -8.565 5.300 -4.732
47 HA LYS 11 HA LYS 11 -6.922 7.369 -3.435
48 HB2 LYS 11 1HB LYS 11 -6.672 4.405 -3.312
49 HB3 LYS 11 2HB LYS 11 -5.187 5.342 -3.406
50 HG2 LYS 11 1HG LYS 11 -5.416 5.224 -1.151
51 HG3 LYS 11 2HG LYS 11 -6.338 6.698 -1.453
52 HD2 LYS 11 1HD LYS 11 -8.411 5.388 -1.473
53 HD3 LYS 11 2HD LYS 11 -7.483 3.920 -1.160
54 HE2 LYS 11 1HE LYS 11 -8.325 4.589 0.933
55 HE3 LYS 11 2HE LYS 11 -6.632 5.080 0.930
56 HZ1 LYS 11 3HZ LYS 11 -8.397 7.107 -0.076
57 HZ2 LYS 11 1HZ LYS 11 -7.189 7.215 1.104
58 HZ3 LYS 11 2HZ LYS 11 -8.737 6.680 1.525
59 HA PRO 12 HA PRO 12 -4.987 7.982 -7.326
60 HB2 PRO 12 1HB PRO 12 -2.446 8.584 -6.585
61 HB3 PRO 12 2HB PRO 12 -3.804 9.689 -6.344
62 HG2 PRO 12 1HG PRO 12 -2.500 7.836 -4.388
63 HG3 PRO 12 2HG PRO 12 -3.033 9.512 -4.158
64 HD2 PRO 12 1HD PRO 12 -4.483 7.391 -3.302
65 HD3 PRO 12 2HD PRO 12 -5.235 8.902 -3.853
66 H TYR 13 H TYR 13 -3.585 5.663 -5.117
67 HA TYR 13 HA TYR 13 -2.544 4.168 -7.426
68 HB2 TYR 13 1HB TYR 13 -1.158 4.221 -4.748
69 HB3 TYR 13 2HB TYR 13 -0.552 3.576 -6.270
70 HD1 TYR 13 HD1 TYR 13 0.046 5.174 -8.117
71 HD2 TYR 13 HD2 TYR 13 -0.829 6.488 -4.166
72 HE1 TYR 13 HE1 TYR 13 1.146 7.321 -8.594
73 HE2 TYR 13 HE2 TYR 13 0.267 8.640 -4.633
74 HH TYR 13 HH TYR 13 2.337 9.218 -6.793
75 H GLU 14 H GLU 14 -3.116 2.080 -7.501
76 HA GLU 14 HA GLU 14 -4.182 0.830 -5.062
77 HB2 GLU 14 1HB GLU 14 -6.030 1.614 -6.548
78 HB3 GLU 14 2HB GLU 14 -5.411 0.558 -7.809
79 HG2 GLU 14 1HG GLU 14 -5.659 -1.270 -5.934
80 HG3 GLU 14 2HG GLU 14 -6.829 -0.120 -5.290
81 H CYS 15 H CYS 15 -3.958 -1.429 -4.929
82 HA CYS 15 HA CYS 15 -1.696 -2.456 -6.416
83 HB2 CYS 15 1HB CYS 15 -2.040 -2.767 -3.920
84 HB3 CYS 15 2HB CYS 15 -3.318 -3.908 -4.325
85 H SER 16 H SER 16 -1.901 -3.528 -8.255
86 HA SER 16 HA SER 16 -4.482 -4.561 -9.073
87 HB2 SER 16 1HB SER 16 -3.042 -3.319 -10.667
88 HB3 SER 16 2HB SER 16 -1.835 -4.600 -10.545
89 HG SER 16 HG SER 16 -4.492 -4.855 -11.513
90 H ILE 17 H ILE 17 -2.601 -5.786 -6.948
91 HA ILE 17 HA ILE 17 -2.461 -8.497 -8.085
92 HB ILE 17 HB ILE 17 -1.026 -7.366 -5.680
93 HG12 ILE 17 1HG1 ILE 17 0.120 -8.276 -8.323
94 HG13 ILE 17 2HG1 ILE 17 -0.253 -6.595 -7.955
95 HG21 ILE 17 1HG2 ILE 17 -1.552 -9.722 -5.383
96 HG22 ILE 17 2HG2 ILE 17 -0.843 -10.092 -6.954
97 HG23 ILE 17 3HG2 ILE 17 0.178 -9.500 -5.644
98 HD11 ILE 17 3HD1 ILE 17 1.674 -6.342 -6.904
99 HD12 ILE 17 1HD1 ILE 17 1.361 -7.741 -5.877
100 HD13 ILE 17 2HD1 ILE 17 2.123 -7.957 -7.453
101 H CYS 18 H CYS 18 -3.055 -6.931 -4.931
102 HA CYS 18 HA CYS 18 -4.902 -9.115 -4.272
103 HB2 CYS 18 1HB CYS 18 -4.703 -8.256 -1.933
104 HB3 CYS 18 2HB CYS 18 -3.177 -8.806 -2.618
105 H GLY 19 H GLY 19 -4.649 -5.571 -4.214
106 HA2 GLY 19 1HA GLY 19 -6.795 -4.595 -5.246
107 HA3 GLY 19 2HA GLY 19 -7.575 -5.428 -3.909
108 H LYS 20 H LYS 20 -5.004 -4.721 -2.335
109 HA LYS 20 HA LYS 20 -5.978 -2.686 -0.787
110 HB2 LYS 20 1HB LYS 20 -3.157 -3.533 -1.393
111 HB3 LYS 20 2HB LYS 20 -3.487 -2.210 -0.283
112 HG2 LYS 20 1HG LYS 20 -5.103 -4.010 0.795
113 HG3 LYS 20 2HG LYS 20 -3.963 -5.118 0.030
114 HD2 LYS 20 1HD LYS 20 -2.146 -4.262 1.262
115 HD3 LYS 20 2HD LYS 20 -3.055 -2.834 1.762
116 HE2 LYS 20 1HE LYS 20 -3.661 -5.669 2.598
117 HE3 LYS 20 2HE LYS 20 -2.797 -4.485 3.577
118 HZ1 LYS 20 3HZ LYS 20 -5.124 -3.239 2.819
119 HZ2 LYS 20 1HZ LYS 20 -4.769 -3.872 4.347
120 HZ3 LYS 20 2HZ LYS 20 -5.597 -4.815 3.213
121 H SER 21 H SER 21 -4.755 -0.486 -0.508
122 HA SER 21 HA SER 21 -4.149 0.795 -3.049
123 HB2 SER 21 1HB SER 21 -6.449 1.675 -1.290
124 HB3 SER 21 2HB SER 21 -5.794 2.623 -2.625
125 HG SER 21 HG SER 21 -7.475 1.497 -3.471
126 H PHE 22 H PHE 22 -3.140 2.858 -2.820
127 HA PHE 22 HA PHE 22 -2.424 3.705 -0.125
128 HB2 PHE 22 1HB PHE 22 -0.307 3.100 -2.198
129 HB3 PHE 22 2HB PHE 22 -0.040 3.677 -0.556
130 HD1 PHE 22 HD1 PHE 22 -1.381 0.815 -2.496
131 HD2 PHE 22 HD2 PHE 22 0.232 2.174 1.200
132 HE1 PHE 22 HE1 PHE 22 -1.235 -1.511 -1.710
133 HE2 PHE 22 HE2 PHE 22 0.383 -0.150 1.993
134 HZ PHE 22 HZ PHE 22 -0.351 -1.997 0.537
135 H THR 23 H THR 23 -1.998 5.865 0.046
136 HA THR 23 HA THR 23 -2.762 7.508 -2.194
137 HB THR 23 HB THR 23 -2.476 9.405 -0.634
138 HG1 THR 23 HG1 THR 23 -1.630 9.111 1.348
139 HG21 THR 23 3HG2 THR 23 -4.581 8.051 -0.718
140 HG22 THR 23 1HG2 THR 23 -4.306 8.870 0.818
141 HG23 THR 23 2HG2 THR 23 -3.986 7.142 0.671
142 H LYS 24 H LYS 24 0.138 6.216 -1.078
143 HA LYS 24 HA LYS 24 1.688 8.284 -2.496
144 HB2 LYS 24 1HB LYS 24 2.514 6.513 -0.191
145 HB3 LYS 24 2HB LYS 24 3.625 7.532 -1.097
146 HG2 LYS 24 1HG LYS 24 2.271 9.504 -0.429
147 HG3 LYS 24 2HG LYS 24 1.301 8.437 0.588
148 HD2 LYS 24 1HD LYS 24 2.841 9.237 2.105
149 HD3 LYS 24 2HD LYS 24 3.621 7.745 1.574
150 HE2 LYS 24 1HE LYS 24 5.208 8.859 0.334
151 HE3 LYS 24 2HE LYS 24 4.191 10.282 0.113
152 HZ1 LYS 24 3HZ LYS 24 5.386 9.503 2.715
153 HZ2 LYS 24 1HZ LYS 24 4.596 10.953 2.343
154 HZ3 LYS 24 2HZ LYS 24 6.099 10.605 1.648
155 H LYS 25 H LYS 25 2.703 7.661 -4.284
156 HA LYS 25 HA LYS 25 2.412 5.186 -5.473
157 HB2 LYS 25 1HB LYS 25 3.161 7.331 -6.569
158 HB3 LYS 25 2HB LYS 25 4.766 7.025 -5.917
159 HG2 LYS 25 1HG LYS 25 5.050 5.101 -7.246
160 HG3 LYS 25 2HG LYS 25 3.338 5.051 -7.673
161 HD2 LYS 25 1HD LYS 25 4.480 5.907 -9.566
162 HD3 LYS 25 2HD LYS 25 3.677 7.281 -8.804
163 HE2 LYS 25 1HE LYS 25 5.861 8.004 -9.364
164 HE3 LYS 25 2HE LYS 25 5.853 7.746 -7.620
165 HZ1 LYS 25 3HZ LYS 25 7.717 6.770 -9.249
166 HZ2 LYS 25 1HZ LYS 25 6.645 5.462 -9.223
167 HZ3 LYS 25 2HZ LYS 25 7.297 6.050 -7.777
168 H SER 26 H SER 26 5.049 6.363 -3.433
169 HA SER 26 HA SER 26 6.771 4.168 -3.742
170 HB2 SER 26 1HB SER 26 7.275 6.436 -2.669
171 HB3 SER 26 2HB SER 26 6.531 5.788 -1.208
172 HG SER 26 HG SER 26 8.885 5.536 -1.426
173 H GLN 27 H GLN 27 4.335 4.847 -1.239
174 HA GLN 27 HA GLN 27 4.655 2.653 0.374
175 HB2 GLN 27 1HB GLN 27 2.303 4.324 -0.374
176 HB3 GLN 27 2HB GLN 27 2.012 2.845 0.531
177 HG2 GLN 27 1HG GLN 27 4.078 4.763 1.493
178 HG3 GLN 27 2HG GLN 27 2.371 5.111 1.764
179 HE21 GLN 27 1HE2 GLN 27 3.551 4.923 3.996
180 HE22 GLN 27 2HE2 GLN 27 3.379 3.386 4.765
181 H LEU 28 H LEU 28 2.799 2.857 -2.638
182 HA LEU 28 HA LEU 28 1.754 0.244 -2.568
183 HB2 LEU 28 1HB LEU 28 0.841 1.946 -4.023
184 HB3 LEU 28 2HB LEU 28 2.364 2.048 -4.905
185 HG LEU 28 HG LEU 28 1.969 -0.370 -5.575
186 HD11 LEU 28 1HD1 LEU 28 -0.921 0.043 -5.139
187 HD12 LEU 28 2HD1 LEU 28 0.038 -0.378 -3.721
188 HD13 LEU 28 3HD1 LEU 28 0.032 -1.441 -5.127
189 HD21 LEU 28 3HD2 LEU 28 0.785 2.080 -6.563
190 HD22 LEU 28 1HD2 LEU 28 -0.172 0.664 -7.001
191 HD23 LEU 28 2HD2 LEU 28 1.532 0.749 -7.448
192 H HIS 29 H HIS 29 4.604 1.555 -4.255
193 HA HIS 29 HA HIS 29 5.494 -0.776 -5.456
194 HB2 HIS 29 1HB HIS 29 6.944 1.649 -4.425
195 HB3 HIS 29 2HB HIS 29 7.824 0.313 -5.162
196 HD2 HIS 29 HD2 HIS 29 4.563 0.817 -7.013
197 HE1 HIS 29 HE1 HIS 29 7.478 3.079 -9.107
198 HE2 HIS 29 HE2 HIS 29 5.115 2.209 -9.123
199 H VAL 30 H VAL 30 6.102 0.418 -2.181
200 HA VAL 30 HA VAL 30 7.881 -1.688 -1.462
201 HB VAL 30 HB VAL 30 6.268 0.164 0.299
202 HG11 VAL 30 1HG1 VAL 30 7.168 -0.780 2.119
203 HG12 VAL 30 2HG1 VAL 30 7.481 -2.164 1.069
204 HG13 VAL 30 3HG1 VAL 30 8.746 -0.968 1.356
205 HG21 VAL 30 3HG2 VAL 30 9.162 0.534 0.098
206 HG22 VAL 30 1HG2 VAL 30 8.296 0.821 -1.411
207 HG23 VAL 30 2HG2 VAL 30 7.860 1.722 0.041
208 H HIS 31 H HIS 31 4.418 -1.122 -0.997
209 HA HIS 31 HA HIS 31 3.823 -3.251 0.680
210 HB2 HIS 31 1HB HIS 31 2.030 -1.824 0.381
211 HB3 HIS 31 2HB HIS 31 2.272 -1.714 -1.360
212 HD1 HIS 31 HD1 HIS 31 1.001 -4.190 1.219
213 HD2 HIS 31 HD2 HIS 31 0.629 -3.312 -2.825
214 HE1 HIS 31 HE1 HIS 31 -0.797 -5.725 0.360
215 H GLN 32 H GLN 32 4.066 -3.178 -2.851
216 HA GLN 32 HA GLN 32 3.130 -5.659 -3.523
217 HB2 GLN 32 1HB GLN 32 5.537 -4.220 -4.650
218 HB3 GLN 32 2HB GLN 32 4.768 -5.609 -5.407
219 HG2 GLN 32 1HG GLN 32 2.621 -4.139 -5.268
220 HG3 GLN 32 2HG GLN 32 3.775 -2.815 -5.124
221 HE21 GLN 32 1HE2 GLN 32 1.884 -3.431 -7.259
222 HE22 GLN 32 2HE2 GLN 32 2.824 -3.582 -8.701
223 H GLN 33 H GLN 33 6.097 -4.863 -1.881
224 HA GLN 33 HA GLN 33 7.594 -7.157 -2.263
225 HB2 GLN 33 1HB GLN 33 7.338 -5.393 0.173
226 HB3 GLN 33 2HB GLN 33 8.542 -6.666 0.024
227 HG2 GLN 33 1HG GLN 33 8.359 -4.599 -2.108
228 HG3 GLN 33 2HG GLN 33 9.116 -4.186 -0.571
229 HE21 GLN 33 1HE2 GLN 33 11.220 -4.434 -0.548
230 HE22 GLN 33 2HE2 GLN 33 12.127 -5.586 -1.462
231 H ILE 34 H ILE 34 4.878 -6.599 -0.101
232 HA ILE 34 HA ILE 34 5.059 -8.843 1.521
233 HB ILE 34 HB ILE 34 3.374 -6.890 1.612
234 HG12 ILE 34 1HG1 ILE 34 2.098 -9.557 2.130
235 HG13 ILE 34 2HG1 ILE 34 3.529 -9.073 3.034
236 HG21 ILE 34 1HG2 ILE 34 1.880 -8.808 -0.171
237 HG22 ILE 34 2HG2 ILE 34 1.164 -7.425 0.655
238 HG23 ILE 34 3HG2 ILE 34 2.397 -7.172 -0.580
239 HD11 ILE 34 3HD1 ILE 34 2.169 -8.058 4.450
240 HD12 ILE 34 1HD1 ILE 34 1.827 -6.884 3.179
241 HD13 ILE 34 2HD1 ILE 34 0.784 -8.292 3.383
242 H HIS 35 H HIS 35 4.093 -8.569 -1.806
243 HA HIS 35 HA HIS 35 2.966 -11.243 -1.884
244 HB2 HIS 35 1HB HIS 35 3.485 -9.298 -4.143
245 HB3 HIS 35 2HB HIS 35 2.535 -10.778 -4.245
246 HD1 HIS 35 HD1 HIS 35 0.494 -10.705 -2.239
247 HD2 HIS 35 HD2 HIS 35 1.866 -7.162 -3.920
248 HE1 HIS 35 HE1 HIS 35 -1.325 -9.017 -1.828
249 H THR 36 H THR 36 5.419 -9.663 -3.930
250 HA THR 36 HA THR 36 6.608 -11.920 -4.942
251 HB THR 36 HB THR 36 7.174 -9.690 -5.751
252 HG1 THR 36 HG1 THR 36 8.752 -11.623 -5.689
253 HG21 THR 36 3HG2 THR 36 9.089 -9.176 -3.554
254 HG22 THR 36 1HG2 THR 36 7.383 -8.920 -3.189
255 HG23 THR 36 2HG2 THR 36 8.141 -8.044 -4.519
256 H GLY 37 H GLY 37 7.068 -10.453 -1.792
257 HA2 GLY 37 1HA GLY 37 8.347 -11.071 0.020
258 HA3 GLY 37 2HA GLY 37 7.908 -12.701 -0.470
259 H GLU 38 H GLU 38 9.856 -13.625 0.118
260 HA GLU 38 HA GLU 38 12.198 -12.754 -1.445
261 HB2 GLU 38 1HB GLU 38 12.096 -14.132 1.243
262 HB3 GLU 38 2HB GLU 38 13.571 -13.818 0.340
263 HG2 GLU 38 1HG GLU 38 13.454 -11.534 0.684
264 HG3 GLU 38 2HG GLU 38 11.728 -11.575 1.041
265 H LYS 39 H LYS 39 13.706 -14.474 -2.067
266 HA LYS 39 HA LYS 39 12.387 -16.584 -3.392
267 HB2 LYS 39 1HB LYS 39 14.731 -15.411 -3.790
268 HB3 LYS 39 2HB LYS 39 15.310 -16.757 -2.817
269 HG2 LYS 39 1HG LYS 39 14.555 -18.346 -4.386
270 HG3 LYS 39 2HG LYS 39 13.596 -17.144 -5.252
271 HD2 LYS 39 1HD LYS 39 15.486 -16.137 -6.186
272 HD3 LYS 39 2HD LYS 39 16.573 -16.867 -5.002
273 HE2 LYS 39 1HE LYS 39 16.440 -18.977 -6.023
274 HE3 LYS 39 2HE LYS 39 15.011 -18.531 -6.954
275 HZ1 LYS 39 3HZ LYS 39 16.486 -16.876 -8.110
276 HZ2 LYS 39 1HZ LYS 39 16.814 -18.502 -8.443
277 HZ3 LYS 39 2HZ LYS 39 17.804 -17.641 -7.377
278 HA PRO 40 HA PRO 40 12.096 -19.638 -0.227
279 HB2 PRO 40 1HB PRO 40 11.852 -21.835 -1.803
280 HB3 PRO 40 2HB PRO 40 10.546 -20.665 -1.577
281 HG2 PRO 40 1HG PRO 40 12.491 -20.919 -3.839
282 HG3 PRO 40 2HG PRO 40 10.746 -20.607 -3.893
283 HD2 PRO 40 1HD PRO 40 12.587 -18.641 -4.173
284 HD3 PRO 40 2HD PRO 40 11.005 -18.367 -3.416
285 H SER 41 H SER 41 14.645 -19.472 -2.497
286 HA SER 41 HA SER 41 16.101 -21.785 -1.983
287 HB2 SER 41 1HB SER 41 16.778 -19.043 -2.932
288 HB3 SER 41 2HB SER 41 18.109 -20.077 -2.414
289 HG SER 41 HG SER 41 17.798 -21.339 -4.091
290 H GLY 42 H GLY 42 16.897 -22.559 -0.151
291 HA2 GLY 42 1HA GLY 42 18.687 -21.805 1.561
292 HA3 GLY 42 2HA GLY 42 17.421 -20.693 2.061
293 HA PRO 43 HA PRO 43 16.040 -23.753 4.893
294 HB2 PRO 43 1HB PRO 43 13.493 -22.890 5.265
295 HB3 PRO 43 2HB PRO 43 14.898 -22.057 5.941
296 HG2 PRO 43 1HG PRO 43 13.322 -21.419 3.477
297 HG3 PRO 43 2HG PRO 43 13.945 -20.321 4.722
298 HD2 PRO 43 1HD PRO 43 15.179 -20.668 2.337
299 HD3 PRO 43 2HD PRO 43 16.070 -20.312 3.830
300 H SER 44 H SER 44 14.836 -25.641 4.990
301 HA SER 44 HA SER 44 13.513 -26.398 2.479
302 HB2 SER 44 1HB SER 44 14.920 -27.978 4.617
303 HB3 SER 44 2HB SER 44 13.803 -28.765 3.503
304 HG SER 44 HG SER 44 15.232 -28.598 1.967
305 H SER 45 H SER 45 11.652 -27.895 2.667
306 HA SER 45 HA SER 45 9.899 -27.019 4.853
307 HB2 SER 45 1HB SER 45 8.927 -26.490 2.754
308 HB3 SER 45 2HB SER 45 9.336 -28.067 2.080
309 HG SER 45 HG SER 45 7.066 -27.583 2.900
310 H GLY 46 H GLY 46 10.467 -29.954 2.896
311 HA2 GLY 46 1HA GLY 46 10.740 -32.142 3.629
312 HA3 GLY 46 2HA GLY 46 10.523 -31.585 5.282
Start of MODEL 9
1 H1 GLY 1 H GLY 1 -19.359 -10.132 -3.928
2 HA2 GLY 1 1HA GLY 1 -18.659 -8.585 -5.910
3 HA3 GLY 1 2HA GLY 1 -20.236 -9.066 -6.517
4 H SER 2 H SER 2 -21.394 -7.232 -6.390
5 HA SER 2 HA SER 2 -22.428 -5.392 -5.530
6 HB2 SER 2 1HB SER 2 -22.441 -7.341 -3.246
7 HB3 SER 2 2HB SER 2 -23.109 -5.723 -3.032
8 HG SER 2 HG SER 2 -23.902 -7.647 -4.963
9 H SER 3 H SER 3 -19.674 -5.110 -5.680
10 HA SER 3 HA SER 3 -18.848 -3.859 -3.169
11 HB2 SER 3 1HB SER 3 -17.256 -4.285 -5.710
12 HB3 SER 3 2HB SER 3 -16.621 -3.752 -4.153
13 HG SER 3 HG SER 3 -17.766 -6.271 -4.779
14 H GLY 4 H GLY 4 -19.771 -1.888 -2.993
15 HA2 GLY 4 1HA GLY 4 -19.716 -0.100 -5.325
16 HA3 GLY 4 2HA GLY 4 -20.712 0.116 -3.893
17 H SER 5 H SER 5 -17.862 1.006 -5.463
18 HA SER 5 HA SER 5 -16.933 2.397 -3.037
19 HB2 SER 5 1HB SER 5 -15.489 0.426 -3.982
20 HB3 SER 5 2HB SER 5 -15.013 1.606 -5.203
21 HG SER 5 HG SER 5 -13.943 2.720 -3.734
22 H SER 6 H SER 6 -18.763 3.513 -4.798
23 HA SER 6 HA SER 6 -17.131 5.560 -6.153
24 HB2 SER 6 1HB SER 6 -19.858 4.526 -6.968
25 HB3 SER 6 2HB SER 6 -18.987 5.837 -7.762
26 HG SER 6 HG SER 6 -18.074 4.331 -8.892
27 H GLY 7 H GLY 7 -17.318 7.531 -5.328
28 HA2 GLY 7 1HA GLY 7 -19.574 8.961 -4.777
29 HA3 GLY 7 2HA GLY 7 -19.265 8.086 -3.284
30 H THR 8 H THR 8 -17.488 8.624 -2.020
31 HA THR 8 HA THR 8 -16.766 11.257 -1.813
32 HB THR 8 HB THR 8 -15.075 8.876 -1.023
33 HG1 THR 8 HG1 THR 8 -16.687 10.387 0.730
34 HG21 THR 8 3HG2 THR 8 -14.393 10.665 0.782
35 HG22 THR 8 1HG2 THR 8 -14.853 11.803 -0.483
36 HG23 THR 8 2HG2 THR 8 -13.585 10.615 -0.785
37 H GLY 9 H GLY 9 -14.693 8.703 -3.214
38 HA2 GLY 9 1HA GLY 9 -13.895 10.196 -5.451
39 HA3 GLY 9 2HA GLY 9 -12.714 10.457 -4.176
40 H GLU 10 H GLU 10 -11.141 9.446 -5.532
41 HA GLU 10 HA GLU 10 -11.173 6.538 -5.251
42 HB2 GLU 10 1HB GLU 10 -10.532 6.137 -7.534
43 HB3 GLU 10 2HB GLU 10 -12.020 7.073 -7.532
44 HG2 GLU 10 1HG GLU 10 -10.409 9.110 -7.731
45 HG3 GLU 10 2HG GLU 10 -9.265 7.899 -8.307
46 H LYS 11 H LYS 11 -9.249 5.726 -4.664
47 HA LYS 11 HA LYS 11 -7.144 7.443 -3.908
48 HB2 LYS 11 1HB LYS 11 -7.560 4.496 -4.006
49 HB3 LYS 11 2HB LYS 11 -5.908 5.080 -3.858
50 HG2 LYS 11 1HG LYS 11 -6.784 4.630 -1.674
51 HG3 LYS 11 2HG LYS 11 -6.583 6.373 -1.864
52 HD2 LYS 11 1HD LYS 11 -8.902 6.713 -2.127
53 HD3 LYS 11 2HD LYS 11 -9.204 4.993 -2.386
54 HE2 LYS 11 1HE LYS 11 -8.447 4.589 -0.040
55 HE3 LYS 11 2HE LYS 11 -8.367 6.336 0.181
56 HZ1 LYS 11 3HZ LYS 11 -10.594 6.515 0.280
57 HZ2 LYS 11 1HZ LYS 11 -10.520 4.889 0.739
58 HZ3 LYS 11 2HZ LYS 11 -10.871 5.300 -0.864
59 HA PRO 12 HA PRO 12 -4.761 7.862 -7.576
60 HB2 PRO 12 1HB PRO 12 -2.277 8.133 -6.514
61 HB3 PRO 12 2HB PRO 12 -3.504 9.402 -6.424
62 HG2 PRO 12 1HG PRO 12 -2.701 7.393 -4.355
63 HG3 PRO 12 2HG PRO 12 -3.043 9.122 -4.162
64 HD2 PRO 12 1HD PRO 12 -4.845 7.202 -3.532
65 HD3 PRO 12 2HD PRO 12 -5.325 8.798 -4.144
66 H TYR 13 H TYR 13 -3.384 5.633 -5.164
67 HA TYR 13 HA TYR 13 -2.523 3.900 -7.388
68 HB2 TYR 13 1HB TYR 13 -1.274 3.844 -4.652
69 HB3 TYR 13 2HB TYR 13 -0.621 3.241 -6.172
70 HD1 TYR 13 HD1 TYR 13 0.348 4.791 -7.810
71 HD2 TYR 13 HD2 TYR 13 -1.065 6.163 -4.038
72 HE1 TYR 13 HE1 TYR 13 1.575 6.899 -8.124
73 HE2 TYR 13 HE2 TYR 13 0.156 8.275 -4.343
74 HH TYR 13 HH TYR 13 1.203 9.588 -5.910
75 H GLU 14 H GLU 14 -2.931 1.713 -7.259
76 HA GLU 14 HA GLU 14 -4.154 0.583 -4.894
77 HB2 GLU 14 1HB GLU 14 -6.053 1.662 -6.072
78 HB3 GLU 14 2HB GLU 14 -5.701 0.684 -7.489
79 HG2 GLU 14 1HG GLU 14 -6.170 -1.342 -6.223
80 HG3 GLU 14 2HG GLU 14 -6.497 -0.374 -4.786
81 H CYS 15 H CYS 15 -3.656 -1.515 -4.699
82 HA CYS 15 HA CYS 15 -2.031 -2.749 -6.729
83 HB2 CYS 15 1HB CYS 15 -1.647 -2.954 -4.235
84 HB3 CYS 15 2HB CYS 15 -3.052 -4.013 -4.184
85 H SER 16 H SER 16 -2.494 -4.564 -7.940
86 HA SER 16 HA SER 16 -5.353 -5.224 -8.143
87 HB2 SER 16 1HB SER 16 -3.969 -4.271 -10.137
88 HB3 SER 16 2HB SER 16 -3.327 -5.910 -10.253
89 HG SER 16 HG SER 16 -5.450 -6.662 -10.513
90 H ILE 17 H ILE 17 -2.690 -6.385 -6.714
91 HA ILE 17 HA ILE 17 -3.003 -9.179 -7.460
92 HB ILE 17 HB ILE 17 -1.151 -7.832 -5.494
93 HG12 ILE 17 1HG1 ILE 17 -0.419 -9.287 -8.027
94 HG13 ILE 17 2HG1 ILE 17 -0.841 -7.578 -8.038
95 HG21 ILE 17 1HG2 ILE 17 -1.510 -10.732 -6.188
96 HG22 ILE 17 2HG2 ILE 17 -0.008 -10.103 -5.513
97 HG23 ILE 17 3HG2 ILE 17 -1.509 -9.975 -4.595
98 HD11 ILE 17 3HD1 ILE 17 1.495 -8.918 -6.728
99 HD12 ILE 17 1HD1 ILE 17 1.490 -7.636 -7.938
100 HD13 ILE 17 2HD1 ILE 17 0.979 -7.291 -6.286
101 H CYS 18 H CYS 18 -3.169 -7.267 -4.452
102 HA CYS 18 HA CYS 18 -4.771 -9.406 -3.242
103 HB2 CYS 18 1HB CYS 18 -4.355 -8.102 -1.111
104 HB3 CYS 18 2HB CYS 18 -2.927 -8.806 -1.861
105 H GLY 19 H GLY 19 -4.766 -5.877 -3.692
106 HA2 GLY 19 1HA GLY 19 -6.907 -4.938 -4.524
107 HA3 GLY 19 2HA GLY 19 -7.698 -5.943 -3.318
108 H LYS 20 H LYS 20 -4.732 -4.129 -2.794
109 HA LYS 20 HA LYS 20 -6.128 -2.590 -0.721
110 HB2 LYS 20 1HB LYS 20 -3.327 -3.534 -1.087
111 HB3 LYS 20 2HB LYS 20 -3.574 -2.031 -0.209
112 HG2 LYS 20 1HG LYS 20 -5.246 -3.353 1.208
113 HG3 LYS 20 2HG LYS 20 -4.509 -4.789 0.494
114 HD2 LYS 20 1HD LYS 20 -3.246 -4.545 2.403
115 HD3 LYS 20 2HD LYS 20 -2.275 -3.641 1.239
116 HE2 LYS 20 1HE LYS 20 -4.380 -2.199 2.775
117 HE3 LYS 20 2HE LYS 20 -2.883 -2.634 3.599
118 HZ1 LYS 20 3HZ LYS 20 -2.049 -0.786 2.727
119 HZ2 LYS 20 1HZ LYS 20 -3.362 -0.573 1.682
120 HZ3 LYS 20 2HZ LYS 20 -2.069 -1.561 1.223
121 H SER 21 H SER 21 -5.522 -0.325 -0.425
122 HA SER 21 HA SER 21 -4.713 0.978 -2.939
123 HB2 SER 21 1HB SER 21 -6.354 2.778 -2.440
124 HB3 SER 21 2HB SER 21 -7.125 1.214 -2.707
125 HG SER 21 HG SER 21 -7.980 2.253 -0.872
126 H PHE 22 H PHE 22 -3.232 2.560 -2.771
127 HA PHE 22 HA PHE 22 -2.519 3.485 -0.066
128 HB2 PHE 22 1HB PHE 22 -0.562 3.081 -2.332
129 HB3 PHE 22 2HB PHE 22 -0.191 3.453 -0.652
130 HD1 PHE 22 HD1 PHE 22 -1.727 0.850 -2.811
131 HD2 PHE 22 HD2 PHE 22 0.242 1.744 0.855
132 HE1 PHE 22 HE1 PHE 22 -1.544 -1.556 -2.326
133 HE2 PHE 22 HE2 PHE 22 0.429 -0.660 1.345
134 HZ PHE 22 HZ PHE 22 -0.464 -2.313 -0.246
135 H THR 23 H THR 23 -1.885 5.629 0.161
136 HA THR 23 HA THR 23 -2.796 7.384 -1.987
137 HB THR 23 HB THR 23 -2.711 9.182 -0.320
138 HG1 THR 23 HG1 THR 23 -2.084 8.721 1.797
139 HG21 THR 23 3HG2 THR 23 -4.261 7.872 1.433
140 HG22 THR 23 1HG2 THR 23 -4.247 6.689 0.126
141 HG23 THR 23 2HG2 THR 23 -4.814 8.332 -0.177
142 H LYS 24 H LYS 24 0.092 6.154 -0.732
143 HA LYS 24 HA LYS 24 1.627 8.298 -2.050
144 HB2 LYS 24 1HB LYS 24 2.522 6.611 0.294
145 HB3 LYS 24 2HB LYS 24 3.441 7.900 -0.472
146 HG2 LYS 24 1HG LYS 24 0.760 8.568 0.605
147 HG3 LYS 24 2HG LYS 24 2.069 8.282 1.753
148 HD2 LYS 24 1HD LYS 24 2.367 10.516 1.418
149 HD3 LYS 24 2HD LYS 24 3.363 9.903 0.095
150 HE2 LYS 24 1HE LYS 24 2.110 11.411 -1.063
151 HE3 LYS 24 2HE LYS 24 1.051 10.007 -1.196
152 HZ1 LYS 24 3HZ LYS 24 0.503 12.497 -0.028
153 HZ2 LYS 24 1HZ LYS 24 0.436 11.322 1.188
154 HZ3 LYS 24 2HZ LYS 24 -0.527 11.165 -0.193
155 H LYS 25 H LYS 25 2.934 7.698 -3.660
156 HA LYS 25 HA LYS 25 2.857 5.178 -4.814
157 HB2 LYS 25 1HB LYS 25 3.554 7.125 -6.072
158 HB3 LYS 25 2HB LYS 25 4.968 7.329 -5.046
159 HG2 LYS 25 1HG LYS 25 6.119 5.643 -6.053
160 HG3 LYS 25 2HG LYS 25 4.657 4.751 -6.481
161 HD2 LYS 25 1HD LYS 25 5.587 5.586 -8.507
162 HD3 LYS 25 2HD LYS 25 4.161 6.564 -8.150
163 HE2 LYS 25 1HE LYS 25 5.570 8.323 -7.243
164 HE3 LYS 25 2HE LYS 25 7.007 7.337 -7.510
165 HZ1 LYS 25 3HZ LYS 25 6.767 8.946 -9.267
166 HZ2 LYS 25 1HZ LYS 25 5.200 8.408 -9.609
167 HZ3 LYS 25 2HZ LYS 25 6.523 7.395 -9.897
168 H SER 26 H SER 26 5.339 6.574 -2.690
169 HA SER 26 HA SER 26 7.188 4.528 -2.713
170 HB2 SER 26 1HB SER 26 8.039 5.411 -0.683
171 HB3 SER 26 2HB SER 26 7.324 6.788 -1.520
172 HG SER 26 HG SER 26 6.698 6.732 0.669
173 H GLN 27 H GLN 27 4.251 4.815 -0.759
174 HA GLN 27 HA GLN 27 4.631 2.554 0.848
175 HB2 GLN 27 1HB GLN 27 2.072 3.837 -0.119
176 HB3 GLN 27 2HB GLN 27 2.153 2.610 1.138
177 HG2 GLN 27 1HG GLN 27 3.765 5.102 1.412
178 HG3 GLN 27 2HG GLN 27 2.037 5.134 1.759
179 HE21 GLN 27 1HE2 GLN 27 2.219 5.462 3.931
180 HE22 GLN 27 2HE2 GLN 27 2.868 4.290 5.022
181 H LEU 28 H LEU 28 2.830 2.896 -2.204
182 HA LEU 28 HA LEU 28 2.044 0.218 -2.434
183 HB2 LEU 28 1HB LEU 28 1.019 1.919 -3.777
184 HB3 LEU 28 2HB LEU 28 2.560 2.313 -4.536
185 HG LEU 28 HG LEU 28 2.479 -0.111 -5.430
186 HD11 LEU 28 1HD1 LEU 28 -0.143 -0.503 -5.830
187 HD12 LEU 28 2HD1 LEU 28 -0.191 0.213 -4.220
188 HD13 LEU 28 3HD1 LEU 28 0.759 -1.244 -4.509
189 HD21 LEU 28 3HD2 LEU 28 1.196 2.350 -6.346
190 HD22 LEU 28 1HD2 LEU 28 0.552 0.888 -7.092
191 HD23 LEU 28 2HD2 LEU 28 2.276 1.246 -7.198
192 H HIS 29 H HIS 29 4.825 1.897 -3.897
193 HA HIS 29 HA HIS 29 5.966 -0.149 -5.308
194 HB2 HIS 29 1HB HIS 29 7.105 2.188 -3.834
195 HB3 HIS 29 2HB HIS 29 8.210 0.985 -4.492
196 HD2 HIS 29 HD2 HIS 29 5.028 2.212 -6.446
197 HE1 HIS 29 HE1 HIS 29 8.508 3.438 -8.540
198 HE2 HIS 29 HE2 HIS 29 5.990 3.391 -8.538
199 H VAL 30 H VAL 30 6.589 0.605 -1.881
200 HA VAL 30 HA VAL 30 8.269 -1.616 -1.415
201 HB VAL 30 HB VAL 30 6.607 -0.044 0.559
202 HG11 VAL 30 1HG1 VAL 30 7.477 -1.243 2.237
203 HG12 VAL 30 2HG1 VAL 30 7.841 -2.449 1.001
204 HG13 VAL 30 3HG1 VAL 30 9.076 -1.291 1.495
205 HG21 VAL 30 3HG2 VAL 30 8.187 1.547 0.563
206 HG22 VAL 30 1HG2 VAL 30 9.500 0.373 0.470
207 HG23 VAL 30 2HG2 VAL 30 8.659 0.874 -0.997
208 H HIS 31 H HIS 31 4.791 -1.141 -1.109
209 HA HIS 31 HA HIS 31 4.150 -3.480 0.278
210 HB2 HIS 31 1HB HIS 31 2.381 -1.987 0.119
211 HB3 HIS 31 2HB HIS 31 2.651 -1.688 -1.596
212 HD1 HIS 31 HD1 HIS 31 1.313 -4.407 0.684
213 HD2 HIS 31 HD2 HIS 31 1.051 -3.132 -3.261
214 HE1 HIS 31 HE1 HIS 31 -0.467 -5.838 -0.368
215 H GLN 32 H GLN 32 4.314 -2.889 -3.225
216 HA GLN 32 HA GLN 32 3.465 -5.208 -4.297
217 HB2 GLN 32 1HB GLN 32 5.922 -3.623 -5.037
218 HB3 GLN 32 2HB GLN 32 5.312 -4.950 -6.016
219 HG2 GLN 32 1HG GLN 32 3.121 -3.706 -6.116
220 HG3 GLN 32 2HG GLN 32 3.972 -2.334 -5.407
221 HE21 GLN 32 1HE2 GLN 32 2.748 -3.106 -8.143
222 HE22 GLN 32 2HE2 GLN 32 3.948 -2.572 -9.265
223 H GLN 33 H GLN 33 6.353 -4.781 -2.396
224 HA GLN 33 HA GLN 33 7.773 -7.077 -3.045
225 HB2 GLN 33 1HB GLN 33 7.511 -5.653 -0.394
226 HB3 GLN 33 2HB GLN 33 8.685 -6.924 -0.711
227 HG2 GLN 33 1HG GLN 33 9.454 -5.444 -2.663
228 HG3 GLN 33 2HG GLN 33 8.550 -4.163 -1.856
229 HE21 GLN 33 1HE2 GLN 33 9.033 -4.219 0.645
230 HE22 GLN 33 2HE2 GLN 33 10.716 -4.207 1.035
231 H ILE 34 H ILE 34 5.278 -6.650 -0.546
232 HA ILE 34 HA ILE 34 5.165 -8.978 0.741
233 HB ILE 34 HB ILE 34 3.446 -7.122 0.833
234 HG12 ILE 34 1HG1 ILE 34 2.053 -9.773 0.747
235 HG13 ILE 34 2HG1 ILE 34 3.363 -9.523 1.896
236 HG21 ILE 34 1HG2 ILE 34 1.476 -7.296 -0.541
237 HG22 ILE 34 2HG2 ILE 34 2.896 -7.181 -1.580
238 HG23 ILE 34 3HG2 ILE 34 2.110 -8.740 -1.331
239 HD11 ILE 34 3HD1 ILE 34 1.381 -9.046 3.055
240 HD12 ILE 34 1HD1 ILE 34 2.098 -7.480 2.679
241 HD13 ILE 34 2HD1 ILE 34 0.741 -8.080 1.725
242 H HIS 35 H HIS 35 3.958 -8.535 -2.568
243 HA HIS 35 HA HIS 35 3.367 -11.362 -2.822
244 HB2 HIS 35 1HB HIS 35 3.326 -9.442 -5.123
245 HB3 HIS 35 2HB HIS 35 2.296 -10.838 -4.822
246 HD1 HIS 35 HD1 HIS 35 0.553 -10.484 -2.745
247 HD2 HIS 35 HD2 HIS 35 2.197 -7.069 -4.447
248 HE1 HIS 35 HE1 HIS 35 -0.944 -8.592 -2.036
249 H THR 36 H THR 36 6.040 -10.957 -2.252
250 HA THR 36 HA THR 36 7.394 -11.431 -4.823
251 HB THR 36 HB THR 36 8.261 -9.555 -3.403
252 HG1 THR 36 HG1 THR 36 9.767 -11.744 -4.280
253 HG21 THR 36 3HG2 THR 36 8.606 -9.867 -1.226
254 HG22 THR 36 1HG2 THR 36 9.831 -11.080 -1.595
255 HG23 THR 36 2HG2 THR 36 8.148 -11.562 -1.386
256 H GLY 37 H GLY 37 6.056 -13.589 -4.180
257 HA2 GLY 37 1HA GLY 37 7.376 -15.784 -4.289
258 HA3 GLY 37 2HA GLY 37 7.884 -15.338 -2.667
259 H GLU 38 H GLU 38 4.678 -14.931 -4.103
260 HA GLU 38 HA GLU 38 3.614 -17.157 -2.578
261 HB2 GLU 38 1HB GLU 38 2.878 -14.289 -1.997
262 HB3 GLU 38 2HB GLU 38 1.862 -15.647 -1.533
263 HG2 GLU 38 1HG GLU 38 3.756 -16.554 -0.221
264 HG3 GLU 38 2HG GLU 38 4.671 -15.098 -0.608
265 H LYS 39 H LYS 39 2.613 -18.160 -4.208
266 HA LYS 39 HA LYS 39 1.394 -18.487 -6.128
267 HB2 LYS 39 1HB LYS 39 -0.280 -18.287 -4.269
268 HB3 LYS 39 2HB LYS 39 -0.497 -16.600 -4.715
269 HG2 LYS 39 1HG LYS 39 -1.252 -17.295 -6.941
270 HG3 LYS 39 2HG LYS 39 -1.063 -18.984 -6.466
271 HD2 LYS 39 1HD LYS 39 -2.811 -18.850 -4.898
272 HD3 LYS 39 2HD LYS 39 -2.806 -17.085 -4.921
273 HE2 LYS 39 1HE LYS 39 -4.694 -17.697 -6.171
274 HE3 LYS 39 2HE LYS 39 -3.473 -17.283 -7.374
275 HZ1 LYS 39 3HZ LYS 39 -3.010 -19.623 -7.680
276 HZ2 LYS 39 1HZ LYS 39 -4.657 -19.326 -7.933
277 HZ3 LYS 39 2HZ LYS 39 -4.138 -20.040 -6.490
278 HA PRO 40 HA PRO 40 2.485 -14.217 -7.841
279 HB2 PRO 40 1HB PRO 40 4.645 -14.992 -9.292
280 HB3 PRO 40 2HB PRO 40 4.759 -14.453 -7.612
281 HG2 PRO 40 1HG PRO 40 4.711 -17.238 -8.709
282 HG3 PRO 40 2HG PRO 40 5.734 -16.557 -7.430
283 HD2 PRO 40 1HD PRO 40 3.546 -18.062 -6.900
284 HD3 PRO 40 2HD PRO 40 4.081 -16.746 -5.835
285 H SER 41 H SER 41 1.947 -13.550 -9.899
286 HA SER 41 HA SER 41 0.637 -15.537 -11.560
287 HB2 SER 41 1HB SER 41 -0.181 -13.579 -12.841
288 HB3 SER 41 2HB SER 41 -0.536 -13.441 -11.119
289 HG SER 41 HG SER 41 0.903 -11.799 -12.684
290 H GLY 42 H GLY 42 3.396 -15.884 -11.504
291 HA2 GLY 42 1HA GLY 42 5.082 -14.750 -13.247
292 HA3 GLY 42 2HA GLY 42 4.950 -16.498 -13.121
293 HA PRO 43 HA PRO 43 3.707 -16.693 -17.319
294 HB2 PRO 43 1HB PRO 43 2.134 -18.906 -17.289
295 HB3 PRO 43 2HB PRO 43 3.894 -18.976 -17.140
296 HG2 PRO 43 1HG PRO 43 1.805 -19.111 -15.000
297 HG3 PRO 43 2HG PRO 43 3.277 -20.081 -15.189
298 HD2 PRO 43 1HD PRO 43 3.120 -17.990 -13.476
299 HD3 PRO 43 2HD PRO 43 4.626 -18.435 -14.303
300 H SER 44 H SER 44 2.441 -14.719 -17.238
301 HA SER 44 HA SER 44 -0.259 -14.626 -16.455
302 HB2 SER 44 1HB SER 44 1.345 -12.932 -18.373
303 HB3 SER 44 2HB SER 44 -0.336 -12.583 -17.969
304 HG SER 44 HG SER 44 1.416 -12.998 -15.849
305 H SER 45 H SER 45 -2.170 -14.624 -17.698
306 HA SER 45 HA SER 45 -2.422 -16.690 -19.546
307 HB2 SER 45 1HB SER 45 -4.236 -14.299 -19.140
308 HB3 SER 45 2HB SER 45 -4.676 -15.775 -19.999
309 HG SER 45 HG SER 45 -3.661 -16.164 -17.466
310 H GLY 46 H GLY 46 -2.477 -13.175 -20.161
311 HA2 GLY 46 1HA GLY 46 -1.038 -12.423 -22.047
312 HA3 GLY 46 2HA GLY 46 -1.701 -13.777 -22.950
Start of MODEL 10
1 H1 GLY 1 H GLY 1 -20.358 -11.643 -0.571
2 HA2 GLY 1 1HA GLY 1 -18.734 -10.526 -2.529
3 HA3 GLY 1 2HA GLY 1 -20.233 -9.814 -1.952
4 H SER 2 H SER 2 -20.116 -7.904 -0.968
5 HA SER 2 HA SER 2 -17.731 -6.461 -0.792
6 HB2 SER 2 1HB SER 2 -19.052 -4.814 0.517
7 HB3 SER 2 2HB SER 2 -19.891 -5.345 -0.940
8 HG SER 2 HG SER 2 -20.362 -6.154 1.734
9 H SER 3 H SER 3 -16.310 -6.030 0.834
10 HA SER 3 HA SER 3 -16.789 -6.910 3.536
11 HB2 SER 3 1HB SER 3 -16.019 -8.979 2.280
12 HB3 SER 3 2HB SER 3 -14.469 -8.166 2.063
13 HG SER 3 HG SER 3 -14.002 -8.507 4.095
14 H GLY 4 H GLY 4 -16.212 -5.073 4.516
15 HA2 GLY 4 1HA GLY 4 -15.031 -3.137 4.982
16 HA3 GLY 4 2HA GLY 4 -13.690 -4.270 5.060
17 H SER 5 H SER 5 -15.492 -2.144 2.888
18 HA SER 5 HA SER 5 -13.005 -1.551 1.484
19 HB2 SER 5 1HB SER 5 -14.155 -1.786 -0.733
20 HB3 SER 5 2HB SER 5 -13.917 -3.315 0.112
21 HG SER 5 HG SER 5 -16.154 -2.442 -0.825
22 H SER 6 H SER 6 -12.907 0.502 0.645
23 HA SER 6 HA SER 6 -14.816 2.381 1.680
24 HB2 SER 6 1HB SER 6 -12.359 2.831 1.578
25 HB3 SER 6 2HB SER 6 -12.485 2.900 -0.179
26 HG SER 6 HG SER 6 -13.913 4.563 1.625
27 H GLY 7 H GLY 7 -16.454 3.362 0.651
28 HA2 GLY 7 1HA GLY 7 -17.259 2.397 -1.925
29 HA3 GLY 7 2HA GLY 7 -18.087 3.611 -0.961
30 H THR 8 H THR 8 -17.543 3.564 -3.837
31 HA THR 8 HA THR 8 -16.524 4.808 -5.505
32 HB THR 8 HB THR 8 -17.190 7.136 -5.408
33 HG1 THR 8 HG1 THR 8 -17.286 6.612 -2.645
34 HG21 THR 8 3HG2 THR 8 -18.918 5.294 -5.670
35 HG22 THR 8 1HG2 THR 8 -19.530 6.866 -5.158
36 HG23 THR 8 2HG2 THR 8 -19.330 5.571 -3.978
37 H GLY 9 H GLY 9 -14.527 3.945 -3.762
38 HA2 GLY 9 1HA GLY 9 -12.896 5.892 -2.633
39 HA3 GLY 9 2HA GLY 9 -12.321 4.364 -3.285
40 H GLU 10 H GLU 10 -11.379 7.287 -3.353
41 HA GLU 10 HA GLU 10 -10.969 7.418 -6.269
42 HB2 GLU 10 1HB GLU 10 -12.266 9.304 -4.935
43 HB3 GLU 10 2HB GLU 10 -10.634 9.840 -4.560
44 HG2 GLU 10 1HG GLU 10 -10.312 9.597 -7.157
45 HG3 GLU 10 2HG GLU 10 -12.065 9.785 -7.163
46 H LYS 11 H LYS 11 -9.366 5.878 -4.495
47 HA LYS 11 HA LYS 11 -7.010 7.245 -3.726
48 HB2 LYS 11 1HB LYS 11 -6.203 5.189 -3.073
49 HB3 LYS 11 2HB LYS 11 -7.933 4.874 -3.067
50 HG2 LYS 11 1HG LYS 11 -6.003 4.154 -5.263
51 HG3 LYS 11 2HG LYS 11 -6.730 3.044 -4.099
52 HD2 LYS 11 1HD LYS 11 -8.477 4.750 -5.825
53 HD3 LYS 11 2HD LYS 11 -7.753 3.283 -6.486
54 HE2 LYS 11 1HE LYS 11 -9.349 3.337 -3.933
55 HE3 LYS 11 2HE LYS 11 -10.065 3.025 -5.513
56 HZ1 LYS 11 3HZ LYS 11 -8.946 1.170 -3.846
57 HZ2 LYS 11 1HZ LYS 11 -7.771 1.396 -5.042
58 HZ3 LYS 11 2HZ LYS 11 -9.341 0.940 -5.475
59 HA PRO 12 HA PRO 12 -4.974 7.754 -7.600
60 HB2 PRO 12 1HB PRO 12 -2.426 7.999 -6.698
61 HB3 PRO 12 2HB PRO 12 -3.634 9.277 -6.521
62 HG2 PRO 12 1HG PRO 12 -2.716 7.249 -4.520
63 HG3 PRO 12 2HG PRO 12 -3.031 8.979 -4.295
64 HD2 PRO 12 1HD PRO 12 -4.804 7.068 -3.563
65 HD3 PRO 12 2HD PRO 12 -5.310 8.671 -4.134
66 H TYR 13 H TYR 13 -3.303 5.580 -5.314
67 HA TYR 13 HA TYR 13 -2.634 3.838 -7.592
68 HB2 TYR 13 1HB TYR 13 -1.258 3.780 -4.913
69 HB3 TYR 13 2HB TYR 13 -0.691 3.130 -6.448
70 HD1 TYR 13 HD1 TYR 13 0.276 4.598 -8.140
71 HD2 TYR 13 HD2 TYR 13 -1.031 6.133 -4.393
72 HE1 TYR 13 HE1 TYR 13 1.523 6.676 -8.563
73 HE2 TYR 13 HE2 TYR 13 0.211 8.216 -4.806
74 HH TYR 13 HH TYR 13 2.009 9.056 -6.118
75 H GLU 14 H GLU 14 -3.034 1.647 -7.473
76 HA GLU 14 HA GLU 14 -4.247 0.548 -5.066
77 HB2 GLU 14 1HB GLU 14 -6.124 1.512 -6.378
78 HB3 GLU 14 2HB GLU 14 -5.680 0.477 -7.727
79 HG2 GLU 14 1HG GLU 14 -6.141 -1.498 -6.379
80 HG3 GLU 14 2HG GLU 14 -6.562 -0.471 -5.010
81 H CYS 15 H CYS 15 -3.784 -1.562 -4.784
82 HA CYS 15 HA CYS 15 -1.998 -2.813 -6.678
83 HB2 CYS 15 1HB CYS 15 -1.670 -2.918 -4.192
84 HB3 CYS 15 2HB CYS 15 -3.095 -3.948 -4.099
85 H SER 16 H SER 16 -2.797 -3.823 -8.394
86 HA SER 16 HA SER 16 -5.458 -4.962 -8.357
87 HB2 SER 16 1HB SER 16 -4.393 -3.692 -10.320
88 HB3 SER 16 2HB SER 16 -3.481 -5.170 -10.624
89 HG SER 16 HG SER 16 -6.304 -5.121 -10.407
90 H ILE 17 H ILE 17 -3.342 -6.144 -6.683
91 HA ILE 17 HA ILE 17 -3.225 -8.833 -7.882
92 HB ILE 17 HB ILE 17 -1.421 -7.650 -5.767
93 HG12 ILE 17 1HG1 ILE 17 -0.711 -8.469 -8.585
94 HG13 ILE 17 2HG1 ILE 17 -1.151 -6.820 -8.152
95 HG21 ILE 17 1HG2 ILE 17 -1.421 -9.891 -5.247
96 HG22 ILE 17 2HG2 ILE 17 -1.699 -10.388 -6.915
97 HG23 ILE 17 3HG2 ILE 17 -0.107 -9.812 -6.420
98 HD11 ILE 17 3HD1 ILE 17 1.272 -7.158 -8.272
99 HD12 ILE 17 1HD1 ILE 17 0.740 -6.673 -6.662
100 HD13 ILE 17 2HD1 ILE 17 1.156 -8.357 -6.984
101 H CYS 18 H CYS 18 -3.338 -7.259 -4.679
102 HA CYS 18 HA CYS 18 -4.926 -9.533 -3.704
103 HB2 CYS 18 1HB CYS 18 -4.295 -8.756 -1.441
104 HB3 CYS 18 2HB CYS 18 -2.892 -9.138 -2.433
105 H GLY 19 H GLY 19 -4.803 -5.994 -3.771
106 HA2 GLY 19 1HA GLY 19 -7.006 -4.943 -4.291
107 HA3 GLY 19 2HA GLY 19 -7.666 -5.980 -3.035
108 H LYS 20 H LYS 20 -4.746 -3.948 -3.164
109 HA LYS 20 HA LYS 20 -5.679 -2.641 -0.695
110 HB2 LYS 20 1HB LYS 20 -2.993 -3.492 -1.655
111 HB3 LYS 20 2HB LYS 20 -3.080 -2.022 -0.693
112 HG2 LYS 20 1HG LYS 20 -4.480 -4.434 0.324
113 HG3 LYS 20 2HG LYS 20 -2.717 -4.393 0.406
114 HD2 LYS 20 1HD LYS 20 -3.211 -3.424 2.414
115 HD3 LYS 20 2HD LYS 20 -3.182 -1.982 1.397
116 HE2 LYS 20 1HE LYS 20 -5.142 -2.084 2.912
117 HE3 LYS 20 2HE LYS 20 -5.578 -2.004 1.205
118 HZ1 LYS 20 3HZ LYS 20 -6.600 -3.772 2.916
119 HZ2 LYS 20 1HZ LYS 20 -5.308 -4.675 2.299
120 HZ3 LYS 20 2HZ LYS 20 -6.477 -4.046 1.251
121 H SER 21 H SER 21 -4.719 -0.378 -0.423
122 HA SER 21 HA SER 21 -4.414 1.072 -2.933
123 HB2 SER 21 1HB SER 21 -6.152 2.746 -2.209
124 HB3 SER 21 2HB SER 21 -6.800 1.169 -2.661
125 HG SER 21 HG SER 21 -7.201 0.717 -0.572
126 H PHE 22 H PHE 22 -3.107 2.814 -2.762
127 HA PHE 22 HA PHE 22 -2.427 3.788 -0.076
128 HB2 PHE 22 1HB PHE 22 -0.372 3.245 -2.225
129 HB3 PHE 22 2HB PHE 22 -0.067 3.774 -0.574
130 HD1 PHE 22 HD1 PHE 22 -1.256 0.951 -2.635
131 HD2 PHE 22 HD2 PHE 22 0.101 2.225 1.193
132 HE1 PHE 22 HE1 PHE 22 -1.059 -1.397 -1.927
133 HE2 PHE 22 HE2 PHE 22 0.301 -0.121 1.907
134 HZ PHE 22 HZ PHE 22 -0.278 -1.936 0.346
135 H THR 23 H THR 23 -1.820 5.950 0.051
136 HA THR 23 HA THR 23 -2.685 7.571 -2.211
137 HB THR 23 HB THR 23 -2.561 9.472 -0.640
138 HG1 THR 23 HG1 THR 23 -2.054 9.046 1.542
139 HG21 THR 23 3HG2 THR 23 -4.151 8.120 1.150
140 HG22 THR 23 1HG2 THR 23 -4.245 7.111 -0.292
141 HG23 THR 23 2HG2 THR 23 -4.690 8.815 -0.378
142 H LYS 24 H LYS 24 0.199 6.432 -0.846
143 HA LYS 24 HA LYS 24 1.740 8.461 -2.327
144 HB2 LYS 24 1HB LYS 24 2.350 7.135 0.309
145 HB3 LYS 24 2HB LYS 24 3.595 7.920 -0.653
146 HG2 LYS 24 1HG LYS 24 1.098 9.344 0.212
147 HG3 LYS 24 2HG LYS 24 2.555 9.284 1.207
148 HD2 LYS 24 1HD LYS 24 2.797 10.134 -1.639
149 HD3 LYS 24 2HD LYS 24 2.128 11.272 -0.467
150 HE2 LYS 24 1HE LYS 24 4.358 11.787 -0.327
151 HE3 LYS 24 2HE LYS 24 4.230 10.567 0.939
152 HZ1 LYS 24 3HZ LYS 24 5.910 10.534 -1.256
153 HZ2 LYS 24 1HZ LYS 24 4.751 9.338 -1.555
154 HZ3 LYS 24 2HZ LYS 24 5.667 9.291 -0.134
155 H LYS 25 H LYS 25 2.609 7.591 -4.081
156 HA LYS 25 HA LYS 25 2.702 5.023 -4.895
157 HB2 LYS 25 1HB LYS 25 3.459 7.085 -6.164
158 HB3 LYS 25 2HB LYS 25 5.019 6.897 -5.375
159 HG2 LYS 25 1HG LYS 25 5.520 4.961 -6.530
160 HG3 LYS 25 2HG LYS 25 3.827 4.615 -6.889
161 HD2 LYS 25 1HD LYS 25 4.783 5.330 -8.926
162 HD3 LYS 25 2HD LYS 25 3.850 6.704 -8.326
163 HE2 LYS 25 1HE LYS 25 5.752 7.893 -7.728
164 HE3 LYS 25 2HE LYS 25 6.758 6.447 -7.669
165 HZ1 LYS 25 3HZ LYS 25 6.179 8.175 -9.882
166 HZ2 LYS 25 1HZ LYS 25 5.933 6.543 -10.253
167 HZ3 LYS 25 2HZ LYS 25 7.437 7.063 -9.682
168 H SER 26 H SER 26 5.182 6.605 -2.910
169 HA SER 26 HA SER 26 7.099 4.670 -2.760
170 HB2 SER 26 1HB SER 26 6.939 6.972 -1.563
171 HB3 SER 26 2HB SER 26 6.205 6.058 -0.246
172 HG SER 26 HG SER 26 8.661 5.275 -1.397
173 H GLN 27 H GLN 27 4.098 4.816 -0.876
174 HA GLN 27 HA GLN 27 4.544 2.582 0.742
175 HB2 GLN 27 1HB GLN 27 1.931 3.673 -0.316
176 HB3 GLN 27 2HB GLN 27 2.080 2.515 0.998
177 HG2 GLN 27 1HG GLN 27 3.431 4.218 2.232
178 HG3 GLN 27 2HG GLN 27 3.021 5.369 0.961
179 HE21 GLN 27 1HE2 GLN 27 2.349 5.945 3.510
180 HE22 GLN 27 2HE2 GLN 27 0.640 5.825 3.727
181 H LEU 28 H LEU 28 2.709 2.785 -2.309
182 HA LEU 28 HA LEU 28 2.043 0.125 -2.590
183 HB2 LEU 28 1HB LEU 28 1.236 1.929 -4.045
184 HB3 LEU 28 2HB LEU 28 2.835 2.042 -4.779
185 HG LEU 28 HG LEU 28 2.534 -0.314 -5.582
186 HD11 LEU 28 1HD1 LEU 28 0.826 -0.996 -3.971
187 HD12 LEU 28 2HD1 LEU 28 0.282 -1.233 -5.631
188 HD13 LEU 28 3HD1 LEU 28 -0.313 0.139 -4.696
189 HD21 LEU 28 3HD2 LEU 28 1.613 2.085 -6.630
190 HD22 LEU 28 1HD2 LEU 28 0.269 0.965 -6.849
191 HD23 LEU 28 2HD2 LEU 28 1.858 0.574 -7.507
192 H HIS 29 H HIS 29 4.922 1.735 -3.946
193 HA HIS 29 HA HIS 29 6.180 -0.341 -5.161
194 HB2 HIS 29 1HB HIS 29 7.252 1.972 -3.580
195 HB3 HIS 29 2HB HIS 29 8.359 0.770 -4.237
196 HD2 HIS 29 HD2 HIS 29 5.279 2.307 -6.172
197 HE1 HIS 29 HE1 HIS 29 8.861 3.221 -8.253
198 HE2 HIS 29 HE2 HIS 29 6.352 3.442 -8.233
199 H VAL 30 H VAL 30 6.448 0.451 -1.699
200 HA VAL 30 HA VAL 30 8.060 -1.792 -1.056
201 HB VAL 30 HB VAL 30 6.295 -0.127 0.745
202 HG11 VAL 30 1HG1 VAL 30 7.060 -1.254 2.538
203 HG12 VAL 30 2HG1 VAL 30 7.336 -2.546 1.368
204 HG13 VAL 30 3HG1 VAL 30 8.663 -1.484 1.841
205 HG21 VAL 30 3HG2 VAL 30 8.695 0.505 -0.618
206 HG22 VAL 30 1HG2 VAL 30 7.827 1.470 0.576
207 HG23 VAL 30 2HG2 VAL 30 9.082 0.345 1.095
208 H HIS 31 H HIS 31 4.577 -1.184 -0.889
209 HA HIS 31 HA HIS 31 3.766 -3.474 0.447
210 HB2 HIS 31 1HB HIS 31 2.139 -1.798 0.046
211 HB3 HIS 31 2HB HIS 31 2.423 -1.828 -1.692
212 HD1 HIS 31 HD1 HIS 31 0.877 -3.932 1.044
213 HD2 HIS 31 HD2 HIS 31 0.834 -3.562 -3.094
214 HE1 HIS 31 HE1 HIS 31 -0.951 -5.466 0.251
215 H GLN 32 H GLN 32 4.498 -3.012 -2.976
216 HA GLN 32 HA GLN 32 3.582 -5.415 -4.001
217 HB2 GLN 32 1HB GLN 32 6.018 -3.809 -4.788
218 HB3 GLN 32 2HB GLN 32 5.361 -5.134 -5.739
219 HG2 GLN 32 1HG GLN 32 3.175 -3.813 -5.734
220 HG3 GLN 32 2HG GLN 32 4.150 -2.454 -5.176
221 HE21 GLN 32 1HE2 GLN 32 4.237 -1.144 -6.878
222 HE22 GLN 32 2HE2 GLN 32 4.778 -1.591 -8.456
223 H GLN 33 H GLN 33 6.311 -4.789 -1.969
224 HA GLN 33 HA GLN 33 7.920 -6.996 -2.518
225 HB2 GLN 33 1HB GLN 33 7.451 -5.659 0.153
226 HB3 GLN 33 2HB GLN 33 8.808 -6.706 -0.245
227 HG2 GLN 33 1HG GLN 33 8.211 -4.109 -1.640
228 HG3 GLN 33 2HG GLN 33 9.331 -4.280 -0.290
229 HE21 GLN 33 1HE2 GLN 33 10.598 -3.271 -2.199
230 HE22 GLN 33 2HE2 GLN 33 11.498 -4.395 -3.154
231 H ILE 34 H ILE 34 4.973 -6.729 -0.656
232 HA ILE 34 HA ILE 34 5.114 -9.161 0.741
233 HB ILE 34 HB ILE 34 3.440 -7.236 1.044
234 HG12 ILE 34 1HG1 ILE 34 2.080 -9.908 1.055
235 HG13 ILE 34 2HG1 ILE 34 3.481 -9.639 2.086
236 HG21 ILE 34 1HG2 ILE 34 1.658 -7.001 -0.319
237 HG22 ILE 34 2HG2 ILE 34 2.723 -7.773 -1.492
238 HG23 ILE 34 3HG2 ILE 34 1.526 -8.733 -0.623
239 HD11 ILE 34 3HD1 ILE 34 0.858 -9.086 2.705
240 HD12 ILE 34 1HD1 ILE 34 2.283 -8.495 3.561
241 HD13 ILE 34 2HD1 ILE 34 1.534 -7.507 2.306
242 H HIS 35 H HIS 35 4.610 -8.503 -2.575
243 HA HIS 35 HA HIS 35 3.538 -11.203 -3.032
244 HB2 HIS 35 1HB HIS 35 3.674 -8.931 -5.019
245 HB3 HIS 35 2HB HIS 35 2.778 -10.438 -5.180
246 HD1 HIS 35 HD1 HIS 35 1.048 -10.659 -2.858
247 HD2 HIS 35 HD2 HIS 35 1.943 -6.942 -4.485
248 HE1 HIS 35 HE1 HIS 35 -0.792 -9.127 -2.088
249 H THR 36 H THR 36 6.383 -10.330 -2.493
250 HA THR 36 HA THR 36 7.575 -11.896 -4.637
251 HB THR 36 HB THR 36 9.502 -10.051 -4.552
252 HG1 THR 36 HG1 THR 36 8.716 -8.026 -4.250
253 HG21 THR 36 3HG2 THR 36 8.829 -10.514 -6.678
254 HG22 THR 36 1HG2 THR 36 8.076 -8.929 -6.512
255 HG23 THR 36 2HG2 THR 36 7.115 -10.389 -6.280
256 H GLY 37 H GLY 37 8.767 -13.402 -3.681
257 HA2 GLY 37 1HA GLY 37 10.955 -13.334 -2.233
258 HA3 GLY 37 2HA GLY 37 9.796 -12.908 -0.983
259 H GLU 38 H GLU 38 7.833 -14.480 -0.946
260 HA GLU 38 HA GLU 38 8.921 -17.215 -1.058
261 HB2 GLU 38 1HB GLU 38 8.514 -16.618 1.216
262 HB3 GLU 38 2HB GLU 38 6.934 -15.952 0.827
263 HG2 GLU 38 1HG GLU 38 6.548 -18.019 1.883
264 HG3 GLU 38 2HG GLU 38 6.234 -18.271 0.166
265 H LYS 39 H LYS 39 8.066 -18.466 -2.567
266 HA LYS 39 HA LYS 39 6.650 -19.312 -4.135
267 HB2 LYS 39 1HB LYS 39 4.762 -18.558 -1.919
268 HB3 LYS 39 2HB LYS 39 4.171 -19.288 -3.406
269 HG2 LYS 39 1HG LYS 39 5.286 -21.299 -3.003
270 HG3 LYS 39 2HG LYS 39 6.351 -20.570 -1.798
271 HD2 LYS 39 1HD LYS 39 4.724 -20.580 -0.162
272 HD3 LYS 39 2HD LYS 39 3.401 -20.585 -1.331
273 HE2 LYS 39 1HE LYS 39 3.632 -22.867 -1.759
274 HE3 LYS 39 2HE LYS 39 5.265 -22.921 -1.097
275 HZ1 LYS 39 3HZ LYS 39 3.874 -23.930 0.487
276 HZ2 LYS 39 1HZ LYS 39 2.710 -22.706 0.385
277 HZ3 LYS 39 2HZ LYS 39 4.206 -22.391 1.107
278 HA PRO 40 HA PRO 40 5.579 -14.910 -5.505
279 HB2 PRO 40 1HB PRO 40 7.568 -14.640 -7.333
280 HB3 PRO 40 2HB PRO 40 7.750 -14.169 -5.639
281 HG2 PRO 40 1HG PRO 40 8.655 -16.666 -7.019
282 HG3 PRO 40 2HG PRO 40 9.518 -15.666 -5.837
283 HD2 PRO 40 1HD PRO 40 8.278 -17.976 -5.161
284 HD3 PRO 40 2HD PRO 40 8.406 -16.599 -4.047
285 H SER 41 H SER 41 5.495 -14.269 -7.996
286 HA SER 41 HA SER 41 4.338 -16.588 -9.397
287 HB2 SER 41 1HB SER 41 2.710 -14.818 -8.783
288 HB3 SER 41 2HB SER 41 3.638 -13.661 -9.736
289 HG SER 41 HG SER 41 2.202 -14.337 -11.177
290 H GLY 42 H GLY 42 5.242 -17.209 -11.249
291 HA2 GLY 42 1HA GLY 42 7.071 -15.314 -12.591
292 HA3 GLY 42 2HA GLY 42 7.389 -17.038 -12.474
293 HA PRO 43 HA PRO 43 3.727 -16.443 -15.604
294 HB2 PRO 43 1HB PRO 43 3.381 -13.915 -16.532
295 HB3 PRO 43 2HB PRO 43 2.532 -14.542 -15.114
296 HG2 PRO 43 1HG PRO 43 4.974 -12.815 -15.250
297 HG3 PRO 43 2HG PRO 43 3.568 -12.683 -14.178
298 HD2 PRO 43 1HD PRO 43 5.911 -13.781 -13.380
299 HD3 PRO 43 2HD PRO 43 4.340 -14.325 -12.756
300 H SER 44 H SER 44 3.668 -15.570 -18.011
301 HA SER 44 HA SER 44 5.834 -16.531 -19.366
302 HB2 SER 44 1HB SER 44 3.511 -15.763 -20.242
303 HB3 SER 44 2HB SER 44 4.297 -14.204 -20.492
304 HG SER 44 HG SER 44 4.373 -15.614 -22.339
305 H SER 45 H SER 45 7.871 -15.944 -18.890
306 HA SER 45 HA SER 45 8.570 -13.159 -18.497
307 HB2 SER 45 1HB SER 45 10.387 -15.579 -18.554
308 HB3 SER 45 2HB SER 45 10.778 -13.979 -17.924
309 HG SER 45 HG SER 45 10.189 -15.058 -16.149
310 H GLY 46 H GLY 46 9.517 -15.770 -20.732
311 HA2 GLY 46 1HA GLY 46 9.380 -14.681 -23.130
312 HA3 GLY 46 2HA GLY 46 10.758 -13.794 -22.496
Start of MODEL 11
1 H1 GLY 1 H GLY 1 -7.481 -10.668 3.485
2 HA2 GLY 1 1HA GLY 1 -10.002 -11.934 2.614
3 HA3 GLY 1 2HA GLY 1 -9.638 -11.708 4.318
4 H SER 2 H SER 2 -8.572 -9.163 4.314
5 HA SER 2 HA SER 2 -10.834 -7.557 4.451
6 HB2 SER 2 1HB SER 2 -8.457 -7.197 5.437
7 HB3 SER 2 2HB SER 2 -8.118 -6.385 3.909
8 HG SER 2 HG SER 2 -9.148 -5.263 5.951
9 H SER 3 H SER 3 -12.132 -7.312 2.724
10 HA SER 3 HA SER 3 -11.416 -7.253 0.050
11 HB2 SER 3 1HB SER 3 -13.720 -7.529 0.614
12 HB3 SER 3 2HB SER 3 -13.759 -5.997 1.486
13 HG SER 3 HG SER 3 -13.030 -5.922 -1.201
14 H GLY 4 H GLY 4 -12.240 -4.405 2.045
15 HA2 GLY 4 1HA GLY 4 -10.053 -2.849 1.232
16 HA3 GLY 4 2HA GLY 4 -11.395 -2.503 0.151
17 H SER 5 H SER 5 -10.549 -0.406 1.476
18 HA SER 5 HA SER 5 -12.067 -0.131 3.954
19 HB2 SER 5 1HB SER 5 -10.943 2.123 4.051
20 HB3 SER 5 2HB SER 5 -9.835 0.751 4.056
21 HG SER 5 HG SER 5 -9.111 2.297 2.591
22 H SER 6 H SER 6 -14.095 0.542 3.882
23 HA SER 6 HA SER 6 -15.027 2.059 1.559
24 HB2 SER 6 1HB SER 6 -16.267 0.009 2.252
25 HB3 SER 6 2HB SER 6 -16.652 0.798 3.782
26 HG SER 6 HG SER 6 -18.178 1.856 2.811
27 H GLY 7 H GLY 7 -14.068 4.063 2.173
28 HA2 GLY 7 1HA GLY 7 -15.420 5.365 4.456
29 HA3 GLY 7 2HA GLY 7 -13.784 5.754 3.946
30 H THR 8 H THR 8 -13.456 7.185 2.295
31 HA THR 8 HA THR 8 -15.592 8.038 0.574
32 HB THR 8 HB THR 8 -14.542 10.003 2.620
33 HG1 THR 8 HG1 THR 8 -16.831 10.012 3.213
34 HG21 THR 8 3HG2 THR 8 -16.486 10.333 0.333
35 HG22 THR 8 1HG2 THR 8 -14.909 11.103 0.503
36 HG23 THR 8 2HG2 THR 8 -16.222 11.530 1.600
37 H GLY 9 H GLY 9 -14.677 8.453 -1.323
38 HA2 GLY 9 1HA GLY 9 -13.199 9.809 -2.661
39 HA3 GLY 9 2HA GLY 9 -12.024 9.735 -1.356
40 H GLU 10 H GLU 10 -11.258 9.182 -3.928
41 HA GLU 10 HA GLU 10 -10.875 6.260 -3.865
42 HB2 GLU 10 1HB GLU 10 -12.241 7.069 -5.790
43 HB3 GLU 10 2HB GLU 10 -10.866 8.031 -6.314
44 HG2 GLU 10 1HG GLU 10 -10.454 5.124 -5.889
45 HG3 GLU 10 2HG GLU 10 -11.359 5.642 -7.310
46 H LYS 11 H LYS 11 -8.839 5.510 -3.857
47 HA LYS 11 HA LYS 11 -6.681 7.402 -3.570
48 HB2 LYS 11 1HB LYS 11 -6.963 4.435 -3.279
49 HB3 LYS 11 2HB LYS 11 -5.358 5.140 -3.415
50 HG2 LYS 11 1HG LYS 11 -5.867 4.883 -1.103
51 HG3 LYS 11 2HG LYS 11 -5.909 6.606 -1.481
52 HD2 LYS 11 1HD LYS 11 -8.392 6.403 -1.727
53 HD3 LYS 11 2HD LYS 11 -8.259 4.750 -1.123
54 HE2 LYS 11 1HE LYS 11 -7.281 7.178 0.371
55 HE3 LYS 11 2HE LYS 11 -8.870 6.451 0.607
56 HZ1 LYS 11 3HZ LYS 11 -6.532 5.748 1.870
57 HZ2 LYS 11 1HZ LYS 11 -6.815 4.496 0.768
58 HZ3 LYS 11 2HZ LYS 11 -7.997 4.902 1.907
59 HA PRO 12 HA PRO 12 -5.257 7.350 -7.735
60 HB2 PRO 12 1HB PRO 12 -2.661 8.024 -7.314
61 HB3 PRO 12 2HB PRO 12 -3.990 9.180 -7.167
62 HG2 PRO 12 1HG PRO 12 -2.542 7.676 -5.022
63 HG3 PRO 12 2HG PRO 12 -3.046 9.376 -5.051
64 HD2 PRO 12 1HD PRO 12 -4.433 7.467 -3.722
65 HD3 PRO 12 2HD PRO 12 -5.219 8.872 -4.471
66 H TYR 13 H TYR 13 -3.373 5.610 -5.293
67 HA TYR 13 HA TYR 13 -2.411 3.780 -7.383
68 HB2 TYR 13 1HB TYR 13 -1.378 3.834 -4.561
69 HB3 TYR 13 2HB TYR 13 -0.577 3.257 -6.017
70 HD1 TYR 13 HD1 TYR 13 0.296 4.905 -7.675
71 HD2 TYR 13 HD2 TYR 13 -1.212 6.106 -3.882
72 HE1 TYR 13 HE1 TYR 13 1.424 7.077 -7.920
73 HE2 TYR 13 HE2 TYR 13 -0.089 8.281 -4.117
74 HH TYR 13 HH TYR 13 1.318 9.312 -7.082
75 H GLU 14 H GLU 14 -3.234 1.802 -7.512
76 HA GLU 14 HA GLU 14 -4.400 0.569 -5.122
77 HB2 GLU 14 1HB GLU 14 -6.190 1.671 -6.528
78 HB3 GLU 14 2HB GLU 14 -5.790 0.526 -7.801
79 HG2 GLU 14 1HG GLU 14 -6.341 -1.324 -6.265
80 HG3 GLU 14 2HG GLU 14 -6.829 -0.137 -5.056
81 H CYS 15 H CYS 15 -3.648 -1.419 -4.841
82 HA CYS 15 HA CYS 15 -1.939 -2.655 -6.745
83 HB2 CYS 15 1HB CYS 15 -1.605 -2.972 -4.348
84 HB3 CYS 15 2HB CYS 15 -3.176 -3.756 -4.213
85 H SER 16 H SER 16 -2.225 -4.643 -7.840
86 HA SER 16 HA SER 16 -5.038 -5.208 -8.491
87 HB2 SER 16 1HB SER 16 -3.525 -4.431 -10.343
88 HB3 SER 16 2HB SER 16 -2.594 -5.913 -10.129
89 HG SER 16 HG SER 16 -4.398 -7.099 -10.717
90 H ILE 17 H ILE 17 -2.134 -6.548 -7.203
91 HA ILE 17 HA ILE 17 -2.635 -9.288 -7.619
92 HB ILE 17 HB ILE 17 -1.078 -7.896 -5.441
93 HG12 ILE 17 1HG1 ILE 17 -0.105 -9.425 -7.861
94 HG13 ILE 17 2HG1 ILE 17 -0.293 -7.675 -7.822
95 HG21 ILE 17 1HG2 ILE 17 -0.009 -10.317 -5.413
96 HG22 ILE 17 2HG2 ILE 17 -1.399 -9.903 -4.411
97 HG23 ILE 17 3HG2 ILE 17 -1.633 -10.771 -5.928
98 HD11 ILE 17 3HD1 ILE 17 1.762 -9.395 -6.595
99 HD12 ILE 17 1HD1 ILE 17 1.892 -7.777 -7.285
100 HD13 ILE 17 2HD1 ILE 17 1.241 -7.993 -5.660
101 H CYS 18 H CYS 18 -3.095 -7.372 -4.640
102 HA CYS 18 HA CYS 18 -5.026 -9.380 -3.722
103 HB2 CYS 18 1HB CYS 18 -4.753 -8.342 -1.502
104 HB3 CYS 18 2HB CYS 18 -3.213 -8.877 -2.167
105 H GLY 19 H GLY 19 -4.656 -5.891 -4.217
106 HA2 GLY 19 1HA GLY 19 -6.601 -4.772 -5.251
107 HA3 GLY 19 2HA GLY 19 -7.603 -5.675 -4.125
108 H LYS 20 H LYS 20 -4.599 -4.405 -2.994
109 HA LYS 20 HA LYS 20 -5.968 -2.753 -1.077
110 HB2 LYS 20 1HB LYS 20 -3.160 -3.610 -1.558
111 HB3 LYS 20 2HB LYS 20 -3.405 -2.127 -0.645
112 HG2 LYS 20 1HG LYS 20 -5.104 -3.667 0.683
113 HG3 LYS 20 2HG LYS 20 -4.031 -4.932 0.079
114 HD2 LYS 20 1HD LYS 20 -2.121 -3.487 0.978
115 HD3 LYS 20 2HD LYS 20 -3.369 -2.599 1.854
116 HE2 LYS 20 1HE LYS 20 -3.895 -4.406 3.196
117 HE3 LYS 20 2HE LYS 20 -3.258 -5.578 2.044
118 HZ1 LYS 20 3HZ LYS 20 -1.936 -4.272 4.204
119 HZ2 LYS 20 1HZ LYS 20 -1.101 -4.048 2.749
120 HZ3 LYS 20 2HZ LYS 20 -1.442 -5.611 3.295
121 H SER 21 H SER 21 -4.863 -0.501 -0.663
122 HA SER 21 HA SER 21 -4.266 0.920 -3.130
123 HB2 SER 21 1HB SER 21 -6.020 2.623 -2.715
124 HB3 SER 21 2HB SER 21 -6.702 1.031 -3.049
125 HG SER 21 HG SER 21 -7.324 0.842 -0.995
126 H PHE 22 H PHE 22 -3.174 2.858 -2.819
127 HA PHE 22 HA PHE 22 -2.601 3.637 -0.049
128 HB2 PHE 22 1HB PHE 22 -0.492 3.306 -2.192
129 HB3 PHE 22 2HB PHE 22 -0.220 3.842 -0.538
130 HD1 PHE 22 HD1 PHE 22 -1.066 0.975 -2.668
131 HD2 PHE 22 HD2 PHE 22 -0.132 2.286 1.272
132 HE1 PHE 22 HE1 PHE 22 -0.729 -1.361 -1.975
133 HE2 PHE 22 HE2 PHE 22 0.207 -0.048 1.972
134 HZ PHE 22 HZ PHE 22 -0.090 -1.876 0.348
135 H THR 23 H THR 23 -1.427 5.785 0.021
136 HA THR 23 HA THR 23 -2.572 7.557 -2.034
137 HB THR 23 HB THR 23 -2.283 9.354 -0.241
138 HG1 THR 23 HG1 THR 23 -1.335 8.682 1.520
139 HG21 THR 23 3HG2 THR 23 -4.273 8.006 1.111
140 HG22 THR 23 1HG2 THR 23 -4.301 7.265 -0.488
141 HG23 THR 23 2HG2 THR 23 -4.495 9.010 -0.321
142 H LYS 24 H LYS 24 0.273 6.193 -1.169
143 HA LYS 24 HA LYS 24 1.800 8.389 -2.372
144 HB2 LYS 24 1HB LYS 24 2.255 7.106 0.277
145 HB3 LYS 24 2HB LYS 24 3.668 7.512 -0.687
146 HG2 LYS 24 1HG LYS 24 3.323 9.763 -0.503
147 HG3 LYS 24 2HG LYS 24 1.579 9.590 -0.289
148 HD2 LYS 24 1HD LYS 24 2.320 10.222 1.826
149 HD3 LYS 24 2HD LYS 24 2.188 8.466 1.951
150 HE2 LYS 24 1HE LYS 24 4.255 8.863 2.901
151 HE3 LYS 24 2HE LYS 24 4.684 8.491 1.232
152 HZ1 LYS 24 3HZ LYS 24 5.260 10.806 2.679
153 HZ2 LYS 24 1HZ LYS 24 4.190 11.244 1.444
154 HZ3 LYS 24 2HZ LYS 24 5.642 10.463 1.067
155 H LYS 25 H LYS 25 3.144 7.741 -3.937
156 HA LYS 25 HA LYS 25 3.093 5.249 -5.076
157 HB2 LYS 25 1HB LYS 25 5.018 7.520 -5.185
158 HB3 LYS 25 2HB LYS 25 5.517 5.988 -5.890
159 HG2 LYS 25 1HG LYS 25 3.486 6.014 -7.294
160 HG3 LYS 25 2HG LYS 25 3.087 7.603 -6.636
161 HD2 LYS 25 1HD LYS 25 5.514 8.198 -7.427
162 HD3 LYS 25 2HD LYS 25 5.288 6.808 -8.491
163 HE2 LYS 25 1HE LYS 25 3.261 9.016 -8.314
164 HE3 LYS 25 2HE LYS 25 4.653 9.120 -9.391
165 HZ1 LYS 25 3HZ LYS 25 3.535 6.630 -9.815
166 HZ2 LYS 25 1HZ LYS 25 3.483 7.964 -10.854
167 HZ3 LYS 25 2HZ LYS 25 2.229 7.704 -9.749
168 H SER 26 H SER 26 5.422 6.471 -2.697
169 HA SER 26 HA SER 26 7.190 4.362 -2.605
170 HB2 SER 26 1HB SER 26 6.272 6.391 -0.629
171 HB3 SER 26 2HB SER 26 7.189 5.017 -0.011
172 HG SER 26 HG SER 26 8.497 6.835 -0.642
173 H GLN 27 H GLN 27 4.204 4.735 -0.703
174 HA GLN 27 HA GLN 27 4.303 2.397 0.755
175 HB2 GLN 27 1HB GLN 27 1.870 3.742 -0.432
176 HB3 GLN 27 2HB GLN 27 1.828 2.525 0.837
177 HG2 GLN 27 1HG GLN 27 3.317 4.110 2.168
178 HG3 GLN 27 2HG GLN 27 2.879 5.327 0.970
179 HE21 GLN 27 1HE2 GLN 27 0.682 5.944 0.784
180 HE22 GLN 27 2HE2 GLN 27 -0.410 5.741 2.107
181 H LEU 28 H LEU 28 2.580 2.834 -2.340
182 HA LEU 28 HA LEU 28 1.808 0.225 -2.763
183 HB2 LEU 28 1HB LEU 28 1.080 2.074 -4.160
184 HB3 LEU 28 2HB LEU 28 2.711 2.251 -4.806
185 HG LEU 28 HG LEU 28 2.380 -0.175 -5.652
186 HD11 LEU 28 1HD1 LEU 28 -0.180 -0.321 -6.271
187 HD12 LEU 28 2HD1 LEU 28 -0.352 0.592 -4.772
188 HD13 LEU 28 3HD1 LEU 28 0.443 -0.982 -4.759
189 HD21 LEU 28 3HD2 LEU 28 0.812 2.084 -6.892
190 HD22 LEU 28 1HD2 LEU 28 1.424 0.649 -7.715
191 HD23 LEU 28 2HD2 LEU 28 2.551 1.839 -7.063
192 H HIS 29 H HIS 29 4.783 1.758 -4.000
193 HA HIS 29 HA HIS 29 5.932 -0.437 -5.206
194 HB2 HIS 29 1HB HIS 29 7.292 1.805 -3.700
195 HB3 HIS 29 2HB HIS 29 8.124 0.672 -4.761
196 HD2 HIS 29 HD2 HIS 29 5.389 1.048 -6.953
197 HE1 HIS 29 HE1 HIS 29 7.350 4.776 -7.462
198 HE2 HIS 29 HE2 HIS 29 5.599 3.205 -8.365
199 H VAL 30 H VAL 30 6.118 0.535 -1.803
200 HA VAL 30 HA VAL 30 7.806 -1.658 -1.059
201 HB VAL 30 HB VAL 30 6.160 0.214 0.647
202 HG11 VAL 30 1HG1 VAL 30 7.827 -2.124 1.305
203 HG12 VAL 30 2HG1 VAL 30 8.107 -0.681 2.281
204 HG13 VAL 30 3HG1 VAL 30 6.494 -1.390 2.197
205 HG21 VAL 30 3HG2 VAL 30 7.813 1.693 0.452
206 HG22 VAL 30 1HG2 VAL 30 9.028 0.472 0.830
207 HG23 VAL 30 2HG2 VAL 30 8.477 0.683 -0.832
208 H HIS 31 H HIS 31 4.506 -1.356 -1.711
209 HA HIS 31 HA HIS 31 3.671 -3.480 0.087
210 HB2 HIS 31 1HB HIS 31 2.035 -1.799 -0.153
211 HB3 HIS 31 2HB HIS 31 2.230 -1.739 -1.902
212 HD1 HIS 31 HD1 HIS 31 0.840 -4.022 0.782
213 HD2 HIS 31 HD2 HIS 31 0.504 -3.325 -3.300
214 HE1 HIS 31 HE1 HIS 31 -1.058 -5.478 0.006
215 H GLN 32 H GLN 32 4.271 -2.968 -3.344
216 HA GLN 32 HA GLN 32 3.225 -5.351 -4.345
217 HB2 GLN 32 1HB GLN 32 5.592 -3.740 -5.311
218 HB3 GLN 32 2HB GLN 32 4.822 -5.027 -6.229
219 HG2 GLN 32 1HG GLN 32 2.710 -3.743 -6.174
220 HG3 GLN 32 2HG GLN 32 3.569 -2.431 -5.368
221 HE21 GLN 32 1HE2 GLN 32 2.215 -2.772 -8.057
222 HE22 GLN 32 2HE2 GLN 32 3.381 -2.187 -9.189
223 H GLN 33 H GLN 33 6.177 -4.711 -2.622
224 HA GLN 33 HA GLN 33 7.451 -7.186 -3.308
225 HB2 GLN 33 1HB GLN 33 9.128 -6.568 -1.681
226 HB3 GLN 33 2HB GLN 33 8.716 -5.158 -2.648
227 HG2 GLN 33 1HG GLN 33 7.740 -4.069 -0.907
228 HG3 GLN 33 2HG GLN 33 7.256 -5.560 -0.100
229 HE21 GLN 33 1HE2 GLN 33 9.846 -3.300 -0.643
230 HE22 GLN 33 2HE2 GLN 33 10.852 -3.832 0.657
231 H ILE 34 H ILE 34 5.121 -6.182 -0.988
232 HA ILE 34 HA ILE 34 5.566 -8.089 1.032
233 HB ILE 34 HB ILE 34 3.989 -6.025 1.017
234 HG12 ILE 34 1HG1 ILE 34 2.901 -8.530 2.297
235 HG13 ILE 34 2HG1 ILE 34 4.381 -7.758 2.857
236 HG21 ILE 34 1HG2 ILE 34 1.960 -6.161 0.072
237 HG22 ILE 34 2HG2 ILE 34 2.674 -7.458 -0.886
238 HG23 ILE 34 3HG2 ILE 34 1.738 -7.841 0.559
239 HD11 ILE 34 3HD1 ILE 34 3.279 -6.006 3.778
240 HD12 ILE 34 1HD1 ILE 34 1.970 -6.061 2.598
241 HD13 ILE 34 2HD1 ILE 34 2.019 -7.231 3.917
242 H HIS 35 H HIS 35 4.364 -8.415 -2.144
243 HA HIS 35 HA HIS 35 2.992 -10.927 -1.559
244 HB2 HIS 35 1HB HIS 35 3.299 -9.448 -4.181
245 HB3 HIS 35 2HB HIS 35 2.289 -10.865 -3.908
246 HD1 HIS 35 HD1 HIS 35 0.342 -10.439 -2.003
247 HD2 HIS 35 HD2 HIS 35 1.984 -7.105 -3.861
248 HE1 HIS 35 HE1 HIS 35 -1.299 -8.574 -1.611
249 H THR 36 H THR 36 5.293 -9.893 -4.081
250 HA THR 36 HA THR 36 6.197 -12.431 -4.756
251 HB THR 36 HB THR 36 6.661 -10.441 -6.122
252 HG1 THR 36 HG1 THR 36 8.046 -12.406 -6.135
253 HG21 THR 36 3HG2 THR 36 7.477 -9.262 -3.802
254 HG22 THR 36 1HG2 THR 36 7.825 -8.646 -5.417
255 HG23 THR 36 2HG2 THR 36 9.019 -9.632 -4.573
256 H GLY 37 H GLY 37 6.749 -10.671 -1.908
257 HA2 GLY 37 1HA GLY 37 9.347 -11.542 -1.224
258 HA3 GLY 37 2HA GLY 37 8.116 -11.002 -0.093
259 H GLU 38 H GLU 38 6.226 -12.742 0.026
260 HA GLU 38 HA GLU 38 7.499 -15.380 0.347
261 HB2 GLU 38 1HB GLU 38 5.732 -13.856 2.237
262 HB3 GLU 38 2HB GLU 38 5.803 -15.611 2.298
263 HG2 GLU 38 1HG GLU 38 7.400 -15.119 3.828
264 HG3 GLU 38 2HG GLU 38 8.398 -15.159 2.376
265 H LYS 39 H LYS 39 5.769 -17.137 0.637
266 HA LYS 39 HA LYS 39 3.333 -16.606 -0.878
267 HB2 LYS 39 1HB LYS 39 4.475 -17.324 -2.731
268 HB3 LYS 39 2HB LYS 39 5.597 -18.302 -1.794
269 HG2 LYS 39 1HG LYS 39 4.218 -20.122 -1.778
270 HG3 LYS 39 2HG LYS 39 2.752 -19.150 -1.920
271 HD2 LYS 39 1HD LYS 39 2.835 -20.016 -4.032
272 HD3 LYS 39 2HD LYS 39 3.809 -18.564 -4.277
273 HE2 LYS 39 1HE LYS 39 5.755 -20.203 -3.531
274 HE3 LYS 39 2HE LYS 39 4.634 -21.416 -4.146
275 HZ1 LYS 39 3HZ LYS 39 6.234 -19.511 -5.581
276 HZ2 LYS 39 1HZ LYS 39 4.618 -19.525 -6.082
277 HZ3 LYS 39 2HZ LYS 39 5.527 -20.951 -6.118
278 HA PRO 40 HA PRO 40 1.686 -19.296 2.207
279 HB2 PRO 40 1HB PRO 40 -0.711 -19.802 1.036
280 HB3 PRO 40 2HB PRO 40 -0.326 -18.260 1.809
281 HG2 PRO 40 1HG PRO 40 -0.277 -18.989 -1.094
282 HG3 PRO 40 2HG PRO 40 -0.892 -17.517 -0.321
283 HD2 PRO 40 1HD PRO 40 1.527 -17.624 -1.532
284 HD3 PRO 40 2HD PRO 40 1.209 -16.591 -0.124
285 H SER 41 H SER 41 1.322 -20.286 -1.195
286 HA SER 41 HA SER 41 0.861 -23.008 -0.719
287 HB2 SER 41 1HB SER 41 2.117 -21.639 -3.109
288 HB3 SER 41 2HB SER 41 1.602 -23.326 -3.084
289 HG SER 41 HG SER 41 -0.488 -22.159 -2.278
290 H GLY 42 H GLY 42 2.178 -24.767 -0.501
291 HA2 GLY 42 1HA GLY 42 5.084 -24.328 -0.565
292 HA3 GLY 42 2HA GLY 42 4.352 -24.982 0.893
293 HA PRO 43 HA PRO 43 3.984 -28.267 -2.681
294 HB2 PRO 43 1HB PRO 43 5.832 -27.978 -4.648
295 HB3 PRO 43 2HB PRO 43 4.220 -27.258 -4.731
296 HG2 PRO 43 1HG PRO 43 6.822 -25.996 -3.956
297 HG3 PRO 43 2HG PRO 43 5.530 -25.353 -4.987
298 HD2 PRO 43 1HD PRO 43 5.829 -24.619 -2.398
299 HD3 PRO 43 2HD PRO 43 4.241 -24.711 -3.187
300 H SER 44 H SER 44 4.801 -29.977 -1.654
301 HA SER 44 HA SER 44 7.267 -30.063 -0.336
302 HB2 SER 44 1HB SER 44 5.546 -32.345 -1.333
303 HB3 SER 44 2HB SER 44 6.881 -32.515 -0.194
304 HG SER 44 HG SER 44 5.628 -31.823 1.340
305 H SER 45 H SER 45 9.218 -29.992 -1.213
306 HA SER 45 HA SER 45 9.792 -30.426 -3.920
307 HB2 SER 45 1HB SER 45 11.460 -30.164 -1.445
308 HB3 SER 45 2HB SER 45 12.226 -30.655 -2.956
309 HG SER 45 HG SER 45 11.437 -28.207 -2.176
310 H GLY 46 H GLY 46 10.495 -32.492 -1.099
311 HA2 GLY 46 1HA GLY 46 9.782 -34.915 -1.770
312 HA3 GLY 46 2HA GLY 46 11.092 -34.710 -2.924
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -10.105 -2.044 -19.127
2 HA2 GLY 1 1HA GLY 1 -12.179 -0.787 -18.179
3 HA3 GLY 1 2HA GLY 1 -10.936 0.212 -17.440
4 H SER 2 H SER 2 -12.952 -0.087 -20.052
5 HA SER 2 HA SER 2 -11.200 1.200 -21.979
6 HB2 SER 2 1HB SER 2 -12.676 -0.415 -22.926
7 HB3 SER 2 2HB SER 2 -14.072 0.271 -22.095
8 HG SER 2 HG SER 2 -12.577 1.806 -23.927
9 H SER 3 H SER 3 -14.105 1.968 -20.103
10 HA SER 3 HA SER 3 -13.770 4.797 -20.847
11 HB2 SER 3 1HB SER 3 -15.998 3.429 -21.220
12 HB3 SER 3 2HB SER 3 -16.249 3.785 -19.511
13 HG SER 3 HG SER 3 -15.742 5.702 -21.545
14 H GLY 4 H GLY 4 -12.268 5.430 -19.329
15 HA2 GLY 4 1HA GLY 4 -11.978 6.583 -17.285
16 HA3 GLY 4 2HA GLY 4 -13.305 5.656 -16.601
17 H SER 5 H SER 5 -10.265 6.178 -16.037
18 HA SER 5 HA SER 5 -9.574 3.355 -15.549
19 HB2 SER 5 1HB SER 5 -7.199 4.193 -15.419
20 HB3 SER 5 2HB SER 5 -7.943 4.338 -17.011
21 HG SER 5 HG SER 5 -7.721 6.419 -16.889
22 H SER 6 H SER 6 -8.927 6.591 -14.189
23 HA SER 6 HA SER 6 -8.843 5.387 -11.516
24 HB2 SER 6 1HB SER 6 -7.660 7.826 -12.747
25 HB3 SER 6 2HB SER 6 -8.075 7.903 -11.035
26 HG SER 6 HG SER 6 -5.885 7.033 -11.837
27 H GLY 7 H GLY 7 -10.113 8.356 -13.046
28 HA2 GLY 7 1HA GLY 7 -12.172 9.374 -12.792
29 HA3 GLY 7 2HA GLY 7 -12.689 7.996 -11.831
30 H THR 8 H THR 8 -13.740 9.482 -10.411
31 HA THR 8 HA THR 8 -11.868 10.857 -8.594
32 HB THR 8 HB THR 8 -14.696 11.683 -9.279
33 HG1 THR 8 HG1 THR 8 -12.409 13.272 -9.691
34 HG21 THR 8 3HG2 THR 8 -12.676 12.940 -7.419
35 HG22 THR 8 1HG2 THR 8 -14.182 12.154 -6.946
36 HG23 THR 8 2HG2 THR 8 -14.223 13.652 -7.876
37 H GLY 9 H GLY 9 -11.828 10.071 -6.595
38 HA2 GLY 9 1HA GLY 9 -13.424 9.653 -4.651
39 HA3 GLY 9 2HA GLY 9 -14.109 8.425 -5.705
40 H GLU 10 H GLU 10 -12.382 6.851 -6.593
41 HA GLU 10 HA GLU 10 -11.265 5.493 -4.388
42 HB2 GLU 10 1HB GLU 10 -11.975 4.674 -6.801
43 HB3 GLU 10 2HB GLU 10 -10.279 4.968 -7.157
44 HG2 GLU 10 1HG GLU 10 -9.635 3.447 -5.358
45 HG3 GLU 10 2HG GLU 10 -11.336 3.151 -5.003
46 H LYS 11 H LYS 11 -9.044 5.013 -3.954
47 HA LYS 11 HA LYS 11 -7.382 7.246 -3.807
48 HB2 LYS 11 1HB LYS 11 -6.818 4.297 -3.556
49 HB3 LYS 11 2HB LYS 11 -5.564 5.508 -3.327
50 HG2 LYS 11 1HG LYS 11 -8.130 5.411 -1.757
51 HG3 LYS 11 2HG LYS 11 -6.602 4.708 -1.222
52 HD2 LYS 11 1HD LYS 11 -5.552 6.912 -1.305
53 HD3 LYS 11 2HD LYS 11 -7.068 7.620 -1.869
54 HE2 LYS 11 1HE LYS 11 -8.145 6.868 0.230
55 HE3 LYS 11 2HE LYS 11 -6.580 6.281 0.790
56 HZ1 LYS 11 3HZ LYS 11 -7.629 8.910 0.872
57 HZ2 LYS 11 1HZ LYS 11 -6.179 8.895 0.001
58 HZ3 LYS 11 2HZ LYS 11 -6.221 8.303 1.585
59 HA PRO 12 HA PRO 12 -5.333 7.548 -7.677
60 HB2 PRO 12 1HB PRO 12 -2.852 8.346 -6.916
61 HB3 PRO 12 2HB PRO 12 -4.266 9.403 -6.840
62 HG2 PRO 12 1HG PRO 12 -2.959 7.828 -4.656
63 HG3 PRO 12 2HG PRO 12 -3.575 9.490 -4.622
64 HD2 PRO 12 1HD PRO 12 -4.961 7.402 -3.598
65 HD3 PRO 12 2HD PRO 12 -5.758 8.809 -4.330
66 H TYR 13 H TYR 13 -3.323 5.946 -5.204
67 HA TYR 13 HA TYR 13 -2.304 4.151 -7.303
68 HB2 TYR 13 1HB TYR 13 -1.071 4.523 -4.579
69 HB3 TYR 13 2HB TYR 13 -0.333 3.850 -6.028
70 HD1 TYR 13 HD1 TYR 13 0.371 5.339 -7.867
71 HD2 TYR 13 HD2 TYR 13 -1.134 6.888 -4.201
72 HE1 TYR 13 HE1 TYR 13 1.297 7.548 -8.427
73 HE2 TYR 13 HE2 TYR 13 -0.213 9.101 -4.751
74 HH TYR 13 HH TYR 13 1.900 9.855 -6.403
75 H GLU 14 H GLU 14 -3.162 2.192 -7.334
76 HA GLU 14 HA GLU 14 -3.982 0.969 -4.783
77 HB2 GLU 14 1HB GLU 14 -5.906 1.729 -6.237
78 HB3 GLU 14 2HB GLU 14 -5.385 0.538 -7.421
79 HG2 GLU 14 1HG GLU 14 -5.632 -1.195 -5.607
80 HG3 GLU 14 2HG GLU 14 -6.427 0.052 -4.648
81 H CYS 15 H CYS 15 -3.712 -1.274 -4.594
82 HA CYS 15 HA CYS 15 -1.562 -2.331 -6.222
83 HB2 CYS 15 1HB CYS 15 -1.560 -2.587 -3.752
84 HB3 CYS 15 2HB CYS 15 -3.002 -3.590 -3.878
85 H SER 16 H SER 16 -1.995 -3.329 -8.067
86 HA SER 16 HA SER 16 -4.590 -4.514 -8.552
87 HB2 SER 16 1HB SER 16 -3.423 -3.197 -10.305
88 HB3 SER 16 2HB SER 16 -2.155 -4.422 -10.349
89 HG SER 16 HG SER 16 -4.031 -5.911 -10.772
90 H ILE 17 H ILE 17 -2.920 -5.740 -6.523
91 HA ILE 17 HA ILE 17 -2.499 -8.384 -7.758
92 HB ILE 17 HB ILE 17 -1.116 -7.265 -5.317
93 HG12 ILE 17 1HG1 ILE 17 0.084 -7.914 -8.011
94 HG13 ILE 17 2HG1 ILE 17 -0.443 -6.297 -7.558
95 HG21 ILE 17 1HG2 ILE 17 -1.094 -9.939 -6.648
96 HG22 ILE 17 2HG2 ILE 17 0.342 -9.362 -5.804
97 HG23 ILE 17 3HG2 ILE 17 -1.180 -9.541 -4.932
98 HD11 ILE 17 3HD1 ILE 17 1.941 -6.532 -7.261
99 HD12 ILE 17 1HD1 ILE 17 1.150 -6.315 -5.699
100 HD13 ILE 17 2HD1 ILE 17 1.695 -7.917 -6.198
101 H CYS 18 H CYS 18 -3.068 -6.988 -4.521
102 HA CYS 18 HA CYS 18 -4.838 -9.255 -3.934
103 HB2 CYS 18 1HB CYS 18 -4.586 -8.539 -1.559
104 HB3 CYS 18 2HB CYS 18 -3.062 -8.980 -2.323
105 H GLY 19 H GLY 19 -4.673 -5.715 -3.609
106 HA2 GLY 19 1HA GLY 19 -6.786 -4.631 -4.504
107 HA3 GLY 19 2HA GLY 19 -7.617 -5.694 -3.378
108 H LYS 20 H LYS 20 -4.746 -3.595 -3.138
109 HA LYS 20 HA LYS 20 -5.996 -2.348 -0.777
110 HB2 LYS 20 1HB LYS 20 -3.218 -3.279 -1.297
111 HB3 LYS 20 2HB LYS 20 -3.414 -1.816 -0.342
112 HG2 LYS 20 1HG LYS 20 -5.113 -3.276 1.004
113 HG3 LYS 20 2HG LYS 20 -4.211 -4.615 0.290
114 HD2 LYS 20 1HD LYS 20 -2.987 -4.311 2.193
115 HD3 LYS 20 2HD LYS 20 -2.145 -3.183 1.129
116 HE2 LYS 20 1HE LYS 20 -2.560 -2.099 3.231
117 HE3 LYS 20 2HE LYS 20 -3.589 -1.364 2.002
118 HZ1 LYS 20 3HZ LYS 20 -5.419 -1.999 3.072
119 HZ2 LYS 20 1HZ LYS 20 -4.423 -2.313 4.403
120 HZ3 LYS 20 2HZ LYS 20 -4.842 -3.566 3.347
121 H SER 21 H SER 21 -4.942 -0.129 -0.312
122 HA SER 21 HA SER 21 -4.393 1.327 -2.797
123 HB2 SER 21 1HB SER 21 -5.975 3.089 -2.210
124 HB3 SER 21 2HB SER 21 -6.816 1.542 -2.315
125 HG SER 21 HG SER 21 -6.569 1.431 0.015
126 H PHE 22 H PHE 22 -3.066 3.101 -2.581
127 HA PHE 22 HA PHE 22 -2.191 3.852 0.109
128 HB2 PHE 22 1HB PHE 22 -0.230 3.232 -2.105
129 HB3 PHE 22 2HB PHE 22 0.145 3.649 -0.436
130 HD1 PHE 22 HD1 PHE 22 -1.556 1.070 -2.501
131 HD2 PHE 22 HD2 PHE 22 0.449 1.979 1.142
132 HE1 PHE 22 HE1 PHE 22 -1.550 -1.319 -1.912
133 HE2 PHE 22 HE2 PHE 22 0.459 -0.409 1.736
134 HZ PHE 22 HZ PHE 22 -0.541 -2.061 0.208
135 H THR 23 H THR 23 -2.004 5.986 0.344
136 HA THR 23 HA THR 23 -2.634 7.740 -1.806
137 HB THR 23 HB THR 23 -2.432 9.536 -0.237
138 HG1 THR 23 HG1 THR 23 -1.481 9.145 1.844
139 HG21 THR 23 3HG2 THR 23 -4.373 8.062 0.071
140 HG22 THR 23 1HG2 THR 23 -3.849 8.771 1.598
141 HG23 THR 23 2HG2 THR 23 -3.451 7.095 1.221
142 H LYS 24 H LYS 24 0.268 6.343 -0.746
143 HA LYS 24 HA LYS 24 1.815 8.300 -2.314
144 HB2 LYS 24 1HB LYS 24 2.382 7.057 0.334
145 HB3 LYS 24 2HB LYS 24 3.739 7.338 -0.748
146 HG2 LYS 24 1HG LYS 24 1.821 9.554 -0.206
147 HG3 LYS 24 2HG LYS 24 3.042 9.140 1.000
148 HD2 LYS 24 1HD LYS 24 4.698 9.267 -0.987
149 HD3 LYS 24 2HD LYS 24 3.409 10.166 -1.792
150 HE2 LYS 24 1HE LYS 24 4.900 11.726 -0.735
151 HE3 LYS 24 2HE LYS 24 3.367 11.728 0.135
152 HZ1 LYS 24 3HZ LYS 24 4.567 11.388 1.956
153 HZ2 LYS 24 1HZ LYS 24 5.977 11.069 1.076
154 HZ3 LYS 24 2HZ LYS 24 4.877 9.824 1.392
155 H LYS 25 H LYS 25 2.261 7.350 -4.194
156 HA LYS 25 HA LYS 25 2.199 4.739 -4.913
157 HB2 LYS 25 1HB LYS 25 3.435 5.293 -6.822
158 HB3 LYS 25 2HB LYS 25 2.703 6.818 -6.343
159 HG2 LYS 25 1HG LYS 25 5.473 6.066 -5.478
160 HG3 LYS 25 2HG LYS 25 5.158 6.836 -7.035
161 HD2 LYS 25 1HD LYS 25 4.008 8.045 -4.563
162 HD3 LYS 25 2HD LYS 25 5.724 8.273 -4.908
163 HE2 LYS 25 1HE LYS 25 3.702 8.790 -7.045
164 HE3 LYS 25 2HE LYS 25 3.959 9.992 -5.781
165 HZ1 LYS 25 3HZ LYS 25 5.752 9.136 -7.924
166 HZ2 LYS 25 1HZ LYS 25 6.456 9.565 -6.447
167 HZ3 LYS 25 2HZ LYS 25 5.495 10.679 -7.281
168 H SER 26 H SER 26 4.676 6.313 -3.047
169 HA SER 26 HA SER 26 6.750 4.449 -3.343
170 HB2 SER 26 1HB SER 26 7.224 6.574 -2.333
171 HB3 SER 26 2HB SER 26 6.046 6.292 -1.051
172 HG SER 26 HG SER 26 8.472 5.863 -0.735
173 H GLN 27 H GLN 27 4.253 4.692 -0.814
174 HA GLN 27 HA GLN 27 4.980 2.422 0.632
175 HB2 GLN 27 1HB GLN 27 2.253 3.667 0.252
176 HB3 GLN 27 2HB GLN 27 2.625 2.441 1.456
177 HG2 GLN 27 1HG GLN 27 4.271 4.912 1.409
178 HG3 GLN 27 2HG GLN 27 2.628 5.006 2.041
179 HE21 GLN 27 1HE2 GLN 27 5.332 5.207 3.307
180 HE22 GLN 27 2HE2 GLN 27 5.286 4.082 4.618
181 H LEU 28 H LEU 28 2.933 2.769 -2.212
182 HA LEU 28 HA LEU 28 1.849 0.183 -2.253
183 HB2 LEU 28 1HB LEU 28 0.880 1.823 -3.648
184 HB3 LEU 28 2HB LEU 28 2.423 2.183 -4.420
185 HG LEU 28 HG LEU 28 2.282 -0.232 -5.321
186 HD11 LEU 28 1HD1 LEU 28 0.026 -1.090 -5.597
187 HD12 LEU 28 2HD1 LEU 28 -0.617 0.250 -4.649
188 HD13 LEU 28 3HD1 LEU 28 0.432 -0.946 -3.887
189 HD21 LEU 28 3HD2 LEU 28 1.715 0.722 -7.261
190 HD22 LEU 28 1HD2 LEU 28 1.587 2.219 -6.338
191 HD23 LEU 28 2HD2 LEU 28 0.147 1.249 -6.647
192 H HIS 29 H HIS 29 4.721 1.486 -3.907
193 HA HIS 29 HA HIS 29 5.542 -0.798 -5.227
194 HB2 HIS 29 1HB HIS 29 7.358 1.240 -3.923
195 HB3 HIS 29 2HB HIS 29 7.772 0.172 -5.262
196 HD2 HIS 29 HD2 HIS 29 5.048 0.839 -7.076
197 HE1 HIS 29 HE1 HIS 29 6.582 4.793 -6.965
198 HE2 HIS 29 HE2 HIS 29 4.945 3.227 -8.066
199 H VAL 30 H VAL 30 6.340 0.231 -1.921
200 HA VAL 30 HA VAL 30 7.968 -2.019 -1.333
201 HB VAL 30 HB VAL 30 6.511 -0.186 0.576
202 HG11 VAL 30 1HG1 VAL 30 8.825 -1.092 1.785
203 HG12 VAL 30 2HG1 VAL 30 7.184 -1.641 2.128
204 HG13 VAL 30 3HG1 VAL 30 8.187 -2.522 0.975
205 HG21 VAL 30 3HG2 VAL 30 8.764 0.901 0.762
206 HG22 VAL 30 1HG2 VAL 30 9.264 -0.049 -0.637
207 HG23 VAL 30 2HG2 VAL 30 7.958 1.127 -0.790
208 H HIS 31 H HIS 31 4.585 -1.571 -1.500
209 HA HIS 31 HA HIS 31 3.939 -3.746 0.302
210 HB2 HIS 31 1HB HIS 31 2.348 -1.990 0.301
211 HB3 HIS 31 2HB HIS 31 2.287 -1.941 -1.458
212 HD1 HIS 31 HD1 HIS 31 1.142 -4.044 1.457
213 HD2 HIS 31 HD2 HIS 31 0.434 -3.616 -2.615
214 HE1 HIS 31 HE1 HIS 31 -0.861 -5.483 0.968
215 H GLN 32 H GLN 32 4.022 -3.140 -3.174
216 HA GLN 32 HA GLN 32 2.822 -5.490 -4.064
217 HB2 GLN 32 1HB GLN 32 5.042 -3.885 -5.342
218 HB3 GLN 32 2HB GLN 32 4.104 -5.126 -6.162
219 HG2 GLN 32 1HG GLN 32 2.077 -3.827 -5.859
220 HG3 GLN 32 2HG GLN 32 2.981 -2.598 -4.976
221 HE21 GLN 32 1HE2 GLN 32 1.485 -1.961 -7.188
222 HE22 GLN 32 2HE2 GLN 32 2.533 -1.501 -8.481
223 H GLN 33 H GLN 33 6.026 -4.908 -2.826
224 HA GLN 33 HA GLN 33 7.164 -7.359 -3.755
225 HB2 GLN 33 1HB GLN 33 9.017 -6.823 -2.224
226 HB3 GLN 33 2HB GLN 33 8.588 -5.455 -3.242
227 HG2 GLN 33 1HG GLN 33 7.797 -4.223 -1.503
228 HG3 GLN 33 2HG GLN 33 7.316 -5.641 -0.572
229 HE21 GLN 33 1HE2 GLN 33 10.255 -4.118 -1.853
230 HE22 GLN 33 2HE2 GLN 33 11.217 -4.394 -0.445
231 H ILE 34 H ILE 34 5.129 -6.489 -1.143
232 HA ILE 34 HA ILE 34 5.841 -8.422 0.764
233 HB ILE 34 HB ILE 34 4.202 -6.435 0.983
234 HG12 ILE 34 1HG1 ILE 34 3.140 -8.930 2.258
235 HG13 ILE 34 2HG1 ILE 34 4.776 -8.399 2.630
236 HG21 ILE 34 1HG2 ILE 34 2.055 -6.624 0.298
237 HG22 ILE 34 2HG2 ILE 34 2.774 -7.708 -0.891
238 HG23 ILE 34 3HG2 ILE 34 2.010 -8.367 0.555
239 HD11 ILE 34 3HD1 ILE 34 4.036 -6.440 3.641
240 HD12 ILE 34 1HD1 ILE 34 2.445 -6.542 2.888
241 HD13 ILE 34 2HD1 ILE 34 2.885 -7.663 4.177
242 H HIS 35 H HIS 35 4.204 -8.696 -2.250
243 HA HIS 35 HA HIS 35 3.034 -11.280 -1.602
244 HB2 HIS 35 1HB HIS 35 3.083 -9.901 -4.289
245 HB3 HIS 35 2HB HIS 35 2.004 -11.191 -3.764
246 HD1 HIS 35 HD1 HIS 35 0.242 -10.486 -1.853
247 HD2 HIS 35 HD2 HIS 35 2.155 -7.376 -3.835
248 HE1 HIS 35 HE1 HIS 35 -1.136 -8.437 -1.377
249 H THR 36 H THR 36 5.820 -11.221 -1.371
250 HA THR 36 HA THR 36 6.733 -12.717 -3.735
251 HB THR 36 HB THR 36 8.133 -10.789 -3.212
252 HG1 THR 36 HG1 THR 36 10.133 -12.111 -2.734
253 HG21 THR 36 3HG2 THR 36 8.823 -10.219 -1.150
254 HG22 THR 36 1HG2 THR 36 9.232 -11.880 -0.725
255 HG23 THR 36 2HG2 THR 36 7.565 -11.319 -0.589
256 H GLY 37 H GLY 37 6.409 -12.830 -0.234
257 HA2 GLY 37 1HA GLY 37 6.934 -14.529 1.270
258 HA3 GLY 37 2HA GLY 37 5.884 -15.414 0.173
259 H GLU 38 H GLU 38 9.202 -14.728 1.053
260 HA GLU 38 HA GLU 38 10.401 -16.385 -0.924
261 HB2 GLU 38 1HB GLU 38 11.467 -14.511 0.511
262 HB3 GLU 38 2HB GLU 38 11.660 -15.762 1.732
263 HG2 GLU 38 1HG GLU 38 13.669 -15.945 0.707
264 HG3 GLU 38 2HG GLU 38 12.746 -17.067 -0.291
265 H LYS 39 H LYS 39 10.457 -18.522 -1.021
266 HA LYS 39 HA LYS 39 10.561 -20.101 1.425
267 HB2 LYS 39 1HB LYS 39 8.285 -20.090 -0.499
268 HB3 LYS 39 2HB LYS 39 8.775 -21.633 0.189
269 HG2 LYS 39 1HG LYS 39 8.553 -20.553 2.458
270 HG3 LYS 39 2HG LYS 39 7.783 -19.194 1.636
271 HD2 LYS 39 1HD LYS 39 6.310 -21.128 0.591
272 HD3 LYS 39 2HD LYS 39 6.799 -21.970 2.064
273 HE2 LYS 39 1HE LYS 39 4.693 -20.834 2.424
274 HE3 LYS 39 2HE LYS 39 5.955 -20.079 3.396
275 HZ1 LYS 39 3HZ LYS 39 5.365 -18.166 2.478
276 HZ2 LYS 39 1HZ LYS 39 4.315 -18.926 1.391
277 HZ3 LYS 39 2HZ LYS 39 5.947 -18.729 0.993
278 HA PRO 40 HA PRO 40 13.306 -22.600 -0.921
279 HB2 PRO 40 1HB PRO 40 12.953 -25.012 0.275
280 HB3 PRO 40 2HB PRO 40 13.812 -23.673 1.046
281 HG2 PRO 40 1HG PRO 40 10.986 -24.582 1.430
282 HG3 PRO 40 2HG PRO 40 12.174 -24.080 2.646
283 HD2 PRO 40 1HD PRO 40 10.212 -22.437 1.762
284 HD3 PRO 40 2HD PRO 40 11.806 -21.837 2.263
285 H SER 41 H SER 41 9.979 -23.687 -0.560
286 HA SER 41 HA SER 41 10.227 -25.447 -2.877
287 HB2 SER 41 1HB SER 41 8.970 -26.072 -0.722
288 HB3 SER 41 2HB SER 41 7.712 -24.971 -1.282
289 HG SER 41 HG SER 41 7.332 -27.128 -1.952
290 H GLY 42 H GLY 42 9.143 -25.145 -4.798
291 HA2 GLY 42 1HA GLY 42 7.656 -22.615 -5.093
292 HA3 GLY 42 2HA GLY 42 8.930 -23.041 -6.227
293 HA PRO 43 HA PRO 43 4.670 -24.781 -7.454
294 HB2 PRO 43 1HB PRO 43 4.089 -23.036 -9.450
295 HB3 PRO 43 2HB PRO 43 3.590 -22.779 -7.774
296 HG2 PRO 43 1HG PRO 43 5.914 -21.614 -9.258
297 HG3 PRO 43 2HG PRO 43 4.785 -20.819 -8.146
298 HD2 PRO 43 1HD PRO 43 7.262 -21.608 -7.389
299 HD3 PRO 43 2HD PRO 43 5.880 -21.601 -6.275
300 H SER 44 H SER 44 6.043 -26.491 -8.195
301 HA SER 44 HA SER 44 7.296 -26.158 -10.809
302 HB2 SER 44 1HB SER 44 8.360 -28.275 -10.410
303 HB3 SER 44 2HB SER 44 8.472 -27.340 -8.918
304 HG SER 44 HG SER 44 6.496 -28.517 -8.292
305 H SER 45 H SER 45 4.543 -25.945 -10.905
306 HA SER 45 HA SER 45 2.905 -28.041 -11.261
307 HB2 SER 45 1HB SER 45 3.242 -25.650 -13.077
308 HB3 SER 45 2HB SER 45 1.910 -26.795 -13.236
309 HG SER 45 HG SER 45 2.371 -25.753 -10.702
310 H GLY 46 H GLY 46 5.082 -26.882 -13.845
311 HA2 GLY 46 1HA GLY 46 5.943 -29.434 -14.628
312 HA3 GLY 46 2HA GLY 46 4.563 -28.997 -15.625
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -21.150 -5.930 -21.660
2 HA2 GLY 1 1HA GLY 1 -18.755 -6.372 -20.515
3 HA3 GLY 1 2HA GLY 1 -18.500 -4.815 -21.289
4 H SER 2 H SER 2 -21.134 -6.319 -19.410
5 HA SER 2 HA SER 2 -22.065 -3.963 -18.255
6 HB2 SER 2 1HB SER 2 -22.313 -6.862 -17.614
7 HB3 SER 2 2HB SER 2 -22.780 -5.710 -16.363
8 HG SER 2 HG SER 2 -24.343 -4.912 -17.664
9 H SER 3 H SER 3 -19.842 -6.380 -16.876
10 HA SER 3 HA SER 3 -19.353 -5.178 -14.437
11 HB2 SER 3 1HB SER 3 -18.536 -7.436 -15.150
12 HB3 SER 3 2HB SER 3 -17.289 -6.635 -16.105
13 HG SER 3 HG SER 3 -16.422 -5.796 -14.218
14 H GLY 4 H GLY 4 -18.410 -3.347 -13.818
15 HA2 GLY 4 1HA GLY 4 -16.160 -2.124 -14.324
16 HA3 GLY 4 2HA GLY 4 -16.979 -1.773 -15.838
17 H SER 5 H SER 5 -18.371 -1.879 -12.587
18 HA SER 5 HA SER 5 -18.771 1.030 -12.712
19 HB2 SER 5 1HB SER 5 -20.817 -0.517 -13.350
20 HB3 SER 5 2HB SER 5 -20.955 -0.687 -11.600
21 HG SER 5 HG SER 5 -20.828 1.730 -11.642
22 H SER 6 H SER 6 -18.158 2.029 -10.914
23 HA SER 6 HA SER 6 -18.238 0.581 -8.365
24 HB2 SER 6 1HB SER 6 -15.997 1.385 -7.774
25 HB3 SER 6 2HB SER 6 -15.936 0.396 -9.232
26 HG SER 6 HG SER 6 -16.283 3.137 -9.568
27 H GLY 7 H GLY 7 -19.216 1.738 -6.843
28 HA2 GLY 7 1HA GLY 7 -19.934 4.483 -7.349
29 HA3 GLY 7 2HA GLY 7 -20.393 3.524 -5.950
30 H THR 8 H THR 8 -19.029 3.453 -4.143
31 HA THR 8 HA THR 8 -17.413 5.826 -3.820
32 HB THR 8 HB THR 8 -18.935 5.068 -2.020
33 HG1 THR 8 HG1 THR 8 -17.215 5.154 -0.337
34 HG21 THR 8 3HG2 THR 8 -17.247 3.045 -0.882
35 HG22 THR 8 1HG2 THR 8 -17.740 2.567 -2.506
36 HG23 THR 8 2HG2 THR 8 -18.959 2.962 -1.294
37 H GLY 9 H GLY 9 -15.221 5.867 -3.190
38 HA2 GLY 9 1HA GLY 9 -13.291 4.340 -2.565
39 HA3 GLY 9 2HA GLY 9 -13.728 3.461 -4.022
40 H GLU 10 H GLU 10 -11.840 5.934 -2.730
41 HA GLU 10 HA GLU 10 -11.017 6.735 -5.433
42 HB2 GLU 10 1HB GLU 10 -11.414 8.606 -3.091
43 HB3 GLU 10 2HB GLU 10 -10.704 9.055 -4.635
44 HG2 GLU 10 1HG GLU 10 -12.849 9.769 -4.931
45 HG3 GLU 10 2HG GLU 10 -12.955 8.140 -5.598
46 H LYS 11 H LYS 11 -8.915 6.453 -5.750
47 HA LYS 11 HA LYS 11 -6.963 7.025 -3.727
48 HB2 LYS 11 1HB LYS 11 -6.226 4.925 -3.171
49 HB3 LYS 11 2HB LYS 11 -7.941 4.595 -3.372
50 HG2 LYS 11 1HG LYS 11 -5.785 4.099 -5.415
51 HG3 LYS 11 2HG LYS 11 -6.603 2.879 -4.435
52 HD2 LYS 11 1HD LYS 11 -8.278 4.697 -6.088
53 HD3 LYS 11 2HD LYS 11 -7.366 3.431 -6.914
54 HE2 LYS 11 1HE LYS 11 -8.558 1.740 -5.926
55 HE3 LYS 11 2HE LYS 11 -8.944 2.700 -4.499
56 HZ1 LYS 11 3HZ LYS 11 -10.952 2.743 -5.508
57 HZ2 LYS 11 1HZ LYS 11 -10.320 2.549 -7.065
58 HZ3 LYS 11 2HZ LYS 11 -10.274 4.065 -6.317
59 HA PRO 12 HA PRO 12 -4.744 7.882 -7.447
60 HB2 PRO 12 1HB PRO 12 -2.295 8.267 -6.340
61 HB3 PRO 12 2HB PRO 12 -3.603 9.450 -6.216
62 HG2 PRO 12 1HG PRO 12 -2.695 7.412 -4.219
63 HG3 PRO 12 2HG PRO 12 -3.150 9.107 -3.961
64 HD2 PRO 12 1HD PRO 12 -4.831 7.050 -3.435
65 HD3 PRO 12 2HD PRO 12 -5.406 8.635 -3.989
66 H TYR 13 H TYR 13 -3.375 5.577 -5.116
67 HA TYR 13 HA TYR 13 -2.377 3.998 -7.394
68 HB2 TYR 13 1HB TYR 13 -1.059 3.998 -4.687
69 HB3 TYR 13 2HB TYR 13 -0.412 3.423 -6.220
70 HD1 TYR 13 HD1 TYR 13 0.393 5.028 -7.907
71 HD2 TYR 13 HD2 TYR 13 -0.927 6.313 -4.072
72 HE1 TYR 13 HE1 TYR 13 1.494 7.199 -8.262
73 HE2 TYR 13 HE2 TYR 13 0.169 8.488 -4.417
74 HH TYR 13 HH TYR 13 1.653 9.330 -7.495
75 H GLU 14 H GLU 14 -3.512 2.192 -7.574
76 HA GLU 14 HA GLU 14 -4.412 0.846 -5.111
77 HB2 GLU 14 1HB GLU 14 -6.249 1.823 -6.508
78 HB3 GLU 14 2HB GLU 14 -5.770 0.740 -7.807
79 HG2 GLU 14 1HG GLU 14 -6.081 -1.075 -5.905
80 HG3 GLU 14 2HG GLU 14 -7.168 0.155 -5.263
81 H CYS 15 H CYS 15 -3.926 -1.264 -4.858
82 HA CYS 15 HA CYS 15 -1.988 -2.433 -6.613
83 HB2 CYS 15 1HB CYS 15 -1.976 -2.739 -4.137
84 HB3 CYS 15 2HB CYS 15 -3.439 -3.708 -4.286
85 H SER 16 H SER 16 -2.181 -4.448 -7.714
86 HA SER 16 HA SER 16 -4.929 -4.985 -8.624
87 HB2 SER 16 1HB SER 16 -2.283 -4.997 -9.997
88 HB3 SER 16 2HB SER 16 -3.494 -6.158 -10.541
89 HG SER 16 HG SER 16 -3.328 -3.605 -11.157
90 H ILE 17 H ILE 17 -2.089 -6.367 -7.200
91 HA ILE 17 HA ILE 17 -2.640 -9.096 -7.666
92 HB ILE 17 HB ILE 17 -1.094 -7.787 -5.427
93 HG12 ILE 17 1HG1 ILE 17 0.140 -9.324 -7.671
94 HG13 ILE 17 2HG1 ILE 17 -0.427 -7.689 -7.990
95 HG21 ILE 17 1HG2 ILE 17 -0.044 -10.095 -5.254
96 HG22 ILE 17 2HG2 ILE 17 -1.675 -9.913 -4.610
97 HG23 ILE 17 3HG2 ILE 17 -1.427 -10.675 -6.181
98 HD11 ILE 17 3HD1 ILE 17 0.974 -6.958 -6.026
99 HD12 ILE 17 1HD1 ILE 17 1.685 -8.572 -6.052
100 HD13 ILE 17 2HD1 ILE 17 1.854 -7.511 -7.451
101 H CYS 18 H CYS 18 -3.147 -7.145 -4.719
102 HA CYS 18 HA CYS 18 -5.118 -9.130 -3.826
103 HB2 CYS 18 1HB CYS 18 -4.881 -7.975 -1.603
104 HB3 CYS 18 2HB CYS 18 -3.415 -8.758 -2.185
105 H GLY 19 H GLY 19 -4.655 -5.637 -4.245
106 HA2 GLY 19 1HA GLY 19 -6.589 -4.505 -5.338
107 HA3 GLY 19 2HA GLY 19 -7.596 -5.346 -4.169
108 H LYS 20 H LYS 20 -4.779 -4.502 -2.650
109 HA LYS 20 HA LYS 20 -5.977 -2.673 -0.911
110 HB2 LYS 20 1HB LYS 20 -3.165 -3.492 -1.487
111 HB3 LYS 20 2HB LYS 20 -3.433 -2.067 -0.492
112 HG2 LYS 20 1HG LYS 20 -4.957 -3.551 0.917
113 HG3 LYS 20 2HG LYS 20 -4.223 -4.906 0.056
114 HD2 LYS 20 1HD LYS 20 -2.019 -4.228 0.821
115 HD3 LYS 20 2HD LYS 20 -2.710 -2.813 1.620
116 HE2 LYS 20 1HE LYS 20 -3.739 -5.524 2.318
117 HE3 LYS 20 2HE LYS 20 -2.184 -5.006 2.968
118 HZ1 LYS 20 3HZ LYS 20 -3.548 -4.218 4.579
119 HZ2 LYS 20 1HZ LYS 20 -4.866 -4.001 3.541
120 HZ3 LYS 20 2HZ LYS 20 -3.602 -2.878 3.549
121 H SER 21 H SER 21 -4.705 -0.447 -0.530
122 HA SER 21 HA SER 21 -4.236 0.979 -3.014
123 HB2 SER 21 1HB SER 21 -6.474 1.798 -1.145
124 HB3 SER 21 2HB SER 21 -5.934 2.696 -2.563
125 HG SER 21 HG SER 21 -7.702 1.463 -3.141
126 H PHE 22 H PHE 22 -3.143 2.941 -2.741
127 HA PHE 22 HA PHE 22 -2.439 3.729 -0.014
128 HB2 PHE 22 1HB PHE 22 -0.336 3.281 -2.138
129 HB3 PHE 22 2HB PHE 22 -0.071 3.727 -0.455
130 HD1 PHE 22 HD1 PHE 22 -1.180 1.011 -2.690
131 HD2 PHE 22 HD2 PHE 22 0.023 2.094 1.246
132 HE1 PHE 22 HE1 PHE 22 -1.000 -1.370 -2.094
133 HE2 PHE 22 HE2 PHE 22 0.206 -0.285 1.848
134 HZ PHE 22 HZ PHE 22 -0.306 -2.020 0.177
135 H THR 23 H THR 23 -1.755 5.880 0.197
136 HA THR 23 HA THR 23 -2.666 7.610 -1.954
137 HB THR 23 HB THR 23 -2.357 9.446 -0.313
138 HG1 THR 23 HG1 THR 23 -1.699 8.960 1.767
139 HG21 THR 23 3HG2 THR 23 -4.250 7.340 -0.239
140 HG22 THR 23 1HG2 THR 23 -4.458 9.011 0.283
141 HG23 THR 23 2HG2 THR 23 -3.898 7.793 1.428
142 H LYS 24 H LYS 24 0.255 6.322 -0.838
143 HA LYS 24 HA LYS 24 1.775 8.406 -2.265
144 HB2 LYS 24 1HB LYS 24 2.426 6.854 0.220
145 HB3 LYS 24 2HB LYS 24 3.717 7.489 -0.791
146 HG2 LYS 24 1HG LYS 24 2.787 9.749 -0.527
147 HG3 LYS 24 2HG LYS 24 1.542 9.092 0.539
148 HD2 LYS 24 1HD LYS 24 4.430 8.589 1.130
149 HD3 LYS 24 2HD LYS 24 3.703 10.141 1.554
150 HE2 LYS 24 1HE LYS 24 2.364 7.586 2.346
151 HE3 LYS 24 2HE LYS 24 3.722 8.200 3.289
152 HZ1 LYS 24 3HZ LYS 24 2.526 9.952 4.046
153 HZ2 LYS 24 1HZ LYS 24 1.239 8.880 3.802
154 HZ3 LYS 24 2HZ LYS 24 1.575 10.074 2.652
155 H LYS 25 H LYS 25 2.823 7.760 -4.025
156 HA LYS 25 HA LYS 25 2.612 5.265 -5.167
157 HB2 LYS 25 1HB LYS 25 3.382 7.397 -6.275
158 HB3 LYS 25 2HB LYS 25 4.967 7.113 -5.569
159 HG2 LYS 25 1HG LYS 25 5.418 5.340 -6.946
160 HG3 LYS 25 2HG LYS 25 3.713 4.958 -7.195
161 HD2 LYS 25 1HD LYS 25 4.367 5.858 -9.241
162 HD3 LYS 25 2HD LYS 25 3.611 7.226 -8.419
163 HE2 LYS 25 1HE LYS 25 6.575 6.692 -8.372
164 HE3 LYS 25 2HE LYS 25 5.795 7.716 -9.577
165 HZ1 LYS 25 3HZ LYS 25 4.829 8.762 -7.329
166 HZ2 LYS 25 1HZ LYS 25 6.242 9.311 -8.080
167 HZ3 LYS 25 2HZ LYS 25 6.339 8.238 -6.776
168 H SER 26 H SER 26 5.226 6.512 -3.125
169 HA SER 26 HA SER 26 6.980 4.358 -3.322
170 HB2 SER 26 1HB SER 26 7.516 6.537 -2.245
171 HB3 SER 26 2HB SER 26 6.504 6.078 -0.876
172 HG SER 26 HG SER 26 8.837 5.648 -0.694
173 H GLN 27 H GLN 27 4.305 4.896 -1.056
174 HA GLN 27 HA GLN 27 4.621 2.718 0.602
175 HB2 GLN 27 1HB GLN 27 2.167 4.144 -0.387
176 HB3 GLN 27 2HB GLN 27 2.038 2.779 0.713
177 HG2 GLN 27 1HG GLN 27 3.527 5.342 1.232
178 HG3 GLN 27 2HG GLN 27 1.971 4.879 1.919
179 HE21 GLN 27 1HE2 GLN 27 4.867 5.366 2.908
180 HE22 GLN 27 2HE2 GLN 27 5.121 4.058 4.007
181 H LEU 28 H LEU 28 2.833 2.848 -2.471
182 HA LEU 28 HA LEU 28 1.961 0.198 -2.509
183 HB2 LEU 28 1HB LEU 28 1.118 1.903 -4.027
184 HB3 LEU 28 2HB LEU 28 2.689 1.994 -4.819
185 HG LEU 28 HG LEU 28 2.350 -0.427 -5.479
186 HD11 LEU 28 1HD1 LEU 28 0.493 -1.550 -4.959
187 HD12 LEU 28 2HD1 LEU 28 -0.548 -0.170 -5.302
188 HD13 LEU 28 3HD1 LEU 28 0.242 -0.309 -3.732
189 HD21 LEU 28 3HD2 LEU 28 1.003 0.143 -7.391
190 HD22 LEU 28 1HD2 LEU 28 2.054 1.505 -7.000
191 HD23 LEU 28 2HD2 LEU 28 0.347 1.553 -6.558
192 H HIS 29 H HIS 29 4.838 1.609 -4.074
193 HA HIS 29 HA HIS 29 5.939 -0.598 -5.230
194 HB2 HIS 29 1HB HIS 29 7.341 1.636 -3.756
195 HB3 HIS 29 2HB HIS 29 8.179 0.451 -4.753
196 HD2 HIS 29 HD2 HIS 29 5.627 0.715 -7.101
197 HE1 HIS 29 HE1 HIS 29 7.451 4.517 -7.566
198 HE2 HIS 29 HE2 HIS 29 5.839 2.849 -8.547
199 H VAL 30 H VAL 30 6.475 0.430 -1.861
200 HA VAL 30 HA VAL 30 8.051 -1.794 -1.134
201 HB VAL 30 HB VAL 30 6.357 -0.008 0.619
202 HG11 VAL 30 1HG1 VAL 30 6.991 -1.200 2.385
203 HG12 VAL 30 2HG1 VAL 30 7.619 -2.415 1.270
204 HG13 VAL 30 3HG1 VAL 30 8.680 -1.146 1.882
205 HG21 VAL 30 3HG2 VAL 30 8.487 0.728 -0.900
206 HG22 VAL 30 1HG2 VAL 30 8.016 1.507 0.611
207 HG23 VAL 30 2HG2 VAL 30 9.279 0.276 0.610
208 H HIS 31 H HIS 31 4.581 -1.205 -1.059
209 HA HIS 31 HA HIS 31 3.802 -3.399 0.494
210 HB2 HIS 31 1HB HIS 31 2.102 -1.855 0.117
211 HB3 HIS 31 2HB HIS 31 2.443 -1.748 -1.607
212 HD1 HIS 31 HD1 HIS 31 1.203 -4.441 0.790
213 HD2 HIS 31 HD2 HIS 31 0.582 -3.036 -3.070
214 HE1 HIS 31 HE1 HIS 31 -0.656 -5.852 -0.148
215 H GLN 32 H GLN 32 3.864 -3.121 -3.064
216 HA GLN 32 HA GLN 32 3.100 -5.576 -3.857
217 HB2 GLN 32 1HB GLN 32 5.487 -4.054 -4.916
218 HB3 GLN 32 2HB GLN 32 4.696 -5.384 -5.750
219 HG2 GLN 32 1HG GLN 32 2.564 -3.891 -5.453
220 HG3 GLN 32 2HG GLN 32 3.755 -2.601 -5.297
221 HE21 GLN 32 1HE2 GLN 32 3.517 -1.547 -7.170
222 HE22 GLN 32 2HE2 GLN 32 3.723 -2.252 -8.734
223 H GLN 33 H GLN 33 6.200 -4.778 -2.396
224 HA GLN 33 HA GLN 33 7.667 -7.045 -2.850
225 HB2 GLN 33 1HB GLN 33 7.497 -5.541 -0.233
226 HB3 GLN 33 2HB GLN 33 8.811 -6.598 -0.730
227 HG2 GLN 33 1HG GLN 33 8.092 -4.292 -2.464
228 HG3 GLN 33 2HG GLN 33 8.991 -3.998 -0.976
229 HE21 GLN 33 1HE2 GLN 33 9.132 -5.059 -4.201
230 HE22 GLN 33 2HE2 GLN 33 10.803 -5.497 -4.234
231 H ILE 34 H ILE 34 5.215 -6.558 -0.332
232 HA ILE 34 HA ILE 34 5.437 -8.892 1.087
233 HB ILE 34 HB ILE 34 3.813 -7.017 1.525
234 HG12 ILE 34 1HG1 ILE 34 2.542 -9.757 1.577
235 HG13 ILE 34 2HG1 ILE 34 3.815 -9.262 2.687
236 HG21 ILE 34 1HG2 ILE 34 1.911 -6.715 0.329
237 HG22 ILE 34 2HG2 ILE 34 2.900 -7.421 -0.948
238 HG23 ILE 34 3HG2 ILE 34 1.753 -8.427 -0.063
239 HD11 ILE 34 3HD1 ILE 34 1.965 -7.238 2.902
240 HD12 ILE 34 1HD1 ILE 34 0.975 -8.688 2.733
241 HD13 ILE 34 2HD1 ILE 34 2.177 -8.585 4.021
242 H HIS 35 H HIS 35 4.091 -8.432 -2.110
243 HA HIS 35 HA HIS 35 2.932 -11.058 -2.263
244 HB2 HIS 35 1HB HIS 35 3.476 -8.967 -4.378
245 HB3 HIS 35 2HB HIS 35 2.638 -10.485 -4.685
246 HD1 HIS 35 HD1 HIS 35 0.536 -10.749 -2.725
247 HD2 HIS 35 HD2 HIS 35 1.675 -6.992 -4.083
248 HE1 HIS 35 HE1 HIS 35 -1.420 -9.241 -2.251
249 H THR 36 H THR 36 5.671 -9.488 -3.925
250 HA THR 36 HA THR 36 6.651 -11.976 -4.954
251 HB THR 36 HB THR 36 7.043 -9.926 -6.205
252 HG1 THR 36 HG1 THR 36 9.425 -11.091 -5.153
253 HG21 THR 36 3HG2 THR 36 7.654 -8.028 -5.215
254 HG22 THR 36 1HG2 THR 36 9.168 -8.763 -4.690
255 HG23 THR 36 2HG2 THR 36 7.733 -8.874 -3.670
256 H GLY 37 H GLY 37 7.969 -13.387 -3.999
257 HA2 GLY 37 1HA GLY 37 9.409 -12.499 -1.575
258 HA3 GLY 37 2HA GLY 37 8.735 -14.110 -1.770
259 H GLU 38 H GLU 38 10.753 -12.048 -3.862
260 HA GLU 38 HA GLU 38 12.737 -12.431 -4.907
261 HB2 GLU 38 1HB GLU 38 13.192 -14.417 -2.673
262 HB3 GLU 38 2HB GLU 38 14.426 -13.745 -3.729
263 HG2 GLU 38 1HG GLU 38 12.803 -12.295 -1.657
264 HG3 GLU 38 2HG GLU 38 14.537 -12.610 -1.643
265 H LYS 39 H LYS 39 10.564 -13.758 -5.955
266 HA LYS 39 HA LYS 39 11.322 -16.516 -6.455
267 HB2 LYS 39 1HB LYS 39 9.018 -14.854 -7.492
268 HB3 LYS 39 2HB LYS 39 9.253 -16.563 -7.838
269 HG2 LYS 39 1HG LYS 39 8.952 -17.139 -5.537
270 HG3 LYS 39 2HG LYS 39 8.929 -15.438 -5.066
271 HD2 LYS 39 1HD LYS 39 6.839 -15.076 -6.091
272 HD3 LYS 39 2HD LYS 39 6.930 -16.589 -6.994
273 HE2 LYS 39 1HE LYS 39 6.837 -16.500 -3.990
274 HE3 LYS 39 2HE LYS 39 5.379 -16.543 -4.980
275 HZ1 LYS 39 3HZ LYS 39 7.421 -18.550 -5.536
276 HZ2 LYS 39 1HZ LYS 39 5.735 -18.681 -5.578
277 HZ3 LYS 39 2HZ LYS 39 6.550 -18.725 -4.097
278 HA PRO 40 HA PRO 40 13.535 -15.814 -10.186
279 HB2 PRO 40 1HB PRO 40 13.008 -18.126 -11.507
280 HB3 PRO 40 2HB PRO 40 14.094 -18.041 -10.116
281 HG2 PRO 40 1HG PRO 40 11.229 -18.900 -10.231
282 HG3 PRO 40 2HG PRO 40 12.583 -19.635 -9.353
283 HD2 PRO 40 1HD PRO 40 10.759 -18.036 -8.147
284 HD3 PRO 40 2HD PRO 40 12.456 -18.109 -7.629
285 H SER 41 H SER 41 13.195 -16.152 -12.672
286 HA SER 41 HA SER 41 10.468 -15.261 -13.352
287 HB2 SER 41 1HB SER 41 11.871 -13.354 -13.600
288 HB3 SER 41 2HB SER 41 13.131 -14.295 -14.397
289 HG SER 41 HG SER 41 11.800 -13.016 -15.832
290 H GLY 42 H GLY 42 9.819 -15.687 -15.600
291 HA2 GLY 42 1HA GLY 42 11.286 -17.622 -17.138
292 HA3 GLY 42 2HA GLY 42 9.899 -18.321 -16.315
293 HA PRO 43 HA PRO 43 7.429 -17.170 -19.758
294 HB2 PRO 43 1HB PRO 43 4.989 -17.137 -18.567
295 HB3 PRO 43 2HB PRO 43 5.858 -18.632 -18.935
296 HG2 PRO 43 1HG PRO 43 5.648 -17.152 -16.342
297 HG3 PRO 43 2HG PRO 43 5.549 -18.896 -16.646
298 HD2 PRO 43 1HD PRO 43 7.794 -17.706 -15.711
299 HD3 PRO 43 2HD PRO 43 7.838 -19.133 -16.766
300 H SER 44 H SER 44 8.165 -15.131 -17.278
301 HA SER 44 HA SER 44 6.462 -13.097 -17.028
302 HB2 SER 44 1HB SER 44 9.422 -13.035 -17.542
303 HB3 SER 44 2HB SER 44 8.525 -11.532 -17.328
304 HG SER 44 HG SER 44 7.862 -12.282 -15.295
305 H SER 45 H SER 45 8.521 -13.527 -19.897
306 HA SER 45 HA SER 45 6.532 -12.059 -21.467
307 HB2 SER 45 1HB SER 45 8.117 -10.608 -22.472
308 HB3 SER 45 2HB SER 45 8.457 -10.539 -20.743
309 HG SER 45 HG SER 45 10.409 -10.870 -21.618
310 H GLY 46 H GLY 46 6.630 -12.484 -23.749
311 HA2 GLY 46 1HA GLY 46 7.079 -15.188 -24.373
312 HA3 GLY 46 2HA GLY 46 6.777 -13.910 -25.541
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -32.041 -2.049 4.752
2 HA2 GLY 1 1HA GLY 1 -33.296 -3.160 3.150
3 HA3 GLY 1 2HA GLY 1 -33.316 -1.555 2.434
4 H SER 2 H SER 2 -31.192 -1.059 1.181
5 HA SER 2 HA SER 2 -30.613 -3.409 -0.500
6 HB2 SER 2 1HB SER 2 -30.874 -0.486 -1.197
7 HB3 SER 2 2HB SER 2 -30.080 -1.635 -2.273
8 HG SER 2 HG SER 2 -32.586 -2.340 -1.291
9 H SER 3 H SER 3 -28.478 -3.125 -1.738
10 HA SER 3 HA SER 3 -26.433 -2.122 0.134
11 HB2 SER 3 1HB SER 3 -26.704 -4.692 -0.310
12 HB3 SER 3 2HB SER 3 -25.865 -4.329 -1.818
13 HG SER 3 HG SER 3 -24.899 -4.447 0.737
14 H GLY 4 H GLY 4 -26.453 -0.083 -0.952
15 HA2 GLY 4 1HA GLY 4 -25.575 -0.065 -3.742
16 HA3 GLY 4 2HA GLY 4 -26.109 1.328 -2.814
17 H SER 5 H SER 5 -23.575 -1.130 -2.321
18 HA SER 5 HA SER 5 -21.746 0.879 -1.368
19 HB2 SER 5 1HB SER 5 -21.298 -2.062 -1.935
20 HB3 SER 5 2HB SER 5 -20.180 -1.000 -1.078
21 HG SER 5 HG SER 5 -22.302 -0.649 0.243
22 H SER 6 H SER 6 -21.257 2.265 -3.029
23 HA SER 6 HA SER 6 -19.921 1.083 -5.374
24 HB2 SER 6 1HB SER 6 -21.913 2.299 -6.032
25 HB3 SER 6 2HB SER 6 -21.396 3.714 -5.115
26 HG SER 6 HG SER 6 -20.574 2.806 -7.593
27 H GLY 7 H GLY 7 -18.118 2.305 -6.275
28 HA2 GLY 7 1HA GLY 7 -15.982 3.115 -5.950
29 HA3 GLY 7 2HA GLY 7 -16.839 4.485 -5.259
30 H THR 8 H THR 8 -15.711 1.223 -4.390
31 HA THR 8 HA THR 8 -15.746 1.700 -1.595
32 HB THR 8 HB THR 8 -15.821 -0.572 -2.352
33 HG1 THR 8 HG1 THR 8 -14.552 -1.245 -0.782
34 HG21 THR 8 3HG2 THR 8 -14.596 -1.393 -4.032
35 HG22 THR 8 1HG2 THR 8 -13.089 -0.868 -3.283
36 HG23 THR 8 2HG2 THR 8 -14.010 0.250 -4.290
37 H GLY 9 H GLY 9 -13.636 2.717 -4.047
38 HA2 GLY 9 1HA GLY 9 -11.953 4.095 -2.213
39 HA3 GLY 9 2HA GLY 9 -11.128 2.691 -2.873
40 H GLU 10 H GLU 10 -10.934 5.757 -3.181
41 HA GLU 10 HA GLU 10 -10.801 5.730 -6.125
42 HB2 GLU 10 1HB GLU 10 -12.588 7.226 -5.099
43 HB3 GLU 10 2HB GLU 10 -11.271 8.199 -4.460
44 HG2 GLU 10 1HG GLU 10 -11.630 9.343 -6.371
45 HG3 GLU 10 2HG GLU 10 -10.509 8.138 -7.002
46 H LYS 11 H LYS 11 -8.881 5.312 -3.709
47 HA LYS 11 HA LYS 11 -6.986 7.279 -3.513
48 HB2 LYS 11 1HB LYS 11 -6.869 4.302 -3.382
49 HB3 LYS 11 2HB LYS 11 -5.351 5.190 -3.419
50 HG2 LYS 11 1HG LYS 11 -5.900 4.795 -1.144
51 HG3 LYS 11 2HG LYS 11 -6.168 6.511 -1.463
52 HD2 LYS 11 1HD LYS 11 -8.605 5.857 -1.900
53 HD3 LYS 11 2HD LYS 11 -8.200 4.322 -1.128
54 HE2 LYS 11 1HE LYS 11 -7.832 7.042 0.123
55 HE3 LYS 11 2HE LYS 11 -9.190 5.962 0.435
56 HZ1 LYS 11 3HZ LYS 11 -6.608 4.734 0.791
57 HZ2 LYS 11 1HZ LYS 11 -7.969 4.705 1.796
58 HZ3 LYS 11 2HZ LYS 11 -6.901 6.016 1.854
59 HA PRO 12 HA PRO 12 -5.093 7.769 -7.449
60 HB2 PRO 12 1HB PRO 12 -2.606 8.554 -6.695
61 HB3 PRO 12 2HB PRO 12 -4.026 9.598 -6.558
62 HG2 PRO 12 1HG PRO 12 -2.677 7.951 -4.454
63 HG3 PRO 12 2HG PRO 12 -3.303 9.606 -4.348
64 HD2 PRO 12 1HD PRO 12 -4.661 7.471 -3.384
65 HD3 PRO 12 2HD PRO 12 -5.476 8.900 -4.051
66 H TYR 13 H TYR 13 -3.634 5.675 -5.061
67 HA TYR 13 HA TYR 13 -2.410 4.122 -7.242
68 HB2 TYR 13 1HB TYR 13 -1.213 4.325 -4.482
69 HB3 TYR 13 2HB TYR 13 -0.477 3.668 -5.940
70 HD1 TYR 13 HD1 TYR 13 0.219 5.223 -7.770
71 HD2 TYR 13 HD2 TYR 13 -1.076 6.639 -3.972
72 HE1 TYR 13 HE1 TYR 13 1.248 7.407 -8.240
73 HE2 TYR 13 HE2 TYR 13 -0.051 8.827 -4.432
74 HH TYR 13 HH TYR 13 1.184 9.656 -7.564
75 H GLU 14 H GLU 14 -3.323 2.194 -7.396
76 HA GLU 14 HA GLU 14 -4.227 0.859 -4.931
77 HB2 GLU 14 1HB GLU 14 -6.116 1.740 -6.325
78 HB3 GLU 14 2HB GLU 14 -5.593 0.671 -7.618
79 HG2 GLU 14 1HG GLU 14 -5.916 -1.249 -6.057
80 HG3 GLU 14 2HG GLU 14 -6.627 -0.117 -4.908
81 H CYS 15 H CYS 15 -3.821 -1.311 -4.749
82 HA CYS 15 HA CYS 15 -1.790 -2.371 -6.513
83 HB2 CYS 15 1HB CYS 15 -1.733 -2.621 -4.008
84 HB3 CYS 15 2HB CYS 15 -3.098 -3.725 -4.148
85 H SER 16 H SER 16 -2.323 -3.360 -8.336
86 HA SER 16 HA SER 16 -4.945 -4.538 -8.684
87 HB2 SER 16 1HB SER 16 -2.591 -4.205 -10.553
88 HB3 SER 16 2HB SER 16 -4.103 -4.984 -11.021
89 HG SER 16 HG SER 16 -3.854 -2.639 -11.463
90 H ILE 17 H ILE 17 -3.003 -5.746 -6.808
91 HA ILE 17 HA ILE 17 -2.703 -8.389 -8.078
92 HB ILE 17 HB ILE 17 -1.177 -7.271 -5.723
93 HG12 ILE 17 1HG1 ILE 17 -0.133 -7.930 -8.478
94 HG13 ILE 17 2HG1 ILE 17 -0.656 -6.314 -8.017
95 HG21 ILE 17 1HG2 ILE 17 0.249 -9.340 -6.179
96 HG22 ILE 17 2HG2 ILE 17 -1.305 -9.584 -5.385
97 HG23 ILE 17 3HG2 ILE 17 -1.129 -9.935 -7.104
98 HD11 ILE 17 3HD1 ILE 17 1.048 -6.225 -6.304
99 HD12 ILE 17 1HD1 ILE 17 1.542 -7.875 -6.680
100 HD13 ILE 17 2HD1 ILE 17 1.769 -6.593 -7.870
101 H CYS 18 H CYS 18 -3.079 -7.032 -4.796
102 HA CYS 18 HA CYS 18 -4.760 -9.333 -4.106
103 HB2 CYS 18 1HB CYS 18 -4.416 -8.577 -1.756
104 HB3 CYS 18 2HB CYS 18 -2.916 -8.971 -2.589
105 H GLY 19 H GLY 19 -4.708 -5.784 -3.843
106 HA2 GLY 19 1HA GLY 19 -6.893 -4.781 -4.639
107 HA3 GLY 19 2HA GLY 19 -7.637 -5.867 -3.474
108 H LYS 20 H LYS 20 -4.680 -3.958 -3.104
109 HA LYS 20 HA LYS 20 -5.894 -2.690 -0.752
110 HB2 LYS 20 1HB LYS 20 -3.079 -3.319 -1.552
111 HB3 LYS 20 2HB LYS 20 -3.378 -2.009 -0.417
112 HG2 LYS 20 1HG LYS 20 -4.806 -3.812 0.827
113 HG3 LYS 20 2HG LYS 20 -3.800 -4.938 -0.088
114 HD2 LYS 20 1HD LYS 20 -2.677 -4.624 1.957
115 HD3 LYS 20 2HD LYS 20 -1.805 -3.625 0.792
116 HE2 LYS 20 1HE LYS 20 -3.174 -1.679 1.565
117 HE3 LYS 20 2HE LYS 20 -3.825 -2.714 2.835
118 HZ1 LYS 20 3HZ LYS 20 -0.926 -2.603 2.621
119 HZ2 LYS 20 1HZ LYS 20 -1.911 -2.649 3.996
120 HZ3 LYS 20 2HZ LYS 20 -1.686 -1.193 3.165
121 H SER 21 H SER 21 -4.691 -0.433 -0.348
122 HA SER 21 HA SER 21 -4.474 1.114 -2.802
123 HB2 SER 21 1HB SER 21 -6.144 2.780 -2.044
124 HB3 SER 21 2HB SER 21 -6.870 1.201 -2.342
125 HG SER 21 HG SER 21 -6.751 2.637 -0.046
126 H PHE 22 H PHE 22 -3.292 2.992 -2.580
127 HA PHE 22 HA PHE 22 -2.439 3.806 0.089
128 HB2 PHE 22 1HB PHE 22 -0.388 3.293 -2.062
129 HB3 PHE 22 2HB PHE 22 -0.110 3.633 -0.357
130 HD1 PHE 22 HD1 PHE 22 -1.509 1.105 -2.679
131 HD2 PHE 22 HD2 PHE 22 0.079 1.898 1.189
132 HE1 PHE 22 HE1 PHE 22 -1.442 -1.311 -2.215
133 HE2 PHE 22 HE2 PHE 22 0.150 -0.516 1.659
134 HZ PHE 22 HZ PHE 22 -0.610 -2.124 -0.045
135 H THR 23 H THR 23 -1.738 5.939 0.228
136 HA THR 23 HA THR 23 -2.517 7.604 -2.043
137 HB THR 23 HB THR 23 -2.232 9.490 -0.352
138 HG1 THR 23 HG1 THR 23 -2.173 8.838 1.828
139 HG21 THR 23 3HG2 THR 23 -4.273 7.977 0.967
140 HG22 THR 23 1HG2 THR 23 -4.332 7.647 -0.764
141 HG23 THR 23 2HG2 THR 23 -4.445 9.307 -0.178
142 H LYS 24 H LYS 24 0.173 6.094 -1.385
143 HA LYS 24 HA LYS 24 1.855 8.267 -2.394
144 HB2 LYS 24 1HB LYS 24 2.238 6.751 0.138
145 HB3 LYS 24 2HB LYS 24 3.670 7.106 -0.819
146 HG2 LYS 24 1HG LYS 24 1.770 9.315 -0.221
147 HG3 LYS 24 2HG LYS 24 2.847 8.742 1.056
148 HD2 LYS 24 1HD LYS 24 3.944 10.549 -0.046
149 HD3 LYS 24 2HD LYS 24 4.755 9.062 -0.541
150 HE2 LYS 24 1HE LYS 24 3.747 9.097 -2.666
151 HE3 LYS 24 2HE LYS 24 2.546 10.288 -2.167
152 HZ1 LYS 24 3HZ LYS 24 5.446 10.885 -2.266
153 HZ2 LYS 24 1HZ LYS 24 4.163 11.980 -2.135
154 HZ3 LYS 24 2HZ LYS 24 4.415 11.142 -3.582
155 H LYS 25 H LYS 25 2.813 7.622 -4.196
156 HA LYS 25 HA LYS 25 2.662 5.138 -5.344
157 HB2 LYS 25 1HB LYS 25 3.408 7.248 -6.465
158 HB3 LYS 25 2HB LYS 25 4.977 7.050 -5.695
159 HG2 LYS 25 1HG LYS 25 5.337 6.166 -7.791
160 HG3 LYS 25 2HG LYS 25 4.972 4.727 -6.837
161 HD2 LYS 25 1HD LYS 25 2.745 4.639 -7.676
162 HD3 LYS 25 2HD LYS 25 2.898 6.231 -8.421
163 HE2 LYS 25 1HE LYS 25 3.175 4.812 -10.226
164 HE3 LYS 25 2HE LYS 25 4.840 5.142 -9.750
165 HZ1 LYS 25 3HZ LYS 25 3.252 2.710 -9.151
166 HZ2 LYS 25 1HZ LYS 25 4.753 3.042 -8.444
167 HZ3 LYS 25 2HZ LYS 25 4.636 2.822 -10.117
168 H SER 26 H SER 26 5.164 6.364 -3.174
169 HA SER 26 HA SER 26 6.946 4.201 -3.396
170 HB2 SER 26 1HB SER 26 7.306 6.505 -2.287
171 HB3 SER 26 2HB SER 26 6.574 5.778 -0.857
172 HG SER 26 HG SER 26 8.644 5.297 -0.565
173 H GLN 27 H GLN 27 4.251 4.798 -1.173
174 HA GLN 27 HA GLN 27 4.565 2.624 0.517
175 HB2 GLN 27 1HB GLN 27 2.127 4.110 -0.426
176 HB3 GLN 27 2HB GLN 27 1.996 2.763 0.697
177 HG2 GLN 27 1HG GLN 27 3.378 5.394 1.107
178 HG3 GLN 27 2HG GLN 27 2.020 4.718 2.004
179 HE21 GLN 27 1HE2 GLN 27 4.954 5.572 2.549
180 HE22 GLN 27 2HE2 GLN 27 5.539 4.298 3.559
181 H LEU 28 H LEU 28 2.655 2.804 -2.483
182 HA LEU 28 HA LEU 28 1.760 0.158 -2.493
183 HB2 LEU 28 1HB LEU 28 0.845 1.895 -3.940
184 HB3 LEU 28 2HB LEU 28 2.364 1.964 -4.831
185 HG LEU 28 HG LEU 28 1.940 -0.454 -5.468
186 HD11 LEU 28 1HD1 LEU 28 0.154 -0.643 -3.615
187 HD12 LEU 28 2HD1 LEU 28 -0.144 -1.426 -5.167
188 HD13 LEU 28 3HD1 LEU 28 -0.920 0.113 -4.792
189 HD21 LEU 28 3HD2 LEU 28 1.621 0.927 -7.250
190 HD22 LEU 28 1HD2 LEU 28 0.438 1.928 -6.407
191 HD23 LEU 28 2HD2 LEU 28 -0.034 0.352 -7.043
192 H HIS 29 H HIS 29 4.574 1.581 -4.152
193 HA HIS 29 HA HIS 29 5.569 -0.683 -5.369
194 HB2 HIS 29 1HB HIS 29 6.781 1.841 -4.363
195 HB3 HIS 29 2HB HIS 29 7.879 0.527 -4.775
196 HD2 HIS 29 HD2 HIS 29 5.744 -0.277 -7.421
197 HE1 HIS 29 HE1 HIS 29 7.400 3.355 -8.858
198 HE2 HIS 29 HE2 HIS 29 6.077 1.295 -9.448
199 H VAL 30 H VAL 30 6.135 0.450 -2.058
200 HA VAL 30 HA VAL 30 7.927 -1.640 -1.358
201 HB VAL 30 HB VAL 30 6.230 0.119 0.419
202 HG11 VAL 30 1HG1 VAL 30 8.720 -1.023 1.471
203 HG12 VAL 30 2HG1 VAL 30 7.144 -0.826 2.240
204 HG13 VAL 30 3HG1 VAL 30 7.439 -2.197 1.169
205 HG21 VAL 30 3HG2 VAL 30 9.049 0.668 0.453
206 HG22 VAL 30 1HG2 VAL 30 8.435 0.743 -1.199
207 HG23 VAL 30 2HG2 VAL 30 7.707 1.742 0.059
208 H HIS 31 H HIS 31 4.438 -1.201 -1.026
209 HA HIS 31 HA HIS 31 3.909 -3.440 0.578
210 HB2 HIS 31 1HB HIS 31 2.117 -1.969 0.417
211 HB3 HIS 31 2HB HIS 31 2.281 -1.799 -1.328
212 HD1 HIS 31 HD1 HIS 31 1.090 -4.320 1.237
213 HD2 HIS 31 HD2 HIS 31 0.632 -3.408 -2.790
214 HE1 HIS 31 HE1 HIS 31 -0.724 -5.850 0.403
215 H GLN 32 H GLN 32 3.877 -3.081 -2.960
216 HA GLN 32 HA GLN 32 3.018 -5.536 -3.761
217 HB2 GLN 32 1HB GLN 32 5.289 -3.912 -4.916
218 HB3 GLN 32 2HB GLN 32 4.547 -5.284 -5.729
219 HG2 GLN 32 1HG GLN 32 2.342 -3.918 -5.325
220 HG3 GLN 32 2HG GLN 32 3.464 -2.562 -5.224
221 HE21 GLN 32 1HE2 GLN 32 1.425 -3.109 -7.213
222 HE22 GLN 32 2HE2 GLN 32 2.238 -3.192 -8.735
223 H GLN 33 H GLN 33 6.007 -4.781 -2.174
224 HA GLN 33 HA GLN 33 7.529 -7.025 -2.855
225 HB2 GLN 33 1HB GLN 33 7.512 -5.481 -0.256
226 HB3 GLN 33 2HB GLN 33 8.779 -6.584 -0.777
227 HG2 GLN 33 1HG GLN 33 8.929 -5.043 -2.850
228 HG3 GLN 33 2HG GLN 33 8.076 -3.882 -1.835
229 HE21 GLN 33 1HE2 GLN 33 10.184 -2.758 -2.348
230 HE22 GLN 33 2HE2 GLN 33 11.473 -2.981 -1.220
231 H ILE 34 H ILE 34 5.126 -6.551 -0.308
232 HA ILE 34 HA ILE 34 5.461 -8.871 1.148
233 HB ILE 34 HB ILE 34 3.846 -6.986 1.632
234 HG12 ILE 34 1HG1 ILE 34 2.528 -9.688 1.833
235 HG13 ILE 34 2HG1 ILE 34 3.960 -9.286 2.775
236 HG21 ILE 34 1HG2 ILE 34 2.687 -7.934 -0.780
237 HG22 ILE 34 2HG2 ILE 34 1.525 -8.180 0.523
238 HG23 ILE 34 3HG2 ILE 34 2.185 -6.572 0.222
239 HD11 ILE 34 3HD1 ILE 34 1.469 -8.940 3.663
240 HD12 ILE 34 1HD1 ILE 34 2.823 -7.930 4.168
241 HD13 ILE 34 2HD1 ILE 34 1.725 -7.368 2.906
242 H HIS 35 H HIS 35 4.273 -8.493 -2.063
243 HA HIS 35 HA HIS 35 2.902 -11.020 -2.176
244 HB2 HIS 35 1HB HIS 35 3.780 -9.146 -4.383
245 HB3 HIS 35 2HB HIS 35 2.746 -10.554 -4.605
246 HD1 HIS 35 HD1 HIS 35 0.760 -10.221 -2.339
247 HD2 HIS 35 HD2 HIS 35 2.076 -7.064 -4.697
248 HE1 HIS 35 HE1 HIS 35 -1.025 -8.459 -2.161
249 H THR 36 H THR 36 5.940 -9.745 -3.523
250 HA THR 36 HA THR 36 6.760 -12.331 -4.478
251 HB THR 36 HB THR 36 7.451 -10.297 -5.664
252 HG1 THR 36 HG1 THR 36 8.986 -11.675 -6.166
253 HG21 THR 36 3HG2 THR 36 7.693 -8.894 -3.596
254 HG22 THR 36 1HG2 THR 36 9.021 -8.741 -4.747
255 HG23 THR 36 2HG2 THR 36 9.223 -9.717 -3.292
256 H GLY 37 H GLY 37 7.937 -13.825 -3.446
257 HA2 GLY 37 1HA GLY 37 10.021 -13.665 -1.775
258 HA3 GLY 37 2HA GLY 37 8.687 -13.323 -0.683
259 H GLU 38 H GLU 38 6.742 -15.020 -1.432
260 HA GLU 38 HA GLU 38 7.891 -17.699 -1.597
261 HB2 GLU 38 1HB GLU 38 7.540 -16.809 0.859
262 HB3 GLU 38 2HB GLU 38 5.858 -17.210 0.540
263 HG2 GLU 38 1HG GLU 38 6.815 -19.078 1.616
264 HG3 GLU 38 2HG GLU 38 6.622 -19.513 -0.081
265 H LYS 39 H LYS 39 6.789 -18.795 -3.066
266 HA LYS 39 HA LYS 39 3.892 -18.349 -3.298
267 HB2 LYS 39 1HB LYS 39 5.345 -17.220 -5.113
268 HB3 LYS 39 2HB LYS 39 5.615 -18.852 -5.711
269 HG2 LYS 39 1HG LYS 39 3.315 -19.157 -6.183
270 HG3 LYS 39 2HG LYS 39 2.873 -17.690 -5.307
271 HD2 LYS 39 1HD LYS 39 4.431 -16.516 -7.032
272 HD3 LYS 39 2HD LYS 39 4.182 -17.983 -7.982
273 HE2 LYS 39 1HE LYS 39 2.456 -16.692 -8.757
274 HE3 LYS 39 2HE LYS 39 1.654 -17.522 -7.425
275 HZ1 LYS 39 3HZ LYS 39 1.079 -15.317 -7.117
276 HZ2 LYS 39 1HZ LYS 39 2.605 -14.734 -7.556
277 HZ3 LYS 39 2HZ LYS 39 2.388 -15.497 -6.062
278 HA PRO 40 HA PRO 40 4.783 -22.843 -2.753
279 HB2 PRO 40 1HB PRO 40 2.650 -23.289 -1.136
280 HB3 PRO 40 2HB PRO 40 4.208 -22.713 -0.533
281 HG2 PRO 40 1HG PRO 40 1.720 -21.162 -1.132
282 HG3 PRO 40 2HG PRO 40 2.821 -21.020 0.251
283 HD2 PRO 40 1HD PRO 40 2.897 -19.317 -1.853
284 HD3 PRO 40 2HD PRO 40 4.348 -19.765 -0.934
285 H SER 41 H SER 41 1.635 -21.251 -3.217
286 HA SER 41 HA SER 41 0.491 -23.524 -4.543
287 HB2 SER 41 1HB SER 41 -1.440 -22.063 -4.930
288 HB3 SER 41 2HB SER 41 -0.900 -21.945 -3.256
289 HG SER 41 HG SER 41 0.350 -20.054 -4.062
290 H GLY 42 H GLY 42 -0.329 -23.475 -6.756
291 HA2 GLY 42 1HA GLY 42 1.038 -21.629 -8.568
292 HA3 GLY 42 2HA GLY 42 1.377 -23.343 -8.755
293 HA PRO 43 HA PRO 43 -3.284 -22.557 -9.902
294 HB2 PRO 43 1HB PRO 43 -3.871 -19.988 -10.556
295 HB3 PRO 43 2HB PRO 43 -4.048 -20.627 -8.918
296 HG2 PRO 43 1HG PRO 43 -1.826 -18.996 -10.085
297 HG3 PRO 43 2HG PRO 43 -2.615 -18.842 -8.505
298 HD2 PRO 43 1HD PRO 43 -0.218 -20.061 -8.823
299 HD3 PRO 43 2HD PRO 43 -1.386 -20.560 -7.583
300 H SER 44 H SER 44 -4.343 -21.708 -12.032
301 HA SER 44 HA SER 44 -2.402 -22.187 -14.145
302 HB2 SER 44 1HB SER 44 -5.370 -22.329 -13.908
303 HB3 SER 44 2HB SER 44 -4.690 -22.026 -15.507
304 HG SER 44 HG SER 44 -3.552 -24.074 -14.003
305 H SER 45 H SER 45 -5.103 -19.896 -13.701
306 HA SER 45 HA SER 45 -3.558 -17.928 -15.255
307 HB2 SER 45 1HB SER 45 -5.639 -18.550 -16.363
308 HB3 SER 45 2HB SER 45 -6.555 -18.177 -14.903
309 HG SER 45 HG SER 45 -6.161 -16.041 -15.191
310 H GLY 46 H GLY 46 -6.073 -18.028 -12.719
311 HA2 GLY 46 1HA GLY 46 -5.286 -17.037 -10.533
312 HA3 GLY 46 2HA GLY 46 -4.778 -15.666 -11.508
Start of MODEL 15
1 H1 GLY 1 H GLY 1 -14.638 -7.727 -1.199
2 HA2 GLY 1 1HA GLY 1 -17.065 -8.356 -0.741
3 HA3 GLY 1 2HA GLY 1 -16.776 -6.643 -1.007
4 H SER 2 H SER 2 -19.180 -6.969 -1.524
5 HA SER 2 HA SER 2 -19.407 -7.317 -4.432
6 HB2 SER 2 1HB SER 2 -20.301 -9.333 -3.236
7 HB3 SER 2 2HB SER 2 -21.488 -8.285 -2.459
8 HG SER 2 HG SER 2 -22.639 -8.481 -4.191
9 H SER 3 H SER 3 -20.857 -6.014 -1.476
10 HA SER 3 HA SER 3 -22.282 -4.011 -3.078
11 HB2 SER 3 1HB SER 3 -23.595 -3.570 -1.065
12 HB3 SER 3 2HB SER 3 -23.608 -5.296 -1.429
13 HG SER 3 HG SER 3 -21.625 -5.160 0.106
14 H GLY 4 H GLY 4 -19.960 -4.351 -0.439
15 HA2 GLY 4 1HA GLY 4 -18.210 -2.898 0.072
16 HA3 GLY 4 2HA GLY 4 -18.879 -1.732 -1.060
17 H SER 5 H SER 5 -18.446 -0.116 0.553
18 HA SER 5 HA SER 5 -20.701 0.216 2.355
19 HB2 SER 5 1HB SER 5 -19.199 0.791 4.275
20 HB3 SER 5 2HB SER 5 -19.142 -0.911 3.817
21 HG SER 5 HG SER 5 -17.201 1.065 3.585
22 H SER 6 H SER 6 -20.781 2.413 3.284
23 HA SER 6 HA SER 6 -20.221 4.358 1.284
24 HB2 SER 6 1HB SER 6 -21.249 5.951 2.806
25 HB3 SER 6 2HB SER 6 -22.194 4.463 2.797
26 HG SER 6 HG SER 6 -21.940 4.966 4.911
27 H GLY 7 H GLY 7 -18.484 5.603 1.013
28 HA2 GLY 7 1HA GLY 7 -16.913 6.655 3.112
29 HA3 GLY 7 2HA GLY 7 -16.112 5.242 2.440
30 H THR 8 H THR 8 -16.980 8.549 1.947
31 HA THR 8 HA THR 8 -16.278 8.725 -0.803
32 HB THR 8 HB THR 8 -16.185 11.180 -0.406
33 HG1 THR 8 HG1 THR 8 -17.079 11.632 1.881
34 HG21 THR 8 3HG2 THR 8 -18.654 10.815 0.943
35 HG22 THR 8 1HG2 THR 8 -18.423 9.437 -0.132
36 HG23 THR 8 2HG2 THR 8 -18.378 11.077 -0.779
37 H GLY 9 H GLY 9 -14.294 8.259 -1.511
38 HA2 GLY 9 1HA GLY 9 -12.063 9.807 -1.040
39 HA3 GLY 9 2HA GLY 9 -11.959 8.488 0.118
40 H GLU 10 H GLU 10 -11.127 9.482 -2.944
41 HA GLU 10 HA GLU 10 -10.868 6.721 -3.928
42 HB2 GLU 10 1HB GLU 10 -12.101 8.499 -5.304
43 HB3 GLU 10 2HB GLU 10 -10.519 9.211 -5.585
44 HG2 GLU 10 1HG GLU 10 -10.871 6.321 -6.156
45 HG3 GLU 10 2HG GLU 10 -11.592 7.487 -7.263
46 H LYS 11 H LYS 11 -8.927 5.823 -3.874
47 HA LYS 11 HA LYS 11 -6.602 7.404 -3.209
48 HB2 LYS 11 1HB LYS 11 -7.188 4.479 -3.457
49 HB3 LYS 11 2HB LYS 11 -5.516 5.024 -3.463
50 HG2 LYS 11 1HG LYS 11 -6.023 4.453 -1.235
51 HG3 LYS 11 2HG LYS 11 -6.018 6.217 -1.302
52 HD2 LYS 11 1HD LYS 11 -7.943 5.797 -0.098
53 HD3 LYS 11 2HD LYS 11 -8.572 5.930 -1.742
54 HE2 LYS 11 1HE LYS 11 -8.166 3.352 -1.796
55 HE3 LYS 11 2HE LYS 11 -8.196 3.503 -0.040
56 HZ1 LYS 11 3HZ LYS 11 -10.383 4.601 -0.269
57 HZ2 LYS 11 1HZ LYS 11 -10.384 2.997 -0.807
58 HZ3 LYS 11 2HZ LYS 11 -10.356 4.264 -1.927
59 HA PRO 12 HA PRO 12 -5.096 7.961 -7.309
60 HB2 PRO 12 1HB PRO 12 -2.463 8.315 -6.753
61 HB3 PRO 12 2HB PRO 12 -3.689 9.542 -6.416
62 HG2 PRO 12 1HG PRO 12 -2.430 7.563 -4.557
63 HG3 PRO 12 2HG PRO 12 -2.784 9.280 -4.290
64 HD2 PRO 12 1HD PRO 12 -4.364 7.300 -3.331
65 HD3 PRO 12 2HD PRO 12 -5.007 8.879 -3.828
66 H TYR 13 H TYR 13 -3.768 5.505 -5.204
67 HA TYR 13 HA TYR 13 -2.920 3.988 -7.585
68 HB2 TYR 13 1HB TYR 13 -1.652 3.685 -4.868
69 HB3 TYR 13 2HB TYR 13 -1.057 3.103 -6.418
70 HD1 TYR 13 HD1 TYR 13 -0.332 4.848 -8.142
71 HD2 TYR 13 HD2 TYR 13 -0.968 5.763 -4.036
72 HE1 TYR 13 HE1 TYR 13 1.021 6.887 -8.393
73 HE2 TYR 13 HE2 TYR 13 0.383 7.805 -4.275
74 HH TYR 13 HH TYR 13 2.467 8.397 -6.353
75 H GLU 14 H GLU 14 -3.034 1.650 -7.366
76 HA GLU 14 HA GLU 14 -4.484 0.480 -5.191
77 HB2 GLU 14 1HB GLU 14 -6.339 1.547 -6.396
78 HB3 GLU 14 2HB GLU 14 -5.863 0.716 -7.871
79 HG2 GLU 14 1HG GLU 14 -6.213 -1.444 -6.556
80 HG3 GLU 14 2HG GLU 14 -7.051 -0.438 -5.375
81 H CYS 15 H CYS 15 -3.741 -1.519 -4.972
82 HA CYS 15 HA CYS 15 -2.084 -2.708 -6.975
83 HB2 CYS 15 1HB CYS 15 -1.577 -3.030 -4.619
84 HB3 CYS 15 2HB CYS 15 -3.138 -3.802 -4.359
85 H SER 16 H SER 16 -2.405 -4.748 -7.999
86 HA SER 16 HA SER 16 -5.244 -5.308 -8.527
87 HB2 SER 16 1HB SER 16 -2.804 -5.933 -10.209
88 HB3 SER 16 2HB SER 16 -4.470 -6.308 -10.648
89 HG SER 16 HG SER 16 -4.416 -4.390 -11.511
90 H ILE 17 H ILE 17 -2.215 -6.720 -7.521
91 HA ILE 17 HA ILE 17 -2.833 -9.434 -7.761
92 HB ILE 17 HB ILE 17 -1.095 -8.052 -5.715
93 HG12 ILE 17 1HG1 ILE 17 -0.262 -9.587 -8.177
94 HG13 ILE 17 2HG1 ILE 17 -0.530 -7.847 -8.189
95 HG21 ILE 17 1HG2 ILE 17 -1.287 -10.977 -6.420
96 HG22 ILE 17 2HG2 ILE 17 -0.062 -10.258 -5.376
97 HG23 ILE 17 3HG2 ILE 17 -1.757 -10.233 -4.892
98 HD11 ILE 17 3HD1 ILE 17 1.307 -8.950 -6.142
99 HD12 ILE 17 1HD1 ILE 17 1.859 -8.897 -7.816
100 HD13 ILE 17 2HD1 ILE 17 1.358 -7.413 -7.005
101 H CYS 18 H CYS 18 -3.021 -7.431 -4.811
102 HA CYS 18 HA CYS 18 -4.877 -9.383 -3.662
103 HB2 CYS 18 1HB CYS 18 -4.482 -8.162 -1.535
104 HB3 CYS 18 2HB CYS 18 -3.001 -8.796 -2.246
105 H GLY 19 H GLY 19 -4.603 -5.923 -4.378
106 HA2 GLY 19 1HA GLY 19 -6.570 -4.815 -5.307
107 HA3 GLY 19 2HA GLY 19 -7.546 -5.766 -4.197
108 H LYS 20 H LYS 20 -4.551 -4.337 -3.157
109 HA LYS 20 HA LYS 20 -5.951 -2.809 -1.149
110 HB2 LYS 20 1HB LYS 20 -3.088 -3.433 -1.746
111 HB3 LYS 20 2HB LYS 20 -3.460 -2.073 -0.696
112 HG2 LYS 20 1HG LYS 20 -4.901 -3.746 0.618
113 HG3 LYS 20 2HG LYS 20 -4.004 -4.984 -0.265
114 HD2 LYS 20 1HD LYS 20 -1.896 -4.012 0.568
115 HD3 LYS 20 2HD LYS 20 -2.826 -2.830 1.492
116 HE2 LYS 20 1HE LYS 20 -2.176 -4.619 2.957
117 HE3 LYS 20 2HE LYS 20 -3.917 -4.708 2.693
118 HZ1 LYS 20 3HZ LYS 20 -2.514 -6.846 2.550
119 HZ2 LYS 20 1HZ LYS 20 -2.086 -6.287 1.011
120 HZ3 LYS 20 2HZ LYS 20 -3.710 -6.578 1.384
121 H SER 21 H SER 21 -5.097 -0.507 -0.722
122 HA SER 21 HA SER 21 -4.688 0.970 -3.220
123 HB2 SER 21 1HB SER 21 -6.398 2.648 -2.479
124 HB3 SER 21 2HB SER 21 -7.077 1.074 -2.893
125 HG SER 21 HG SER 21 -6.915 0.636 -0.556
126 H PHE 22 H PHE 22 -3.453 2.789 -3.031
127 HA PHE 22 HA PHE 22 -2.673 3.654 -0.338
128 HB2 PHE 22 1HB PHE 22 -0.646 3.306 -2.544
129 HB3 PHE 22 2HB PHE 22 -0.350 3.607 -0.835
130 HD1 PHE 22 HD1 PHE 22 -1.711 1.084 -3.189
131 HD2 PHE 22 HD2 PHE 22 -0.003 1.839 0.635
132 HE1 PHE 22 HE1 PHE 22 -1.515 -1.338 -2.803
133 HE2 PHE 22 HE2 PHE 22 0.196 -0.582 1.028
134 HZ PHE 22 HZ PHE 22 -0.559 -2.174 -0.692
135 H THR 23 H THR 23 -1.512 5.766 -0.373
136 HA THR 23 HA THR 23 -2.528 7.460 -2.563
137 HB THR 23 HB THR 23 -2.493 9.327 -0.853
138 HG1 THR 23 HG1 THR 23 -2.506 8.657 1.337
139 HG21 THR 23 3HG2 THR 23 -4.616 8.569 0.245
140 HG22 THR 23 1HG2 THR 23 -4.357 6.984 -0.482
141 HG23 THR 23 2HG2 THR 23 -4.599 8.396 -1.510
142 H LYS 24 H LYS 24 0.166 6.060 -1.865
143 HA LYS 24 HA LYS 24 1.804 8.273 -2.786
144 HB2 LYS 24 1HB LYS 24 2.051 7.034 -0.090
145 HB3 LYS 24 2HB LYS 24 3.538 7.413 -0.950
146 HG2 LYS 24 1HG LYS 24 1.394 9.475 -0.644
147 HG3 LYS 24 2HG LYS 24 2.536 9.156 0.663
148 HD2 LYS 24 1HD LYS 24 3.662 10.810 -0.445
149 HD3 LYS 24 2HD LYS 24 4.299 9.397 -1.290
150 HE2 LYS 24 1HE LYS 24 3.040 9.798 -3.183
151 HE3 LYS 24 2HE LYS 24 1.828 10.731 -2.306
152 HZ1 LYS 24 3HZ LYS 24 4.485 11.581 -3.255
153 HZ2 LYS 24 1HZ LYS 24 3.752 12.381 -1.957
154 HZ3 LYS 24 2HZ LYS 24 2.986 12.336 -3.464
155 H LYS 25 H LYS 25 3.080 7.565 -4.358
156 HA LYS 25 HA LYS 25 3.166 5.017 -5.348
157 HB2 LYS 25 1HB LYS 25 4.927 7.391 -5.594
158 HB3 LYS 25 2HB LYS 25 5.602 5.856 -6.125
159 HG2 LYS 25 1HG LYS 25 2.889 6.586 -7.080
160 HG3 LYS 25 2HG LYS 25 4.273 7.441 -7.763
161 HD2 LYS 25 1HD LYS 25 5.221 4.979 -7.987
162 HD3 LYS 25 2HD LYS 25 3.502 4.576 -7.986
163 HE2 LYS 25 1HE LYS 25 3.347 6.476 -9.767
164 HE3 LYS 25 2HE LYS 25 5.077 6.188 -9.951
165 HZ1 LYS 25 3HZ LYS 25 4.695 4.323 -11.073
166 HZ2 LYS 25 1HZ LYS 25 3.078 4.807 -11.186
167 HZ3 LYS 25 2HZ LYS 25 3.562 3.762 -9.948
168 H SER 26 H SER 26 5.322 6.451 -2.940
169 HA SER 26 HA SER 26 7.170 4.364 -2.748
170 HB2 SER 26 1HB SER 26 7.695 6.442 -1.698
171 HB3 SER 26 2HB SER 26 6.230 6.394 -0.718
172 HG SER 26 HG SER 26 8.630 5.433 -0.126
173 H GLN 27 H GLN 27 4.152 4.918 -0.963
174 HA GLN 27 HA GLN 27 4.304 2.746 0.774
175 HB2 GLN 27 1HB GLN 27 1.858 4.021 -0.462
176 HB3 GLN 27 2HB GLN 27 1.832 2.921 0.910
177 HG2 GLN 27 1HG GLN 27 3.340 5.519 0.910
178 HG3 GLN 27 2HG GLN 27 1.674 5.360 1.463
179 HE21 GLN 27 1HE2 GLN 27 2.366 6.066 3.527
180 HE22 GLN 27 2HE2 GLN 27 3.164 4.984 4.612
181 H LEU 28 H LEU 28 2.657 2.939 -2.381
182 HA LEU 28 HA LEU 28 1.817 0.279 -2.496
183 HB2 LEU 28 1HB LEU 28 0.972 1.995 -3.992
184 HB3 LEU 28 2HB LEU 28 2.560 2.149 -4.741
185 HG LEU 28 HG LEU 28 2.275 -0.298 -5.431
186 HD11 LEU 28 1HD1 LEU 28 0.440 -0.888 -3.984
187 HD12 LEU 28 2HD1 LEU 28 -0.074 -1.020 -5.665
188 HD13 LEU 28 3HD1 LEU 28 -0.572 0.368 -4.698
189 HD21 LEU 28 3HD2 LEU 28 2.139 1.614 -6.969
190 HD22 LEU 28 1HD2 LEU 28 0.419 1.767 -6.610
191 HD23 LEU 28 2HD2 LEU 28 1.026 0.320 -7.416
192 H HIS 29 H HIS 29 4.757 1.780 -3.824
193 HA HIS 29 HA HIS 29 5.898 -0.398 -5.053
194 HB2 HIS 29 1HB HIS 29 7.251 1.814 -3.498
195 HB3 HIS 29 2HB HIS 29 8.102 0.679 -4.542
196 HD2 HIS 29 HD2 HIS 29 5.698 0.941 -6.964
197 HE1 HIS 29 HE1 HIS 29 7.217 4.899 -7.125
198 HE2 HIS 29 HE2 HIS 29 5.802 3.165 -8.280
199 H VAL 30 H VAL 30 6.283 0.572 -1.649
200 HA VAL 30 HA VAL 30 7.931 -1.569 -0.883
201 HB VAL 30 HB VAL 30 5.993 0.034 0.792
202 HG11 VAL 30 1HG1 VAL 30 7.297 -2.327 1.474
203 HG12 VAL 30 2HG1 VAL 30 8.283 -1.047 2.184
204 HG13 VAL 30 3HG1 VAL 30 6.568 -1.162 2.579
205 HG21 VAL 30 3HG2 VAL 30 8.683 0.537 -0.264
206 HG22 VAL 30 1HG2 VAL 30 7.452 1.668 0.299
207 HG23 VAL 30 2HG2 VAL 30 8.500 0.855 1.461
208 H HIS 31 H HIS 31 4.405 -1.182 -0.739
209 HA HIS 31 HA HIS 31 3.724 -3.513 0.574
210 HB2 HIS 31 1HB HIS 31 1.901 -2.151 0.206
211 HB3 HIS 31 2HB HIS 31 2.359 -1.807 -1.459
212 HD1 HIS 31 HD1 HIS 31 0.897 -4.635 0.603
213 HD2 HIS 31 HD2 HIS 31 1.025 -3.279 -3.322
214 HE1 HIS 31 HE1 HIS 31 -0.681 -6.120 -0.673
215 H GLN 32 H GLN 32 4.027 -3.059 -2.949
216 HA GLN 32 HA GLN 32 3.434 -5.494 -3.926
217 HB2 GLN 32 1HB GLN 32 5.797 -3.771 -4.678
218 HB3 GLN 32 2HB GLN 32 5.259 -5.153 -5.623
219 HG2 GLN 32 1HG GLN 32 3.159 -4.103 -6.082
220 HG3 GLN 32 2HG GLN 32 3.530 -2.778 -4.980
221 HE21 GLN 32 1HE2 GLN 32 2.828 -1.909 -7.291
222 HE22 GLN 32 2HE2 GLN 32 4.161 -1.433 -8.281
223 H GLN 33 H GLN 33 6.383 -4.663 -2.187
224 HA GLN 33 HA GLN 33 7.947 -6.872 -2.612
225 HB2 GLN 33 1HB GLN 33 7.532 -5.411 0.002
226 HB3 GLN 33 2HB GLN 33 8.876 -6.489 -0.350
227 HG2 GLN 33 1HG GLN 33 9.369 -4.925 -2.313
228 HG3 GLN 33 2HG GLN 33 8.284 -3.794 -1.508
229 HE21 GLN 33 1HE2 GLN 33 9.869 -2.299 -1.073
230 HE22 GLN 33 2HE2 GLN 33 11.121 -2.568 0.087
231 H ILE 34 H ILE 34 5.329 -6.541 -0.236
232 HA ILE 34 HA ILE 34 5.505 -8.910 1.110
233 HB ILE 34 HB ILE 34 3.786 -7.111 1.476
234 HG12 ILE 34 1HG1 ILE 34 2.558 -9.863 1.316
235 HG13 ILE 34 2HG1 ILE 34 3.772 -9.436 2.517
236 HG21 ILE 34 1HG2 ILE 34 1.903 -8.512 -0.321
237 HG22 ILE 34 2HG2 ILE 34 1.992 -6.810 0.127
238 HG23 ILE 34 3HG2 ILE 34 3.096 -7.461 -1.084
239 HD11 ILE 34 3HD1 ILE 34 2.146 -7.488 3.069
240 HD12 ILE 34 1HD1 ILE 34 0.955 -8.505 2.258
241 HD13 ILE 34 2HD1 ILE 34 1.817 -9.112 3.672
242 H HIS 35 H HIS 35 4.363 -8.395 -2.163
243 HA HIS 35 HA HIS 35 3.373 -11.084 -2.468
244 HB2 HIS 35 1HB HIS 35 3.900 -8.942 -4.539
245 HB3 HIS 35 2HB HIS 35 3.041 -10.453 -4.828
246 HD1 HIS 35 HD1 HIS 35 1.003 -10.631 -2.724
247 HD2 HIS 35 HD2 HIS 35 2.065 -6.978 -4.392
248 HE1 HIS 35 HE1 HIS 35 -0.947 -9.103 -2.292
249 H THR 36 H THR 36 6.164 -9.249 -3.686
250 HA THR 36 HA THR 36 7.330 -11.583 -4.909
251 HB THR 36 HB THR 36 7.614 -9.207 -5.761
252 HG1 THR 36 HG1 THR 36 10.035 -9.676 -6.041
253 HG21 THR 36 3HG2 THR 36 9.984 -8.774 -4.119
254 HG22 THR 36 1HG2 THR 36 8.486 -8.712 -3.191
255 HG23 THR 36 2HG2 THR 36 8.707 -7.648 -4.580
256 H GLY 37 H GLY 37 6.891 -12.172 -2.274
257 HA2 GLY 37 1HA GLY 37 9.632 -12.575 -1.343
258 HA3 GLY 37 2HA GLY 37 8.532 -11.750 -0.248
259 H GLU 38 H GLU 38 9.525 -14.767 -1.555
260 HA GLU 38 HA GLU 38 7.357 -16.159 -0.141
261 HB2 GLU 38 1HB GLU 38 7.933 -16.596 -2.633
262 HB3 GLU 38 2HB GLU 38 9.307 -17.490 -1.998
263 HG2 GLU 38 1HG GLU 38 7.237 -18.826 -2.549
264 HG3 GLU 38 2HG GLU 38 7.937 -19.075 -0.951
265 H LYS 39 H LYS 39 8.052 -18.300 0.847
266 HA LYS 39 HA LYS 39 9.116 -19.259 2.628
267 HB2 LYS 39 1HB LYS 39 11.388 -18.595 0.761
268 HB3 LYS 39 2HB LYS 39 11.627 -19.521 2.238
269 HG2 LYS 39 1HG LYS 39 9.729 -20.307 0.039
270 HG3 LYS 39 2HG LYS 39 11.382 -20.906 0.194
271 HD2 LYS 39 1HD LYS 39 10.832 -21.828 2.400
272 HD3 LYS 39 2HD LYS 39 9.177 -21.238 2.230
273 HE2 LYS 39 1HE LYS 39 9.132 -23.530 1.644
274 HE3 LYS 39 2HE LYS 39 9.026 -22.631 0.131
275 HZ1 LYS 39 3HZ LYS 39 10.574 -24.394 -0.159
276 HZ2 LYS 39 1HZ LYS 39 11.421 -23.981 1.247
277 HZ3 LYS 39 2HZ LYS 39 11.463 -22.956 -0.098
278 HA PRO 40 HA PRO 40 10.376 -15.036 4.337
279 HB2 PRO 40 1HB PRO 40 8.221 -14.688 5.951
280 HB3 PRO 40 2HB PRO 40 8.265 -14.131 4.274
281 HG2 PRO 40 1HG PRO 40 7.028 -16.606 5.417
282 HG3 PRO 40 2HG PRO 40 6.379 -15.490 4.201
283 HD2 PRO 40 1HD PRO 40 7.512 -17.860 3.545
284 HD3 PRO 40 2HD PRO 40 7.612 -16.431 2.496
285 H SER 41 H SER 41 10.147 -14.521 6.878
286 HA SER 41 HA SER 41 11.259 -16.885 8.203
287 HB2 SER 41 1HB SER 41 11.408 -13.938 8.858
288 HB3 SER 41 2HB SER 41 12.039 -15.199 9.916
289 HG SER 41 HG SER 41 13.500 -14.150 8.277
290 H GLY 42 H GLY 42 10.374 -17.794 9.991
291 HA2 GLY 42 1HA GLY 42 7.997 -16.490 11.150
292 HA3 GLY 42 2HA GLY 42 7.937 -18.177 10.661
293 HA PRO 43 HA PRO 43 9.046 -18.075 15.143
294 HB2 PRO 43 1HB PRO 43 7.407 -20.130 15.824
295 HB3 PRO 43 2HB PRO 43 6.859 -18.452 15.739
296 HG2 PRO 43 1HG PRO 43 6.553 -20.649 13.729
297 HG3 PRO 43 2HG PRO 43 5.366 -19.442 14.257
298 HD2 PRO 43 1HD PRO 43 6.751 -19.208 11.942
299 HD3 PRO 43 2HD PRO 43 6.243 -17.800 12.898
300 H SER 44 H SER 44 9.221 -20.320 12.575
301 HA SER 44 HA SER 44 10.661 -22.314 14.141
302 HB2 SER 44 1HB SER 44 10.679 -23.624 12.049
303 HB3 SER 44 2HB SER 44 9.047 -23.116 12.481
304 HG SER 44 HG SER 44 9.811 -22.817 10.205
305 H SER 45 H SER 45 12.452 -20.921 14.661
306 HA SER 45 HA SER 45 14.240 -20.323 12.408
307 HB2 SER 45 1HB SER 45 15.386 -18.784 13.900
308 HB3 SER 45 2HB SER 45 13.656 -18.447 13.935
309 HG SER 45 HG SER 45 14.824 -20.185 15.820
310 H GLY 46 H GLY 46 16.423 -20.952 12.455
311 HA2 GLY 46 1HA GLY 46 16.915 -23.533 13.473
312 HA3 GLY 46 2HA GLY 46 18.125 -22.455 12.792
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -21.607 -11.374 10.343
2 HA2 GLY 1 1HA GLY 1 -19.914 -11.134 8.761
3 HA3 GLY 1 2HA GLY 1 -19.792 -12.860 9.071
4 H SER 2 H SER 2 -22.042 -10.779 7.244
5 HA SER 2 HA SER 2 -21.664 -12.590 4.948
6 HB2 SER 2 1HB SER 2 -24.120 -11.088 5.864
7 HB3 SER 2 2HB SER 2 -23.984 -11.811 4.261
8 HG SER 2 HG SER 2 -24.997 -13.201 5.796
9 H SER 3 H SER 3 -22.774 -9.268 5.639
10 HA SER 3 HA SER 3 -21.881 -8.344 3.062
11 HB2 SER 3 1HB SER 3 -23.017 -6.885 5.457
12 HB3 SER 3 2HB SER 3 -22.613 -6.101 3.929
13 HG SER 3 HG SER 3 -24.064 -7.843 3.023
14 H GLY 4 H GLY 4 -19.738 -8.240 2.753
15 HA2 GLY 4 1HA GLY 4 -18.200 -6.313 4.195
16 HA3 GLY 4 2HA GLY 4 -17.738 -7.953 4.626
17 H SER 5 H SER 5 -17.977 -5.650 1.975
18 HA SER 5 HA SER 5 -15.886 -7.179 0.573
19 HB2 SER 5 1HB SER 5 -17.940 -7.480 -0.668
20 HB3 SER 5 2HB SER 5 -18.259 -5.746 -0.641
21 HG SER 5 HG SER 5 -16.368 -5.468 -1.909
22 H SER 6 H SER 6 -14.076 -6.035 0.751
23 HA SER 6 HA SER 6 -14.081 -3.184 1.080
24 HB2 SER 6 1HB SER 6 -11.961 -5.301 0.935
25 HB3 SER 6 2HB SER 6 -11.510 -3.602 0.798
26 HG SER 6 HG SER 6 -12.697 -4.955 2.965
27 H GLY 7 H GLY 7 -13.097 -1.648 -0.319
28 HA2 GLY 7 1HA GLY 7 -11.873 -1.623 -2.607
29 HA3 GLY 7 2HA GLY 7 -13.355 -2.397 -3.149
30 H THR 8 H THR 8 -15.221 -0.956 -1.654
31 HA THR 8 HA THR 8 -15.855 1.157 -3.257
32 HB THR 8 HB THR 8 -16.437 1.129 -0.292
33 HG1 THR 8 HG1 THR 8 -17.646 -0.281 -2.447
34 HG21 THR 8 3HG2 THR 8 -17.435 2.642 -2.616
35 HG22 THR 8 1HG2 THR 8 -17.406 3.077 -0.907
36 HG23 THR 8 2HG2 THR 8 -18.675 2.021 -1.527
37 H GLY 9 H GLY 9 -15.040 3.111 -3.641
38 HA2 GLY 9 1HA GLY 9 -14.341 5.163 -2.174
39 HA3 GLY 9 2HA GLY 9 -12.959 4.129 -1.844
40 H GLU 10 H GLU 10 -11.687 5.870 -2.764
41 HA GLU 10 HA GLU 10 -11.095 5.388 -5.515
42 HB2 GLU 10 1HB GLU 10 -13.069 6.938 -5.655
43 HB3 GLU 10 2HB GLU 10 -12.100 8.153 -4.833
44 HG2 GLU 10 1HG GLU 10 -10.617 8.350 -6.640
45 HG3 GLU 10 2HG GLU 10 -11.204 6.866 -7.388
46 H LYS 11 H LYS 11 -8.958 5.308 -5.416
47 HA LYS 11 HA LYS 11 -7.531 7.487 -4.050
48 HB2 LYS 11 1HB LYS 11 -7.271 4.551 -3.648
49 HB3 LYS 11 2HB LYS 11 -5.790 5.500 -3.641
50 HG2 LYS 11 1HG LYS 11 -6.401 6.682 -1.746
51 HG3 LYS 11 2HG LYS 11 -8.116 6.314 -1.949
52 HD2 LYS 11 1HD LYS 11 -6.121 4.138 -1.425
53 HD3 LYS 11 2HD LYS 11 -6.796 5.089 -0.100
54 HE2 LYS 11 1HE LYS 11 -8.620 3.850 -2.115
55 HE3 LYS 11 2HE LYS 11 -7.933 2.853 -0.834
56 HZ1 LYS 11 3HZ LYS 11 -8.801 4.676 0.712
57 HZ2 LYS 11 1HZ LYS 11 -9.926 3.601 0.047
58 HZ3 LYS 11 2HZ LYS 11 -9.761 5.157 -0.595
59 HA PRO 12 HA PRO 12 -5.022 7.829 -7.633
60 HB2 PRO 12 1HB PRO 12 -2.562 8.318 -6.595
61 HB3 PRO 12 2HB PRO 12 -3.872 9.504 -6.560
62 HG2 PRO 12 1HG PRO 12 -2.933 7.655 -4.401
63 HG3 PRO 12 2HG PRO 12 -3.391 9.364 -4.289
64 HD2 PRO 12 1HD PRO 12 -5.058 7.359 -3.561
65 HD3 PRO 12 2HD PRO 12 -5.646 8.887 -4.247
66 H TYR 13 H TYR 13 -3.388 5.880 -5.130
67 HA TYR 13 HA TYR 13 -2.392 4.117 -7.268
68 HB2 TYR 13 1HB TYR 13 -1.293 4.237 -4.466
69 HB3 TYR 13 2HB TYR 13 -0.534 3.572 -5.908
70 HD1 TYR 13 HD1 TYR 13 0.465 5.055 -7.584
71 HD2 TYR 13 HD2 TYR 13 -1.226 6.601 -3.999
72 HE1 TYR 13 HE1 TYR 13 1.617 7.194 -7.970
73 HE2 TYR 13 HE2 TYR 13 -0.081 8.745 -4.376
74 HH TYR 13 HH TYR 13 0.848 10.016 -6.338
75 H GLU 14 H GLU 14 -3.024 2.049 -7.324
76 HA GLU 14 HA GLU 14 -4.210 0.843 -4.934
77 HB2 GLU 14 1HB GLU 14 -6.071 1.762 -6.266
78 HB3 GLU 14 2HB GLU 14 -5.529 0.831 -7.655
79 HG2 GLU 14 1HG GLU 14 -5.788 -1.183 -5.984
80 HG3 GLU 14 2HG GLU 14 -6.896 -0.073 -5.179
81 H CYS 15 H CYS 15 -3.935 -1.354 -4.762
82 HA CYS 15 HA CYS 15 -1.916 -2.501 -6.492
83 HB2 CYS 15 1HB CYS 15 -1.897 -2.748 -3.987
84 HB3 CYS 15 2HB CYS 15 -3.309 -3.788 -4.139
85 H SER 16 H SER 16 -2.459 -3.488 -8.312
86 HA SER 16 HA SER 16 -5.130 -4.558 -8.678
87 HB2 SER 16 1HB SER 16 -3.680 -3.233 -10.409
88 HB3 SER 16 2HB SER 16 -2.944 -4.805 -10.719
89 HG SER 16 HG SER 16 -5.128 -5.580 -11.072
90 H ILE 17 H ILE 17 -3.200 -5.835 -6.819
91 HA ILE 17 HA ILE 17 -3.026 -8.486 -8.097
92 HB ILE 17 HB ILE 17 -1.385 -7.416 -5.797
93 HG12 ILE 17 1HG1 ILE 17 -0.467 -8.142 -8.581
94 HG13 ILE 17 2HG1 ILE 17 -0.889 -6.500 -8.106
95 HG21 ILE 17 1HG2 ILE 17 -1.668 -9.746 -5.473
96 HG22 ILE 17 2HG2 ILE 17 -1.416 -10.084 -7.185
97 HG23 ILE 17 3HG2 ILE 17 -0.070 -9.531 -6.188
98 HD11 ILE 17 3HD1 ILE 17 1.406 -6.540 -7.881
99 HD12 ILE 17 1HD1 ILE 17 0.851 -6.846 -6.235
100 HD13 ILE 17 2HD1 ILE 17 1.418 -8.182 -7.238
101 H CYS 18 H CYS 18 -3.289 -7.081 -4.824
102 HA CYS 18 HA CYS 18 -5.024 -9.325 -4.074
103 HB2 CYS 18 1HB CYS 18 -4.566 -8.641 -1.745
104 HB3 CYS 18 2HB CYS 18 -3.088 -8.994 -2.633
105 H GLY 19 H GLY 19 -4.853 -5.791 -4.057
106 HA2 GLY 19 1HA GLY 19 -7.046 -4.755 -4.730
107 HA3 GLY 19 2HA GLY 19 -7.745 -5.739 -3.453
108 H LYS 20 H LYS 20 -4.625 -4.393 -2.900
109 HA LYS 20 HA LYS 20 -5.628 -2.846 -0.694
110 HB2 LYS 20 1HB LYS 20 -2.918 -3.481 -1.794
111 HB3 LYS 20 2HB LYS 20 -3.093 -2.151 -0.656
112 HG2 LYS 20 1HG LYS 20 -4.329 -4.734 0.091
113 HG3 LYS 20 2HG LYS 20 -2.566 -4.641 0.109
114 HD2 LYS 20 1HD LYS 20 -3.274 -4.055 2.288
115 HD3 LYS 20 2HD LYS 20 -2.824 -2.541 1.500
116 HE2 LYS 20 1HE LYS 20 -5.649 -3.400 1.263
117 HE3 LYS 20 2HE LYS 20 -5.109 -2.857 2.851
118 HZ1 LYS 20 3HZ LYS 20 -4.111 -0.955 1.239
119 HZ2 LYS 20 1HZ LYS 20 -5.590 -0.839 2.053
120 HZ3 LYS 20 2HZ LYS 20 -5.550 -1.337 0.437
121 H SER 21 H SER 21 -4.220 -0.601 -0.524
122 HA SER 21 HA SER 21 -4.161 0.931 -2.934
123 HB2 SER 21 1HB SER 21 -6.346 1.623 -0.959
124 HB3 SER 21 2HB SER 21 -5.992 2.443 -2.480
125 HG SER 21 HG SER 21 -6.983 -0.189 -2.120
126 H PHE 22 H PHE 22 -3.164 2.926 -2.666
127 HA PHE 22 HA PHE 22 -2.540 3.843 0.023
128 HB2 PHE 22 1HB PHE 22 -0.291 3.353 -1.926
129 HB3 PHE 22 2HB PHE 22 -0.175 3.773 -0.220
130 HD1 PHE 22 HD1 PHE 22 -1.415 1.093 -2.483
131 HD2 PHE 22 HD2 PHE 22 0.126 2.107 1.353
132 HE1 PHE 22 HE1 PHE 22 -1.274 -1.296 -1.912
133 HE2 PHE 22 HE2 PHE 22 0.270 -0.280 1.930
134 HZ PHE 22 HZ PHE 22 -0.430 -1.985 0.296
135 H THR 23 H THR 23 -1.555 5.979 0.049
136 HA THR 23 HA THR 23 -2.339 7.536 -2.321
137 HB THR 23 HB THR 23 -2.310 9.500 -0.729
138 HG1 THR 23 HG1 THR 23 -2.660 8.569 1.555
139 HG21 THR 23 3HG2 THR 23 -4.252 7.447 0.258
140 HG22 THR 23 1HG2 THR 23 -4.336 8.011 -1.411
141 HG23 THR 23 2HG2 THR 23 -4.511 9.158 -0.082
142 H LYS 24 H LYS 24 0.275 6.111 -1.702
143 HA LYS 24 HA LYS 24 1.987 8.317 -2.516
144 HB2 LYS 24 1HB LYS 24 2.225 6.871 0.074
145 HB3 LYS 24 2HB LYS 24 3.714 7.234 -0.789
146 HG2 LYS 24 1HG LYS 24 1.639 9.295 -0.084
147 HG3 LYS 24 2HG LYS 24 3.053 8.931 0.908
148 HD2 LYS 24 1HD LYS 24 3.460 9.558 -1.975
149 HD3 LYS 24 2HD LYS 24 3.084 10.883 -0.870
150 HE2 LYS 24 1HE LYS 24 5.357 10.887 -0.694
151 HE3 LYS 24 2HE LYS 24 4.975 9.725 0.576
152 HZ1 LYS 24 3HZ LYS 24 6.205 8.245 -0.489
153 HZ2 LYS 24 1HZ LYS 24 6.514 9.340 -1.741
154 HZ3 LYS 24 2HZ LYS 24 5.167 8.320 -1.823
155 H LYS 25 H LYS 25 2.882 7.606 -4.328
156 HA LYS 25 HA LYS 25 2.940 5.089 -5.352
157 HB2 LYS 25 1HB LYS 25 3.629 7.196 -6.525
158 HB3 LYS 25 2HB LYS 25 5.183 7.083 -5.709
159 HG2 LYS 25 1HG LYS 25 5.450 6.207 -7.900
160 HG3 LYS 25 2HG LYS 25 5.494 4.847 -6.775
161 HD2 LYS 25 1HD LYS 25 3.421 4.066 -7.434
162 HD3 LYS 25 2HD LYS 25 2.902 5.644 -8.030
163 HE2 LYS 25 1HE LYS 25 3.277 4.253 -9.926
164 HE3 LYS 25 2HE LYS 25 4.602 5.414 -9.854
165 HZ1 LYS 25 3HZ LYS 25 4.639 2.530 -9.242
166 HZ2 LYS 25 1HZ LYS 25 5.808 3.559 -8.582
167 HZ3 LYS 25 2HZ LYS 25 5.660 3.415 -10.260
168 H SER 26 H SER 26 5.324 6.525 -3.174
169 HA SER 26 HA SER 26 7.209 4.449 -3.243
170 HB2 SER 26 1HB SER 26 7.731 6.631 -2.279
171 HB3 SER 26 2HB SER 26 6.551 6.369 -0.995
172 HG SER 26 HG SER 26 7.995 5.266 0.045
173 H GLN 27 H GLN 27 4.433 4.993 -1.103
174 HA GLN 27 HA GLN 27 4.811 2.850 0.629
175 HB2 GLN 27 1HB GLN 27 2.256 4.133 -0.341
176 HB3 GLN 27 2HB GLN 27 2.326 2.968 0.974
177 HG2 GLN 27 1HG GLN 27 3.964 5.471 1.037
178 HG3 GLN 27 2HG GLN 27 2.276 5.465 1.545
179 HE21 GLN 27 1HE2 GLN 27 1.685 4.351 3.401
180 HE22 GLN 27 2HE2 GLN 27 2.844 3.826 4.570
181 H LEU 28 H LEU 28 2.866 2.967 -2.352
182 HA LEU 28 HA LEU 28 1.979 0.338 -2.356
183 HB2 LEU 28 1HB LEU 28 1.111 1.999 -3.882
184 HB3 LEU 28 2HB LEU 28 2.676 2.123 -4.682
185 HG LEU 28 HG LEU 28 2.390 -0.272 -5.390
186 HD11 LEU 28 1HD1 LEU 28 0.816 -1.185 -3.949
187 HD12 LEU 28 2HD1 LEU 28 -0.096 -0.947 -5.439
188 HD13 LEU 28 3HD1 LEU 28 -0.274 0.193 -4.105
189 HD21 LEU 28 3HD2 LEU 28 1.910 1.732 -6.819
190 HD22 LEU 28 1HD2 LEU 28 0.213 1.561 -6.373
191 HD23 LEU 28 2HD2 LEU 28 1.024 0.272 -7.262
192 H HIS 29 H HIS 29 4.890 1.680 -3.907
193 HA HIS 29 HA HIS 29 5.915 -0.558 -5.098
194 HB2 HIS 29 1HB HIS 29 7.147 1.848 -3.849
195 HB3 HIS 29 2HB HIS 29 8.214 0.509 -4.264
196 HD2 HIS 29 HD2 HIS 29 6.500 -0.147 -7.139
197 HE1 HIS 29 HE1 HIS 29 7.985 3.696 -8.153
198 HE2 HIS 29 HE2 HIS 29 6.917 1.585 -9.015
199 H VAL 30 H VAL 30 6.409 0.431 -1.716
200 HA VAL 30 HA VAL 30 7.994 -1.780 -0.980
201 HB VAL 30 HB VAL 30 6.213 -0.068 0.760
202 HG11 VAL 30 1HG1 VAL 30 6.914 -1.193 2.556
203 HG12 VAL 30 2HG1 VAL 30 7.421 -2.451 1.428
204 HG13 VAL 30 3HG1 VAL 30 8.580 -1.241 1.979
205 HG21 VAL 30 3HG2 VAL 30 7.712 1.454 -0.077
206 HG22 VAL 30 1HG2 VAL 30 8.612 0.855 1.317
207 HG23 VAL 30 2HG2 VAL 30 8.981 0.249 -0.298
208 H HIS 31 H HIS 31 4.509 -1.238 -0.938
209 HA HIS 31 HA HIS 31 3.730 -3.477 0.532
210 HB2 HIS 31 1HB HIS 31 2.072 -1.851 0.082
211 HB3 HIS 31 2HB HIS 31 2.365 -1.915 -1.654
212 HD1 HIS 31 HD1 HIS 31 0.977 -4.132 1.101
213 HD2 HIS 31 HD2 HIS 31 0.673 -3.556 -3.003
214 HE1 HIS 31 HE1 HIS 31 -0.857 -5.675 0.339
215 H GLN 32 H GLN 32 4.125 -3.121 -2.987
216 HA GLN 32 HA GLN 32 3.337 -5.533 -3.920
217 HB2 GLN 32 1HB GLN 32 5.826 -4.011 -4.703
218 HB3 GLN 32 2HB GLN 32 5.156 -5.347 -5.630
219 HG2 GLN 32 1HG GLN 32 3.072 -4.069 -5.916
220 HG3 GLN 32 2HG GLN 32 3.808 -2.719 -5.053
221 HE21 GLN 32 1HE2 GLN 32 2.829 -3.181 -7.885
222 HE22 GLN 32 2HE2 GLN 32 4.132 -2.623 -8.873
223 H GLN 33 H GLN 33 6.278 -4.868 -2.118
224 HA GLN 33 HA GLN 33 7.730 -7.165 -2.507
225 HB2 GLN 33 1HB GLN 33 7.345 -5.657 0.085
226 HB3 GLN 33 2HB GLN 33 8.627 -6.820 -0.224
227 HG2 GLN 33 1HG GLN 33 9.474 -5.391 -2.026
228 HG3 GLN 33 2HG GLN 33 8.205 -4.219 -1.678
229 HE21 GLN 33 1HE2 GLN 33 11.273 -4.349 -1.465
230 HE22 GLN 33 2HE2 GLN 33 11.587 -3.676 0.095
231 H ILE 34 H ILE 34 5.033 -6.670 -0.262
232 HA ILE 34 HA ILE 34 5.058 -9.036 1.127
233 HB ILE 34 HB ILE 34 3.440 -7.122 1.428
234 HG12 ILE 34 1HG1 ILE 34 1.949 -9.726 1.315
235 HG13 ILE 34 2HG1 ILE 34 3.305 -9.528 2.419
236 HG21 ILE 34 1HG2 ILE 34 1.407 -8.375 -0.243
237 HG22 ILE 34 2HG2 ILE 34 1.820 -6.673 -0.043
238 HG23 ILE 34 3HG2 ILE 34 2.737 -7.676 -1.165
239 HD11 ILE 34 3HD1 ILE 34 1.766 -8.792 3.850
240 HD12 ILE 34 1HD1 ILE 34 1.837 -7.291 2.926
241 HD13 ILE 34 2HD1 ILE 34 0.588 -8.486 2.575
242 H HIS 35 H HIS 35 4.311 -8.529 -2.211
243 HA HIS 35 HA HIS 35 3.175 -11.208 -2.490
244 HB2 HIS 35 1HB HIS 35 3.555 -9.077 -4.602
245 HB3 HIS 35 2HB HIS 35 2.613 -10.556 -4.761
246 HD1 HIS 35 HD1 HIS 35 0.738 -10.609 -2.536
247 HD2 HIS 35 HD2 HIS 35 1.863 -7.010 -4.281
248 HE1 HIS 35 HE1 HIS 35 -1.089 -8.981 -1.957
249 H THR 36 H THR 36 5.911 -11.009 -1.747
250 HA THR 36 HA THR 36 7.072 -12.798 -3.587
251 HB THR 36 HB THR 36 7.413 -10.915 -5.042
252 HG1 THR 36 HG1 THR 36 9.204 -12.149 -5.154
253 HG21 THR 36 3HG2 THR 36 8.758 -9.562 -2.700
254 HG22 THR 36 1HG2 THR 36 7.195 -9.123 -3.388
255 HG23 THR 36 2HG2 THR 36 8.665 -8.927 -4.343
256 H GLY 37 H GLY 37 8.929 -13.756 -2.778
257 HA2 GLY 37 1HA GLY 37 10.895 -13.622 -1.331
258 HA3 GLY 37 2HA GLY 37 9.924 -12.670 -0.218
259 H GLU 38 H GLU 38 11.409 -15.392 -0.183
260 HA GLU 38 HA GLU 38 11.172 -17.412 0.837
261 HB2 GLU 38 1HB GLU 38 10.384 -15.790 2.648
262 HB3 GLU 38 2HB GLU 38 8.748 -16.255 2.203
263 HG2 GLU 38 1HG GLU 38 9.538 -17.501 4.135
264 HG3 GLU 38 2HG GLU 38 9.226 -18.566 2.766
265 H LYS 39 H LYS 39 10.088 -17.320 -1.683
266 HA LYS 39 HA LYS 39 7.416 -18.186 -1.879
267 HB2 LYS 39 1HB LYS 39 8.594 -17.334 -3.815
268 HB3 LYS 39 2HB LYS 39 9.771 -18.637 -3.719
269 HG2 LYS 39 1HG LYS 39 7.745 -20.196 -4.032
270 HG3 LYS 39 2HG LYS 39 6.911 -18.743 -4.588
271 HD2 LYS 39 1HD LYS 39 8.430 -18.447 -6.381
272 HD3 LYS 39 2HD LYS 39 9.555 -19.635 -5.718
273 HE2 LYS 39 1HE LYS 39 8.516 -20.828 -7.404
274 HE3 LYS 39 2HE LYS 39 7.571 -21.285 -5.987
275 HZ1 LYS 39 3HZ LYS 39 5.860 -20.718 -7.305
276 HZ2 LYS 39 1HZ LYS 39 6.796 -19.726 -8.306
277 HZ3 LYS 39 2HZ LYS 39 6.231 -19.139 -6.823
278 HA PRO 40 HA PRO 40 7.636 -22.340 -0.429
279 HB2 PRO 40 1HB PRO 40 5.429 -23.327 -1.665
280 HB3 PRO 40 2HB PRO 40 5.346 -22.243 -0.271
281 HG2 PRO 40 1HG PRO 40 5.040 -21.612 -3.181
282 HG3 PRO 40 2HG PRO 40 4.087 -21.029 -1.804
283 HD2 PRO 40 1HD PRO 40 6.034 -19.545 -2.963
284 HD3 PRO 40 2HD PRO 40 5.656 -19.440 -1.231
285 H SER 41 H SER 41 9.474 -23.190 -1.395
286 HA SER 41 HA SER 41 9.514 -23.933 -4.171
287 HB2 SER 41 1HB SER 41 11.425 -24.422 -1.883
288 HB3 SER 41 2HB SER 41 11.712 -25.024 -3.516
289 HG SER 41 HG SER 41 12.670 -23.109 -3.600
290 H GLY 42 H GLY 42 9.509 -26.011 -5.041
291 HA2 GLY 42 1HA GLY 42 8.919 -28.224 -5.218
292 HA3 GLY 42 2HA GLY 42 9.337 -28.385 -3.519
293 HA PRO 43 HA PRO 43 4.735 -28.979 -4.104
294 HB2 PRO 43 1HB PRO 43 4.624 -31.418 -2.917
295 HB3 PRO 43 2HB PRO 43 4.943 -31.202 -4.642
296 HG2 PRO 43 1HG PRO 43 6.871 -31.698 -2.407
297 HG3 PRO 43 2HG PRO 43 6.831 -32.414 -4.029
298 HD2 PRO 43 1HD PRO 43 8.510 -30.395 -3.369
299 HD3 PRO 43 2HD PRO 43 7.834 -30.580 -5.000
300 H SER 44 H SER 44 3.901 -27.628 -2.616
301 HA SER 44 HA SER 44 4.742 -27.504 0.087
302 HB2 SER 44 1HB SER 44 2.824 -25.987 0.397
303 HB3 SER 44 2HB SER 44 3.740 -25.576 -1.053
304 HG SER 44 HG SER 44 2.025 -27.174 -1.990
305 H SER 45 H SER 45 4.102 -28.602 1.830
306 HA SER 45 HA SER 45 2.758 -30.984 1.755
307 HB2 SER 45 1HB SER 45 4.076 -30.242 3.690
308 HB3 SER 45 2HB SER 45 2.844 -29.043 4.079
309 HG SER 45 HG SER 45 1.484 -31.187 3.965
310 H GLY 46 H GLY 46 0.696 -31.651 1.681
311 HA2 GLY 46 1HA GLY 46 -1.608 -31.047 2.609
312 HA3 GLY 46 2HA GLY 46 -1.386 -29.563 1.695
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -19.237 -14.321 -9.000
2 HA2 GLY 1 1HA GLY 1 -17.722 -16.683 -8.872
3 HA3 GLY 1 2HA GLY 1 -17.048 -15.665 -10.136
4 H SER 2 H SER 2 -16.129 -13.650 -9.582
5 HA SER 2 HA SER 2 -15.001 -13.629 -6.912
6 HB2 SER 2 1HB SER 2 -14.482 -12.015 -9.406
7 HB3 SER 2 2HB SER 2 -13.741 -11.605 -7.860
8 HG SER 2 HG SER 2 -13.300 -13.800 -9.527
9 H SER 3 H SER 3 -15.309 -12.078 -5.363
10 HA SER 3 HA SER 3 -17.359 -10.037 -5.916
11 HB2 SER 3 1HB SER 3 -18.483 -11.683 -4.611
12 HB3 SER 3 2HB SER 3 -17.112 -11.854 -3.516
13 HG SER 3 HG SER 3 -18.493 -10.557 -2.446
14 H GLY 4 H GLY 4 -17.146 -8.062 -4.832
15 HA2 GLY 4 1HA GLY 4 -15.248 -7.498 -2.839
16 HA3 GLY 4 2HA GLY 4 -14.521 -7.162 -4.404
17 H SER 5 H SER 5 -17.496 -6.499 -2.562
18 HA SER 5 HA SER 5 -17.576 -3.844 -3.832
19 HB2 SER 5 1HB SER 5 -19.986 -3.825 -3.219
20 HB3 SER 5 2HB SER 5 -19.572 -5.157 -4.297
21 HG SER 5 HG SER 5 -19.804 -5.349 -1.473
22 H SER 6 H SER 6 -16.116 -2.891 -2.372
23 HA SER 6 HA SER 6 -16.655 -2.944 0.462
24 HB2 SER 6 1HB SER 6 -14.345 -2.767 -0.671
25 HB3 SER 6 2HB SER 6 -14.740 -1.064 -0.907
26 HG SER 6 HG SER 6 -15.232 -1.200 1.491
27 H GLY 7 H GLY 7 -16.752 -0.488 -2.114
28 HA2 GLY 7 1HA GLY 7 -18.853 0.899 -2.020
29 HA3 GLY 7 2HA GLY 7 -18.436 1.161 -0.333
30 H THR 8 H THR 8 -15.833 1.749 -0.329
31 HA THR 8 HA THR 8 -15.645 4.114 -2.080
32 HB THR 8 HB THR 8 -14.204 5.110 -0.283
33 HG1 THR 8 HG1 THR 8 -13.944 2.884 0.713
34 HG21 THR 8 3HG2 THR 8 -16.662 5.584 -0.570
35 HG22 THR 8 1HG2 THR 8 -16.029 5.863 1.051
36 HG23 THR 8 2HG2 THR 8 -16.963 4.407 0.708
37 H GLY 9 H GLY 9 -13.533 4.749 -2.787
38 HA2 GLY 9 1HA GLY 9 -11.122 3.542 -2.320
39 HA3 GLY 9 2HA GLY 9 -11.897 2.504 -3.507
40 H GLU 10 H GLU 10 -11.854 6.042 -3.119
41 HA GLU 10 HA GLU 10 -11.173 6.282 -5.948
42 HB2 GLU 10 1HB GLU 10 -13.020 7.612 -4.594
43 HB3 GLU 10 2HB GLU 10 -11.660 8.656 -4.206
44 HG2 GLU 10 1HG GLU 10 -11.259 8.622 -6.779
45 HG3 GLU 10 2HG GLU 10 -12.950 8.128 -6.839
46 H LYS 11 H LYS 11 -9.143 5.343 -4.190
47 HA LYS 11 HA LYS 11 -7.370 7.483 -3.512
48 HB2 LYS 11 1HB LYS 11 -7.268 4.511 -3.466
49 HB3 LYS 11 2HB LYS 11 -5.732 5.368 -3.493
50 HG2 LYS 11 1HG LYS 11 -6.305 4.916 -1.223
51 HG3 LYS 11 2HG LYS 11 -6.480 6.651 -1.500
52 HD2 LYS 11 1HD LYS 11 -8.869 4.925 -1.891
53 HD3 LYS 11 2HD LYS 11 -8.336 5.239 -0.238
54 HE2 LYS 11 1HE LYS 11 -8.442 7.646 -0.664
55 HE3 LYS 11 2HE LYS 11 -8.967 7.332 -2.318
56 HZ1 LYS 11 3HZ LYS 11 -11.033 6.696 -1.642
57 HZ2 LYS 11 1HZ LYS 11 -10.685 7.820 -0.426
58 HZ3 LYS 11 2HZ LYS 11 -10.515 6.165 -0.122
59 HA PRO 12 HA PRO 12 -5.192 8.119 -7.267
60 HB2 PRO 12 1HB PRO 12 -2.637 8.440 -6.406
61 HB3 PRO 12 2HB PRO 12 -3.898 9.650 -6.144
62 HG2 PRO 12 1HG PRO 12 -2.844 7.575 -4.261
63 HG3 PRO 12 2HG PRO 12 -3.232 9.277 -3.947
64 HD2 PRO 12 1HD PRO 12 -4.900 7.254 -3.271
65 HD3 PRO 12 2HD PRO 12 -5.491 8.857 -3.754
66 H TYR 13 H TYR 13 -3.449 5.876 -5.110
67 HA TYR 13 HA TYR 13 -2.746 4.279 -7.486
68 HB2 TYR 13 1HB TYR 13 -1.266 4.196 -4.863
69 HB3 TYR 13 2HB TYR 13 -0.731 3.615 -6.436
70 HD1 TYR 13 HD1 TYR 13 0.118 5.165 -8.113
71 HD2 TYR 13 HD2 TYR 13 -1.130 6.546 -4.287
72 HE1 TYR 13 HE1 TYR 13 1.258 7.306 -8.521
73 HE2 TYR 13 HE2 TYR 13 0.006 8.691 -4.684
74 HH TYR 13 HH TYR 13 1.318 9.855 -6.049
75 H GLU 14 H GLU 14 -2.803 1.994 -7.298
76 HA GLU 14 HA GLU 14 -4.030 0.828 -4.939
77 HB2 GLU 14 1HB GLU 14 -5.973 1.553 -6.224
78 HB3 GLU 14 2HB GLU 14 -5.364 0.723 -7.649
79 HG2 GLU 14 1HG GLU 14 -5.485 -1.407 -6.280
80 HG3 GLU 14 2HG GLU 14 -6.416 -0.475 -5.109
81 H CYS 15 H CYS 15 -3.913 -1.474 -4.888
82 HA CYS 15 HA CYS 15 -1.719 -2.503 -6.516
83 HB2 CYS 15 1HB CYS 15 -1.663 -2.745 -4.036
84 HB3 CYS 15 2HB CYS 15 -3.090 -3.770 -4.136
85 H SER 16 H SER 16 -2.224 -3.489 -8.350
86 HA SER 16 HA SER 16 -4.835 -4.677 -8.740
87 HB2 SER 16 1HB SER 16 -3.598 -3.327 -10.499
88 HB3 SER 16 2HB SER 16 -2.512 -4.706 -10.673
89 HG SER 16 HG SER 16 -5.050 -4.357 -11.610
90 H ILE 17 H ILE 17 -3.066 -5.902 -6.785
91 HA ILE 17 HA ILE 17 -2.684 -8.540 -8.045
92 HB ILE 17 HB ILE 17 -1.230 -7.415 -5.648
93 HG12 ILE 17 1HG1 ILE 17 -0.120 -8.082 -8.378
94 HG13 ILE 17 2HG1 ILE 17 -0.622 -6.461 -7.911
95 HG21 ILE 17 1HG2 ILE 17 -0.993 -10.059 -7.073
96 HG22 ILE 17 2HG2 ILE 17 0.169 -9.461 -5.891
97 HG23 ILE 17 3HG2 ILE 17 -1.495 -9.784 -5.405
98 HD11 ILE 17 3HD1 ILE 17 1.055 -6.375 -6.203
99 HD12 ILE 17 1HD1 ILE 17 1.489 -8.061 -6.488
100 HD13 ILE 17 2HD1 ILE 17 1.809 -6.846 -7.726
101 H CYS 18 H CYS 18 -3.208 -7.128 -4.807
102 HA CYS 18 HA CYS 18 -4.940 -9.418 -4.176
103 HB2 CYS 18 1HB CYS 18 -4.616 -8.708 -1.800
104 HB3 CYS 18 2HB CYS 18 -3.126 -9.177 -2.611
105 H GLY 19 H GLY 19 -4.755 -5.882 -3.802
106 HA2 GLY 19 1HA GLY 19 -6.897 -4.788 -4.629
107 HA3 GLY 19 2HA GLY 19 -7.689 -5.856 -3.480
108 H LYS 20 H LYS 20 -4.816 -3.749 -3.342
109 HA LYS 20 HA LYS 20 -5.970 -2.527 -0.920
110 HB2 LYS 20 1HB LYS 20 -3.204 -3.420 -1.574
111 HB3 LYS 20 2HB LYS 20 -3.384 -1.981 -0.579
112 HG2 LYS 20 1HG LYS 20 -4.957 -3.436 0.852
113 HG3 LYS 20 2HG LYS 20 -4.206 -4.795 0.012
114 HD2 LYS 20 1HD LYS 20 -1.986 -3.546 0.702
115 HD3 LYS 20 2HD LYS 20 -3.029 -2.871 1.956
116 HE2 LYS 20 1HE LYS 20 -3.663 -5.165 2.613
117 HE3 LYS 20 2HE LYS 20 -2.544 -5.798 1.406
118 HZ1 LYS 20 3HZ LYS 20 -1.906 -4.288 3.870
119 HZ2 LYS 20 1HZ LYS 20 -0.783 -4.482 2.619
120 HZ3 LYS 20 2HZ LYS 20 -1.390 -5.838 3.428
121 H SER 21 H SER 21 -5.013 -0.295 -0.486
122 HA SER 21 HA SER 21 -4.482 1.183 -2.960
123 HB2 SER 21 1HB SER 21 -6.107 2.947 -2.232
124 HB3 SER 21 2HB SER 21 -6.869 1.417 -2.666
125 HG SER 21 HG SER 21 -7.706 1.465 -0.751
126 H PHE 22 H PHE 22 -3.045 2.810 -2.741
127 HA PHE 22 HA PHE 22 -2.302 3.651 -0.024
128 HB2 PHE 22 1HB PHE 22 -0.349 2.971 -2.233
129 HB3 PHE 22 2HB PHE 22 0.071 3.581 -0.635
130 HD1 PHE 22 HD1 PHE 22 -1.490 0.722 -2.400
131 HD2 PHE 22 HD2 PHE 22 0.373 2.121 1.162
132 HE1 PHE 22 HE1 PHE 22 -1.376 -1.587 -1.557
133 HE2 PHE 22 HE2 PHE 22 0.490 -0.185 2.011
134 HZ PHE 22 HZ PHE 22 -0.384 -2.043 0.651
135 H THR 23 H THR 23 -1.758 5.779 0.214
136 HA THR 23 HA THR 23 -2.386 7.509 -2.048
137 HB THR 23 HB THR 23 -2.222 9.343 -0.295
138 HG1 THR 23 HG1 THR 23 -2.305 8.594 1.881
139 HG21 THR 23 3HG2 THR 23 -4.287 7.669 -0.971
140 HG22 THR 23 1HG2 THR 23 -4.437 9.130 0.005
141 HG23 THR 23 2HG2 THR 23 -4.270 7.559 0.789
142 H LYS 24 H LYS 24 0.209 5.989 -1.662
143 HA LYS 24 HA LYS 24 1.941 8.199 -2.394
144 HB2 LYS 24 1HB LYS 24 2.231 6.636 0.120
145 HB3 LYS 24 2HB LYS 24 3.701 7.002 -0.774
146 HG2 LYS 24 1HG LYS 24 3.566 9.237 -0.361
147 HG3 LYS 24 2HG LYS 24 1.804 9.224 -0.254
148 HD2 LYS 24 1HD LYS 24 2.043 7.971 1.909
149 HD3 LYS 24 2HD LYS 24 3.780 8.271 1.814
150 HE2 LYS 24 1HE LYS 24 3.240 10.721 1.663
151 HE3 LYS 24 2HE LYS 24 1.567 10.304 2.028
152 HZ1 LYS 24 3HZ LYS 24 2.507 10.851 4.074
153 HZ2 LYS 24 1HZ LYS 24 3.946 10.020 3.758
154 HZ3 LYS 24 2HZ LYS 24 2.524 9.159 4.068
155 H LYS 25 H LYS 25 2.830 7.574 -4.238
156 HA LYS 25 HA LYS 25 2.787 5.119 -5.409
157 HB2 LYS 25 1HB LYS 25 3.576 7.335 -6.392
158 HB3 LYS 25 2HB LYS 25 5.152 6.968 -5.703
159 HG2 LYS 25 1HG LYS 25 5.549 5.252 -7.171
160 HG3 LYS 25 2HG LYS 25 3.833 4.945 -7.446
161 HD2 LYS 25 1HD LYS 25 3.858 7.319 -8.514
162 HD3 LYS 25 2HD LYS 25 5.599 7.051 -8.629
163 HE2 LYS 25 1HE LYS 25 4.758 6.302 -10.679
164 HE3 LYS 25 2HE LYS 25 5.000 4.829 -9.741
165 HZ1 LYS 25 3HZ LYS 25 2.527 6.069 -10.645
166 HZ2 LYS 25 1HZ LYS 25 2.493 5.378 -9.101
167 HZ3 LYS 25 2HZ LYS 25 2.908 4.433 -10.441
168 H SER 26 H SER 26 5.318 6.368 -3.264
169 HA SER 26 HA SER 26 7.051 4.162 -3.454
170 HB2 SER 26 1HB SER 26 6.666 6.335 -1.414
171 HB3 SER 26 2HB SER 26 7.799 5.018 -1.111
172 HG SER 26 HG SER 26 7.921 6.359 -3.565
173 H GLN 27 H GLN 27 4.404 4.884 -1.216
174 HA GLN 27 HA GLN 27 4.724 2.744 0.534
175 HB2 GLN 27 1HB GLN 27 2.274 4.254 -0.357
176 HB3 GLN 27 2HB GLN 27 2.201 2.988 0.862
177 HG2 GLN 27 1HG GLN 27 4.038 5.345 1.113
178 HG3 GLN 27 2HG GLN 27 2.369 5.382 1.679
179 HE21 GLN 27 1HE2 GLN 27 5.187 5.331 2.932
180 HE22 GLN 27 2HE2 GLN 27 5.027 4.172 4.202
181 H LEU 28 H LEU 28 2.759 2.936 -2.426
182 HA LEU 28 HA LEU 28 1.742 0.329 -2.338
183 HB2 LEU 28 1HB LEU 28 0.812 2.014 -3.796
184 HB3 LEU 28 2HB LEU 28 2.324 2.113 -4.697
185 HG LEU 28 HG LEU 28 1.962 -0.216 -5.468
186 HD11 LEU 28 1HD1 LEU 28 -0.848 0.006 -4.460
187 HD12 LEU 28 2HD1 LEU 28 0.421 -0.705 -3.463
188 HD13 LEU 28 3HD1 LEU 28 0.026 -1.417 -5.027
189 HD21 LEU 28 3HD2 LEU 28 0.273 0.327 -7.099
190 HD22 LEU 28 1HD2 LEU 28 1.272 1.750 -6.803
191 HD23 LEU 28 2HD2 LEU 28 -0.336 1.637 -6.086
192 H HIS 29 H HIS 29 4.565 1.603 -4.098
193 HA HIS 29 HA HIS 29 5.432 -0.717 -5.307
194 HB2 HIS 29 1HB HIS 29 6.876 1.697 -4.268
195 HB3 HIS 29 2HB HIS 29 7.792 0.343 -4.924
196 HD2 HIS 29 HD2 HIS 29 4.512 1.098 -6.796
197 HE1 HIS 29 HE1 HIS 29 7.694 2.751 -9.065
198 HE2 HIS 29 HE2 HIS 29 5.224 2.263 -8.993
199 H VAL 30 H VAL 30 6.246 0.465 -2.055
200 HA VAL 30 HA VAL 30 7.949 -1.655 -1.345
201 HB VAL 30 HB VAL 30 6.241 0.077 0.447
202 HG11 VAL 30 1HG1 VAL 30 7.700 -0.574 2.248
203 HG12 VAL 30 2HG1 VAL 30 7.017 -2.025 1.511
204 HG13 VAL 30 3HG1 VAL 30 8.678 -1.551 1.154
205 HG21 VAL 30 3HG2 VAL 30 8.501 0.688 -1.149
206 HG22 VAL 30 1HG2 VAL 30 7.670 1.719 0.016
207 HG23 VAL 30 2HG2 VAL 30 9.015 0.705 0.538
208 H HIS 31 H HIS 31 4.458 -1.230 -1.006
209 HA HIS 31 HA HIS 31 3.907 -3.451 0.592
210 HB2 HIS 31 1HB HIS 31 2.095 -2.026 0.346
211 HB3 HIS 31 2HB HIS 31 2.325 -1.865 -1.392
212 HD1 HIS 31 HD1 HIS 31 1.115 -4.428 1.129
213 HD2 HIS 31 HD2 HIS 31 0.715 -3.466 -2.893
214 HE1 HIS 31 HE1 HIS 31 -0.652 -5.981 0.239
215 H GLN 32 H GLN 32 4.178 -3.172 -2.927
216 HA GLN 32 HA GLN 32 3.308 -5.632 -3.748
217 HB2 GLN 32 1HB GLN 32 5.633 -3.991 -4.750
218 HB3 GLN 32 2HB GLN 32 5.062 -5.438 -5.570
219 HG2 GLN 32 1HG GLN 32 2.761 -4.239 -5.524
220 HG3 GLN 32 2HG GLN 32 3.728 -2.789 -5.260
221 HE21 GLN 32 1HE2 GLN 32 2.710 -2.200 -7.332
222 HE22 GLN 32 2HE2 GLN 32 3.490 -2.690 -8.793
223 H GLN 33 H GLN 33 6.269 -4.856 -2.071
224 HA GLN 33 HA GLN 33 7.783 -7.125 -2.557
225 HB2 GLN 33 1HB GLN 33 7.558 -5.468 -0.042
226 HB3 GLN 33 2HB GLN 33 8.793 -6.692 -0.302
227 HG2 GLN 33 1HG GLN 33 9.409 -5.379 -2.399
228 HG3 GLN 33 2HG GLN 33 8.419 -4.084 -1.727
229 HE21 GLN 33 1HE2 GLN 33 9.338 -2.724 -0.353
230 HE22 GLN 33 2HE2 GLN 33 10.869 -2.951 0.416
231 H ILE 34 H ILE 34 5.089 -6.655 -0.351
232 HA ILE 34 HA ILE 34 5.313 -8.938 1.211
233 HB ILE 34 HB ILE 34 3.630 -7.041 1.447
234 HG12 ILE 34 1HG1 ILE 34 2.235 -9.678 1.690
235 HG13 ILE 34 2HG1 ILE 34 3.707 -9.403 2.614
236 HG21 ILE 34 1HG2 ILE 34 1.825 -8.738 -0.233
237 HG22 ILE 34 2HG2 ILE 34 1.626 -7.062 0.276
238 HG23 ILE 34 3HG2 ILE 34 2.810 -7.472 -0.965
239 HD11 ILE 34 3HD1 ILE 34 2.567 -8.291 4.141
240 HD12 ILE 34 1HD1 ILE 34 1.986 -7.155 2.924
241 HD13 ILE 34 2HD1 ILE 34 1.083 -8.634 3.252
242 H HIS 35 H HIS 35 4.127 -8.557 -2.063
243 HA HIS 35 HA HIS 35 3.023 -11.204 -2.230
244 HB2 HIS 35 1HB HIS 35 3.702 -9.229 -4.420
245 HB3 HIS 35 2HB HIS 35 2.755 -10.700 -4.627
246 HD1 HIS 35 HD1 HIS 35 0.739 -10.581 -2.444
247 HD2 HIS 35 HD2 HIS 35 1.938 -7.191 -4.525
248 HE1 HIS 35 HE1 HIS 35 -1.131 -8.923 -2.163
249 H THR 36 H THR 36 5.585 -9.751 -4.230
250 HA THR 36 HA THR 36 6.736 -11.921 -5.303
251 HB THR 36 HB THR 36 7.582 -9.641 -5.673
252 HG1 THR 36 HG1 THR 36 9.172 -11.846 -5.220
253 HG21 THR 36 3HG2 THR 36 8.909 -8.473 -4.138
254 HG22 THR 36 1HG2 THR 36 9.193 -9.907 -3.152
255 HG23 THR 36 2HG2 THR 36 7.607 -9.135 -3.150
256 H GLY 37 H GLY 37 7.618 -13.763 -4.625
257 HA2 GLY 37 1HA GLY 37 9.497 -14.518 -3.037
258 HA3 GLY 37 2HA GLY 37 8.389 -13.964 -1.790
259 H GLU 38 H GLU 38 6.242 -15.008 -1.726
260 HA GLU 38 HA GLU 38 6.234 -17.718 -2.849
261 HB2 GLU 38 1HB GLU 38 5.447 -18.622 -0.688
262 HB3 GLU 38 2HB GLU 38 7.074 -17.964 -0.589
263 HG2 GLU 38 1HG GLU 38 5.868 -15.809 0.217
264 HG3 GLU 38 2HG GLU 38 4.533 -16.908 0.561
265 H LYS 39 H LYS 39 4.514 -17.682 -4.146
266 HA LYS 39 HA LYS 39 2.071 -16.329 -3.240
267 HB2 LYS 39 1HB LYS 39 1.359 -16.434 -5.591
268 HB3 LYS 39 2HB LYS 39 2.905 -15.613 -5.416
269 HG2 LYS 39 1HG LYS 39 4.092 -17.514 -6.229
270 HG3 LYS 39 2HG LYS 39 2.632 -18.506 -6.193
271 HD2 LYS 39 1HD LYS 39 1.644 -16.865 -7.852
272 HD3 LYS 39 2HD LYS 39 3.271 -16.203 -8.022
273 HE2 LYS 39 1HE LYS 39 3.288 -17.726 -9.725
274 HE3 LYS 39 2HE LYS 39 3.887 -18.737 -8.411
275 HZ1 LYS 39 3HZ LYS 39 1.816 -19.764 -8.170
276 HZ2 LYS 39 1HZ LYS 39 2.047 -19.684 -9.844
277 HZ3 LYS 39 2HZ LYS 39 1.010 -18.588 -9.080
278 HA PRO 40 HA PRO 40 0.132 -20.210 -2.448
279 HB2 PRO 40 1HB PRO 40 -2.452 -19.382 -2.519
280 HB3 PRO 40 2HB PRO 40 -1.365 -19.023 -1.172
281 HG2 PRO 40 1HG PRO 40 -2.157 -17.289 -3.480
282 HG3 PRO 40 2HG PRO 40 -2.001 -16.866 -1.765
283 HD2 PRO 40 1HD PRO 40 -0.089 -16.280 -3.590
284 HD3 PRO 40 2HD PRO 40 0.290 -16.654 -1.897
285 H SER 41 H SER 41 -1.459 -21.700 -3.398
286 HA SER 41 HA SER 41 -1.754 -21.284 -6.302
287 HB2 SER 41 1HB SER 41 -0.917 -23.705 -4.740
288 HB3 SER 41 2HB SER 41 -1.717 -23.902 -6.299
289 HG SER 41 HG SER 41 0.038 -22.164 -6.847
290 H GLY 42 H GLY 42 -3.838 -20.776 -6.606
291 HA2 GLY 42 1HA GLY 42 -5.845 -22.679 -5.616
292 HA3 GLY 42 2HA GLY 42 -6.071 -20.967 -5.289
293 HA PRO 43 HA PRO 43 -6.568 -21.835 -10.061
294 HB2 PRO 43 1HB PRO 43 -7.474 -24.337 -10.603
295 HB3 PRO 43 2HB PRO 43 -5.756 -23.922 -10.577
296 HG2 PRO 43 1HG PRO 43 -7.418 -25.236 -8.463
297 HG3 PRO 43 2HG PRO 43 -5.781 -25.640 -9.010
298 HD2 PRO 43 1HD PRO 43 -6.254 -24.228 -6.749
299 HD3 PRO 43 2HD PRO 43 -4.812 -23.970 -7.752
300 H SER 44 H SER 44 -8.530 -21.726 -11.253
301 HA SER 44 HA SER 44 -10.951 -21.953 -9.587
302 HB2 SER 44 1HB SER 44 -10.193 -19.899 -11.665
303 HB3 SER 44 2HB SER 44 -11.853 -20.110 -11.107
304 HG SER 44 HG SER 44 -9.682 -19.657 -9.347
305 H SER 45 H SER 45 -12.885 -22.615 -10.600
306 HA SER 45 HA SER 45 -12.601 -24.690 -12.470
307 HB2 SER 45 1HB SER 45 -15.057 -23.173 -11.566
308 HB3 SER 45 2HB SER 45 -15.111 -24.619 -12.574
309 HG SER 45 HG SER 45 -14.287 -25.809 -10.910
310 H GLY 46 H GLY 46 -13.355 -24.865 -14.632
311 HA2 GLY 46 1HA GLY 46 -12.676 -22.638 -16.264
312 HA3 GLY 46 2HA GLY 46 -13.361 -24.158 -16.820
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -20.671 -19.925 -12.999
2 HA2 GLY 1 1HA GLY 1 -21.826 -17.664 -13.369
3 HA3 GLY 1 2HA GLY 1 -22.603 -18.028 -11.835
4 H SER 2 H SER 2 -19.733 -16.929 -13.401
5 HA SER 2 HA SER 2 -18.557 -16.354 -10.762
6 HB2 SER 2 1HB SER 2 -17.208 -17.361 -13.261
7 HB3 SER 2 2HB SER 2 -16.307 -16.515 -12.003
8 HG SER 2 HG SER 2 -16.316 -18.289 -10.896
9 H SER 3 H SER 3 -19.253 -14.252 -10.648
10 HA SER 3 HA SER 3 -17.827 -12.359 -12.313
11 HB2 SER 3 1HB SER 3 -20.020 -12.894 -13.496
12 HB3 SER 3 2HB SER 3 -20.833 -12.117 -12.137
13 HG SER 3 HG SER 3 -18.821 -10.862 -13.691
14 H GLY 4 H GLY 4 -17.583 -10.341 -11.359
15 HA2 GLY 4 1HA GLY 4 -19.001 -9.197 -9.308
16 HA3 GLY 4 2HA GLY 4 -17.883 -10.294 -8.510
17 H SER 5 H SER 5 -18.251 -7.304 -10.190
18 HA SER 5 HA SER 5 -15.364 -6.786 -9.956
19 HB2 SER 5 1HB SER 5 -17.485 -5.608 -11.745
20 HB3 SER 5 2HB SER 5 -15.927 -4.817 -11.507
21 HG SER 5 HG SER 5 -14.933 -6.734 -12.269
22 H SER 6 H SER 6 -15.192 -6.109 -7.859
23 HA SER 6 HA SER 6 -16.724 -3.695 -7.139
24 HB2 SER 6 1HB SER 6 -17.041 -5.950 -5.815
25 HB3 SER 6 2HB SER 6 -15.529 -5.471 -5.044
26 HG SER 6 HG SER 6 -17.747 -3.727 -5.242
27 H GLY 7 H GLY 7 -15.507 -1.932 -7.116
28 HA2 GLY 7 1HA GLY 7 -12.656 -2.217 -6.390
29 HA3 GLY 7 2HA GLY 7 -13.244 -1.059 -7.573
30 H THR 8 H THR 8 -12.742 -1.729 -4.231
31 HA THR 8 HA THR 8 -14.010 0.800 -3.451
32 HB THR 8 HB THR 8 -14.728 -0.985 -2.050
33 HG1 THR 8 HG1 THR 8 -12.682 0.144 -0.466
34 HG21 THR 8 3HG2 THR 8 -13.385 -2.797 -2.077
35 HG22 THR 8 1HG2 THR 8 -12.640 -2.043 -0.669
36 HG23 THR 8 2HG2 THR 8 -11.920 -1.833 -2.265
37 H GLY 9 H GLY 9 -12.882 2.386 -2.293
38 HA2 GLY 9 1HA GLY 9 -10.883 3.180 -1.198
39 HA3 GLY 9 2HA GLY 9 -9.953 2.071 -2.194
40 H GLU 10 H GLU 10 -11.405 5.193 -1.976
41 HA GLU 10 HA GLU 10 -10.928 5.867 -4.746
42 HB2 GLU 10 1HB GLU 10 -11.738 7.599 -2.403
43 HB3 GLU 10 2HB GLU 10 -11.685 8.124 -4.080
44 HG2 GLU 10 1HG GLU 10 -13.330 6.222 -4.536
45 HG3 GLU 10 2HG GLU 10 -13.554 6.174 -2.788
46 H LYS 11 H LYS 11 -8.588 5.145 -4.354
47 HA LYS 11 HA LYS 11 -7.008 7.489 -3.520
48 HB2 LYS 11 1HB LYS 11 -6.559 4.564 -3.075
49 HB3 LYS 11 2HB LYS 11 -5.170 5.632 -3.222
50 HG2 LYS 11 1HG LYS 11 -5.535 5.541 -0.939
51 HG3 LYS 11 2HG LYS 11 -6.333 7.043 -1.412
52 HD2 LYS 11 1HD LYS 11 -8.437 5.524 -1.658
53 HD3 LYS 11 2HD LYS 11 -7.536 4.424 -0.613
54 HE2 LYS 11 1HE LYS 11 -7.532 5.920 1.166
55 HE3 LYS 11 2HE LYS 11 -7.849 7.308 0.126
56 HZ1 LYS 11 3HZ LYS 11 -9.720 5.320 1.192
57 HZ2 LYS 11 1HZ LYS 11 -10.064 6.018 -0.310
58 HZ3 LYS 11 2HZ LYS 11 -9.891 6.998 1.058
59 HA PRO 12 HA PRO 12 -5.184 7.632 -7.508
60 HB2 PRO 12 1HB PRO 12 -2.619 8.318 -6.939
61 HB3 PRO 12 2HB PRO 12 -3.973 9.444 -6.780
62 HG2 PRO 12 1HG PRO 12 -2.588 7.835 -4.669
63 HG3 PRO 12 2HG PRO 12 -3.120 9.526 -4.618
64 HD2 PRO 12 1HD PRO 12 -4.526 7.520 -3.464
65 HD3 PRO 12 2HD PRO 12 -5.306 8.955 -4.161
66 H TYR 13 H TYR 13 -3.734 5.564 -5.100
67 HA TYR 13 HA TYR 13 -2.570 3.926 -7.256
68 HB2 TYR 13 1HB TYR 13 -1.577 4.008 -4.406
69 HB3 TYR 13 2HB TYR 13 -0.798 3.260 -5.796
70 HD1 TYR 13 HD1 TYR 13 0.195 4.706 -7.572
71 HD2 TYR 13 HD2 TYR 13 -1.265 6.310 -3.911
72 HE1 TYR 13 HE1 TYR 13 1.467 6.772 -7.977
73 HE2 TYR 13 HE2 TYR 13 0.002 8.380 -4.306
74 HH TYR 13 HH TYR 13 2.231 8.927 -5.745
75 H GLU 14 H GLU 14 -3.211 1.863 -7.394
76 HA GLU 14 HA GLU 14 -4.448 0.563 -5.092
77 HB2 GLU 14 1HB GLU 14 -6.226 1.725 -6.505
78 HB3 GLU 14 2HB GLU 14 -5.841 0.560 -7.765
79 HG2 GLU 14 1HG GLU 14 -6.467 -1.268 -6.299
80 HG3 GLU 14 2HG GLU 14 -6.797 -0.129 -4.995
81 H CYS 15 H CYS 15 -3.679 -1.428 -4.891
82 HA CYS 15 HA CYS 15 -1.969 -2.572 -6.858
83 HB2 CYS 15 1HB CYS 15 -1.606 -2.956 -4.469
84 HB3 CYS 15 2HB CYS 15 -3.155 -3.785 -4.353
85 H SER 16 H SER 16 -2.265 -4.390 -8.140
86 HA SER 16 HA SER 16 -5.065 -4.982 -8.765
87 HB2 SER 16 1HB SER 16 -4.125 -5.964 -10.867
88 HB3 SER 16 2HB SER 16 -3.757 -4.251 -10.663
89 HG SER 16 HG SER 16 -2.067 -6.475 -10.507
90 H ILE 17 H ILE 17 -2.178 -6.413 -7.504
91 HA ILE 17 HA ILE 17 -2.779 -9.131 -7.938
92 HB ILE 17 HB ILE 17 -1.139 -7.840 -5.757
93 HG12 ILE 17 1HG1 ILE 17 0.003 -9.387 -8.041
94 HG13 ILE 17 2HG1 ILE 17 -0.569 -7.750 -8.346
95 HG21 ILE 17 1HG2 ILE 17 -1.599 -9.923 -4.862
96 HG22 ILE 17 2HG2 ILE 17 -1.646 -10.705 -6.441
97 HG23 ILE 17 3HG2 ILE 17 -0.101 -10.218 -5.745
98 HD11 ILE 17 3HD1 ILE 17 1.664 -7.438 -7.876
99 HD12 ILE 17 1HD1 ILE 17 0.901 -7.120 -6.319
100 HD13 ILE 17 2HD1 ILE 17 1.680 -8.674 -6.619
101 H CYS 18 H CYS 18 -3.151 -7.185 -4.968
102 HA CYS 18 HA CYS 18 -5.115 -9.148 -4.011
103 HB2 CYS 18 1HB CYS 18 -4.771 -8.052 -1.790
104 HB3 CYS 18 2HB CYS 18 -3.314 -8.787 -2.452
105 H GLY 19 H GLY 19 -4.617 -5.658 -4.423
106 HA2 GLY 19 1HA GLY 19 -6.551 -4.467 -5.427
107 HA3 GLY 19 2HA GLY 19 -7.551 -5.332 -4.269
108 H LYS 20 H LYS 20 -4.579 -4.415 -2.958
109 HA LYS 20 HA LYS 20 -5.725 -2.725 -1.031
110 HB2 LYS 20 1HB LYS 20 -2.958 -3.460 -1.838
111 HB3 LYS 20 2HB LYS 20 -3.153 -2.018 -0.849
112 HG2 LYS 20 1HG LYS 20 -4.533 -4.498 0.019
113 HG3 LYS 20 2HG LYS 20 -2.781 -4.402 0.215
114 HD2 LYS 20 1HD LYS 20 -3.574 -3.565 2.231
115 HD3 LYS 20 2HD LYS 20 -3.265 -2.101 1.294
116 HE2 LYS 20 1HE LYS 20 -5.443 -2.110 2.519
117 HE3 LYS 20 2HE LYS 20 -5.583 -1.854 0.780
118 HZ1 LYS 20 3HZ LYS 20 -7.182 -3.485 1.862
119 HZ2 LYS 20 1HZ LYS 20 -5.867 -4.544 1.972
120 HZ3 LYS 20 2HZ LYS 20 -6.391 -4.001 0.458
121 H SER 21 H SER 21 -4.827 -0.441 -0.631
122 HA SER 21 HA SER 21 -4.524 1.086 -3.107
123 HB2 SER 21 1HB SER 21 -6.319 2.569 -2.660
124 HB3 SER 21 2HB SER 21 -6.983 0.954 -2.408
125 HG SER 21 HG SER 21 -7.224 1.372 -0.352
126 H PHE 22 H PHE 22 -3.393 2.993 -2.887
127 HA PHE 22 HA PHE 22 -2.597 3.849 -0.211
128 HB2 PHE 22 1HB PHE 22 -0.556 3.296 -2.372
129 HB3 PHE 22 2HB PHE 22 -0.237 3.827 -0.724
130 HD1 PHE 22 HD1 PHE 22 -1.644 1.015 -2.694
131 HD2 PHE 22 HD2 PHE 22 0.118 2.274 0.970
132 HE1 PHE 22 HE1 PHE 22 -1.459 -1.332 -1.981
133 HE2 PHE 22 HE2 PHE 22 0.307 -0.072 1.688
134 HZ PHE 22 HZ PHE 22 -0.481 -1.878 0.212
135 H THR 23 H THR 23 -1.213 5.900 -0.384
136 HA THR 23 HA THR 23 -2.162 7.551 -2.632
137 HB THR 23 HB THR 23 -2.173 9.475 -0.958
138 HG1 THR 23 HG1 THR 23 -1.122 8.509 0.775
139 HG21 THR 23 3HG2 THR 23 -4.131 7.336 -1.338
140 HG22 THR 23 1HG2 THR 23 -4.337 9.086 -1.416
141 HG23 THR 23 2HG2 THR 23 -4.373 8.263 0.143
142 H LYS 24 H LYS 24 0.445 6.133 -1.847
143 HA LYS 24 HA LYS 24 2.171 8.361 -2.582
144 HB2 LYS 24 1HB LYS 24 2.298 6.899 0.009
145 HB3 LYS 24 2HB LYS 24 3.820 7.303 -0.773
146 HG2 LYS 24 1HG LYS 24 3.127 9.669 -0.833
147 HG3 LYS 24 2HG LYS 24 1.654 9.233 0.036
148 HD2 LYS 24 1HD LYS 24 3.026 8.389 1.897
149 HD3 LYS 24 2HD LYS 24 4.483 8.879 1.029
150 HE2 LYS 24 1HE LYS 24 3.569 11.217 1.019
151 HE3 LYS 24 2HE LYS 24 2.293 10.652 2.096
152 HZ1 LYS 24 3HZ LYS 24 4.571 9.771 3.284
153 HZ2 LYS 24 1HZ LYS 24 3.700 11.153 3.727
154 HZ3 LYS 24 2HZ LYS 24 5.025 11.286 2.683
155 H LYS 25 H LYS 25 3.196 7.676 -4.333
156 HA LYS 25 HA LYS 25 3.321 5.232 -5.448
157 HB2 LYS 25 1HB LYS 25 5.190 7.546 -5.492
158 HB3 LYS 25 2HB LYS 25 5.761 6.034 -6.186
159 HG2 LYS 25 1HG LYS 25 3.140 7.255 -6.983
160 HG3 LYS 25 2HG LYS 25 4.663 7.703 -7.756
161 HD2 LYS 25 1HD LYS 25 4.972 5.151 -8.072
162 HD3 LYS 25 2HD LYS 25 3.234 5.068 -7.772
163 HE2 LYS 25 1HE LYS 25 3.374 5.228 -10.089
164 HE3 LYS 25 2HE LYS 25 3.053 6.886 -9.585
165 HZ1 LYS 25 3HZ LYS 25 4.889 6.484 -11.290
166 HZ2 LYS 25 1HZ LYS 25 5.815 5.926 -9.989
167 HZ3 LYS 25 2HZ LYS 25 5.236 7.515 -9.994
168 H SER 26 H SER 26 5.592 6.444 -3.009
169 HA SER 26 HA SER 26 7.299 4.225 -2.951
170 HB2 SER 26 1HB SER 26 7.683 6.484 -1.862
171 HB3 SER 26 2HB SER 26 6.619 5.948 -0.562
172 HG SER 26 HG SER 26 8.229 4.009 -0.715
173 H GLN 27 H GLN 27 4.478 4.978 -0.916
174 HA GLN 27 HA GLN 27 4.514 2.749 0.720
175 HB2 GLN 27 1HB GLN 27 2.209 4.365 -0.358
176 HB3 GLN 27 2HB GLN 27 1.988 3.074 0.815
177 HG2 GLN 27 1HG GLN 27 3.611 5.580 1.186
178 HG3 GLN 27 2HG GLN 27 2.059 5.205 1.933
179 HE21 GLN 27 1HE2 GLN 27 4.600 5.843 3.187
180 HE22 GLN 27 2HE2 GLN 27 4.991 4.500 4.201
181 H LEU 28 H LEU 28 2.833 3.129 -2.396
182 HA LEU 28 HA LEU 28 1.759 0.548 -2.521
183 HB2 LEU 28 1HB LEU 28 0.959 2.266 -3.979
184 HB3 LEU 28 2HB LEU 28 2.556 2.471 -4.696
185 HG LEU 28 HG LEU 28 2.349 0.179 -5.653
186 HD11 LEU 28 1HD1 LEU 28 0.284 -0.979 -5.638
187 HD12 LEU 28 2HD1 LEU 28 -0.548 0.370 -4.865
188 HD13 LEU 28 3HD1 LEU 28 0.642 -0.566 -3.961
189 HD21 LEU 28 3HD2 LEU 28 -0.031 1.600 -6.666
190 HD22 LEU 28 1HD2 LEU 28 1.387 0.998 -7.525
191 HD23 LEU 28 2HD2 LEU 28 1.475 2.520 -6.638
192 H HIS 29 H HIS 29 4.770 1.831 -3.919
193 HA HIS 29 HA HIS 29 5.678 -0.471 -5.163
194 HB2 HIS 29 1HB HIS 29 7.201 1.775 -3.841
195 HB3 HIS 29 2HB HIS 29 7.989 0.499 -4.763
196 HD2 HIS 29 HD2 HIS 29 4.731 1.618 -6.408
197 HE1 HIS 29 HE1 HIS 29 7.874 3.702 -8.351
198 HE2 HIS 29 HE2 HIS 29 5.411 3.177 -8.356
199 H VAL 30 H VAL 30 6.261 0.608 -1.826
200 HA VAL 30 HA VAL 30 7.856 -1.584 -1.061
201 HB VAL 30 HB VAL 30 6.111 0.182 0.662
202 HG11 VAL 30 1HG1 VAL 30 7.144 -0.666 2.546
203 HG12 VAL 30 2HG1 VAL 30 6.961 -2.112 1.551
204 HG13 VAL 30 3HG1 VAL 30 8.520 -1.292 1.638
205 HG21 VAL 30 3HG2 VAL 30 9.038 0.510 0.630
206 HG22 VAL 30 1HG2 VAL 30 8.198 0.987 -0.846
207 HG23 VAL 30 2HG2 VAL 30 7.759 1.722 0.695
208 H HIS 31 H HIS 31 4.372 -1.038 -0.973
209 HA HIS 31 HA HIS 31 3.628 -3.249 0.567
210 HB2 HIS 31 1HB HIS 31 1.876 -1.782 0.222
211 HB3 HIS 31 2HB HIS 31 2.257 -1.562 -1.483
212 HD1 HIS 31 HD1 HIS 31 0.624 -4.043 0.849
213 HD2 HIS 31 HD2 HIS 31 0.866 -3.182 -3.208
214 HE1 HIS 31 HE1 HIS 31 -1.075 -5.531 -0.256
215 H GLN 32 H GLN 32 3.941 -2.944 -2.964
216 HA GLN 32 HA GLN 32 3.111 -5.366 -3.841
217 HB2 GLN 32 1HB GLN 32 5.597 -3.888 -4.717
218 HB3 GLN 32 2HB GLN 32 4.861 -5.211 -5.612
219 HG2 GLN 32 1HG GLN 32 2.894 -3.939 -6.030
220 HG3 GLN 32 2HG GLN 32 3.417 -2.666 -4.928
221 HE21 GLN 32 1HE2 GLN 32 2.871 -3.043 -7.972
222 HE22 GLN 32 2HE2 GLN 32 4.177 -2.174 -8.696
223 H GLN 33 H GLN 33 6.079 -4.692 -2.098
224 HA GLN 33 HA GLN 33 7.535 -6.984 -2.499
225 HB2 GLN 33 1HB GLN 33 7.174 -5.470 0.093
226 HB3 GLN 33 2HB GLN 33 8.455 -6.632 -0.225
227 HG2 GLN 33 1HG GLN 33 9.043 -5.118 -2.217
228 HG3 GLN 33 2HG GLN 33 8.048 -3.913 -1.401
229 HE21 GLN 33 1HE2 GLN 33 9.731 -2.535 -0.967
230 HE22 GLN 33 2HE2 GLN 33 10.974 -2.896 0.177
231 H ILE 34 H ILE 34 4.902 -6.491 -0.170
232 HA ILE 34 HA ILE 34 4.893 -8.771 1.272
233 HB ILE 34 HB ILE 34 3.137 -6.887 1.216
234 HG12 ILE 34 1HG1 ILE 34 1.876 -9.584 1.561
235 HG13 ILE 34 2HG1 ILE 34 3.224 -9.120 2.594
236 HG21 ILE 34 1HG2 ILE 34 1.138 -7.273 -0.029
237 HG22 ILE 34 2HG2 ILE 34 2.494 -7.348 -1.154
238 HG23 ILE 34 3HG2 ILE 34 1.727 -8.835 -0.596
239 HD11 ILE 34 3HD1 ILE 34 1.151 -8.641 3.701
240 HD12 ILE 34 1HD1 ILE 34 1.953 -7.126 3.289
241 HD13 ILE 34 2HD1 ILE 34 0.591 -7.693 2.324
242 H HIS 35 H HIS 35 4.042 -8.479 -2.116
243 HA HIS 35 HA HIS 35 3.154 -11.230 -2.295
244 HB2 HIS 35 1HB HIS 35 3.645 -9.252 -4.528
245 HB3 HIS 35 2HB HIS 35 2.736 -10.757 -4.634
246 HD1 HIS 35 HD1 HIS 35 0.574 -10.759 -2.851
247 HD2 HIS 35 HD2 HIS 35 2.046 -7.109 -4.182
248 HE1 HIS 35 HE1 HIS 35 -1.275 -9.103 -2.451
249 H THR 36 H THR 36 5.716 -11.147 -1.318
250 HA THR 36 HA THR 36 7.420 -11.886 -3.597
251 HB THR 36 HB THR 36 8.372 -10.169 -2.136
252 HG1 THR 36 HG1 THR 36 9.877 -12.451 -1.502
253 HG21 THR 36 3HG2 THR 36 7.648 -10.360 0.011
254 HG22 THR 36 1HG2 THR 36 9.152 -11.265 0.183
255 HG23 THR 36 2HG2 THR 36 7.627 -12.123 -0.038
256 H GLY 37 H GLY 37 5.401 -13.678 -2.738
257 HA2 GLY 37 1HA GLY 37 6.589 -15.669 -1.023
258 HA3 GLY 37 2HA GLY 37 5.065 -15.809 -1.888
259 H GLU 38 H GLU 38 6.423 -15.078 -4.448
260 HA GLU 38 HA GLU 38 7.262 -17.771 -5.123
261 HB2 GLU 38 1HB GLU 38 7.162 -17.029 -7.431
262 HB3 GLU 38 2HB GLU 38 5.700 -16.541 -6.585
263 HG2 GLU 38 1HG GLU 38 7.964 -14.620 -6.755
264 HG3 GLU 38 2HG GLU 38 6.963 -14.893 -8.181
265 H LYS 39 H LYS 39 9.079 -16.634 -3.419
266 HA LYS 39 HA LYS 39 11.463 -16.661 -5.059
267 HB2 LYS 39 1HB LYS 39 10.650 -14.255 -3.438
268 HB3 LYS 39 2HB LYS 39 12.328 -14.572 -3.858
269 HG2 LYS 39 1HG LYS 39 11.765 -14.487 -6.225
270 HG3 LYS 39 2HG LYS 39 10.071 -14.203 -5.819
271 HD2 LYS 39 1HD LYS 39 10.622 -12.097 -4.787
272 HD3 LYS 39 2HD LYS 39 12.347 -12.399 -5.003
273 HE2 LYS 39 1HE LYS 39 10.391 -12.208 -7.285
274 HE3 LYS 39 2HE LYS 39 11.304 -10.831 -6.672
275 HZ1 LYS 39 3HZ LYS 39 12.235 -13.151 -8.190
276 HZ2 LYS 39 1HZ LYS 39 13.294 -12.483 -7.052
277 HZ3 LYS 39 2HZ LYS 39 12.692 -11.526 -8.310
278 HA PRO 40 HA PRO 40 12.781 -18.938 -1.506
279 HB2 PRO 40 1HB PRO 40 15.404 -19.145 -2.171
280 HB3 PRO 40 2HB PRO 40 14.137 -20.097 -2.953
281 HG2 PRO 40 1HG PRO 40 15.485 -17.597 -3.899
282 HG3 PRO 40 2HG PRO 40 15.071 -19.059 -4.813
283 HD2 PRO 40 1HD PRO 40 13.574 -16.805 -4.914
284 HD3 PRO 40 2HD PRO 40 12.870 -18.427 -5.070
285 H SER 41 H SER 41 13.540 -18.442 0.480
286 HA SER 41 HA SER 41 14.291 -15.754 1.054
287 HB2 SER 41 1HB SER 41 12.994 -17.337 2.575
288 HB3 SER 41 2HB SER 41 14.542 -18.096 2.942
289 HG SER 41 HG SER 41 14.373 -15.321 3.164
290 H GLY 42 H GLY 42 16.253 -14.914 1.705
291 HA2 GLY 42 1HA GLY 42 18.572 -16.354 2.292
292 HA3 GLY 42 2HA GLY 42 18.575 -16.044 0.562
293 HA PRO 43 HA PRO 43 20.458 -12.162 1.370
294 HB2 PRO 43 1HB PRO 43 19.746 -10.832 -0.886
295 HB3 PRO 43 2HB PRO 43 20.971 -12.106 -0.869
296 HG2 PRO 43 1HG PRO 43 18.090 -12.260 -1.666
297 HG3 PRO 43 2HG PRO 43 19.509 -12.971 -2.456
298 HD2 PRO 43 1HD PRO 43 17.855 -14.406 -0.862
299 HD3 PRO 43 2HD PRO 43 19.594 -14.745 -0.986
300 H SER 44 H SER 44 17.047 -12.436 0.778
301 HA SER 44 HA SER 44 16.234 -9.785 1.086
302 HB2 SER 44 1HB SER 44 14.051 -10.762 1.828
303 HB3 SER 44 2HB SER 44 14.670 -11.468 0.335
304 HG SER 44 HG SER 44 15.667 -13.024 2.038
305 H SER 45 H SER 45 16.060 -8.443 2.772
306 HA SER 45 HA SER 45 15.800 -9.345 5.473
307 HB2 SER 45 1HB SER 45 17.936 -8.295 6.272
308 HB3 SER 45 2HB SER 45 18.172 -9.747 5.300
309 HG SER 45 HG SER 45 18.598 -7.050 4.596
310 H GLY 46 H GLY 46 14.199 -7.970 5.959
311 HA2 GLY 46 1HA GLY 46 14.763 -5.207 6.339
312 HA3 GLY 46 2HA GLY 46 13.752 -5.442 4.920
Start of MODEL 19
1 H1 GLY 1 H GLY 1 -26.889 -6.605 10.647
2 HA2 GLY 1 1HA GLY 1 -27.564 -6.827 8.140
3 HA3 GLY 1 2HA GLY 1 -26.921 -5.285 8.685
4 H SER 2 H SER 2 -26.679 -5.806 6.081
5 HA SER 2 HA SER 2 -23.833 -6.505 5.773
6 HB2 SER 2 1HB SER 2 -24.379 -7.319 3.492
7 HB3 SER 2 2HB SER 2 -25.194 -8.248 4.750
8 HG SER 2 HG SER 2 -27.067 -6.982 4.339
9 H SER 3 H SER 3 -22.785 -4.646 5.497
10 HA SER 3 HA SER 3 -23.982 -2.307 4.402
11 HB2 SER 3 1HB SER 3 -21.827 -1.272 4.686
12 HB3 SER 3 2HB SER 3 -22.105 -2.322 6.076
13 HG SER 3 HG SER 3 -20.924 -3.899 4.501
14 H GLY 4 H GLY 4 -24.233 -1.757 2.342
15 HA2 GLY 4 1HA GLY 4 -23.082 -3.417 0.264
16 HA3 GLY 4 2HA GLY 4 -24.241 -2.115 0.041
17 H SER 5 H SER 5 -20.887 -2.476 1.205
18 HA SER 5 HA SER 5 -20.213 -0.010 -0.241
19 HB2 SER 5 1HB SER 5 -18.631 -1.446 1.904
20 HB3 SER 5 2HB SER 5 -18.248 0.124 1.199
21 HG SER 5 HG SER 5 -19.320 0.564 3.060
22 H SER 6 H SER 6 -19.659 -0.532 -2.275
23 HA SER 6 HA SER 6 -18.664 -2.851 -3.295
24 HB2 SER 6 1HB SER 6 -18.149 0.004 -4.115
25 HB3 SER 6 2HB SER 6 -17.511 -1.356 -5.038
26 HG SER 6 HG SER 6 -19.400 -1.319 -5.959
27 H GLY 7 H GLY 7 -16.751 -0.174 -1.949
28 HA2 GLY 7 1HA GLY 7 -14.722 -0.316 -0.818
29 HA3 GLY 7 2HA GLY 7 -14.668 -2.034 -1.185
30 H THR 8 H THR 8 -14.292 1.164 -2.674
31 HA THR 8 HA THR 8 -12.359 -0.038 -4.548
32 HB THR 8 HB THR 8 -14.198 0.846 -5.805
33 HG1 THR 8 HG1 THR 8 -13.064 2.557 -6.953
34 HG21 THR 8 3HG2 THR 8 -15.444 2.514 -5.016
35 HG22 THR 8 1HG2 THR 8 -14.106 3.629 -5.290
36 HG23 THR 8 2HG2 THR 8 -14.267 2.810 -3.736
37 H GLY 9 H GLY 9 -12.833 2.220 -2.021
38 HA2 GLY 9 1HA GLY 9 -11.499 3.872 -1.114
39 HA3 GLY 9 2HA GLY 9 -10.225 2.702 -1.424
40 H GLU 10 H GLU 10 -11.950 5.472 -2.746
41 HA GLU 10 HA GLU 10 -10.648 5.853 -5.133
42 HB2 GLU 10 1HB GLU 10 -12.454 7.297 -4.539
43 HB3 GLU 10 2HB GLU 10 -11.606 7.875 -3.111
44 HG2 GLU 10 1HG GLU 10 -11.618 9.530 -4.904
45 HG3 GLU 10 2HG GLU 10 -9.983 9.015 -4.494
46 H LYS 11 H LYS 11 -8.511 5.531 -5.356
47 HA LYS 11 HA LYS 11 -6.719 7.429 -4.084
48 HB2 LYS 11 1HB LYS 11 -6.458 4.442 -3.736
49 HB3 LYS 11 2HB LYS 11 -5.124 5.557 -3.474
50 HG2 LYS 11 1HG LYS 11 -6.815 6.739 -1.869
51 HG3 LYS 11 2HG LYS 11 -7.606 5.161 -1.877
52 HD2 LYS 11 1HD LYS 11 -5.541 4.103 -1.141
53 HD3 LYS 11 2HD LYS 11 -4.710 5.659 -1.187
54 HE2 LYS 11 1HE LYS 11 -6.491 6.453 0.465
55 HE3 LYS 11 2HE LYS 11 -6.885 4.747 0.674
56 HZ1 LYS 11 3HZ LYS 11 -5.005 6.088 2.069
57 HZ2 LYS 11 1HZ LYS 11 -4.073 5.324 0.881
58 HZ3 LYS 11 2HZ LYS 11 -5.066 4.407 1.897
59 HA PRO 12 HA PRO 12 -4.831 7.311 -8.054
60 HB2 PRO 12 1HB PRO 12 -2.365 8.249 -7.415
61 HB3 PRO 12 2HB PRO 12 -3.801 9.278 -7.464
62 HG2 PRO 12 1HG PRO 12 -2.454 8.018 -5.106
63 HG3 PRO 12 2HG PRO 12 -3.104 9.659 -5.278
64 HD2 PRO 12 1HD PRO 12 -4.443 7.688 -3.991
65 HD3 PRO 12 2HD PRO 12 -5.271 8.976 -4.891
66 H TYR 13 H TYR 13 -3.538 5.547 -5.369
67 HA TYR 13 HA TYR 13 -2.068 3.813 -7.244
68 HB2 TYR 13 1HB TYR 13 -1.275 4.090 -4.361
69 HB3 TYR 13 2HB TYR 13 -0.317 3.514 -5.720
70 HD1 TYR 13 HD1 TYR 13 0.386 5.216 -7.488
71 HD2 TYR 13 HD2 TYR 13 -1.160 6.331 -3.684
72 HE1 TYR 13 HE1 TYR 13 1.365 7.457 -7.753
73 HE2 TYR 13 HE2 TYR 13 -0.187 8.575 -3.939
74 HH TYR 13 HH TYR 13 0.966 9.756 -6.872
75 H GLU 14 H GLU 14 -2.886 1.840 -7.371
76 HA GLU 14 HA GLU 14 -4.098 0.640 -4.981
77 HB2 GLU 14 1HB GLU 14 -5.829 1.588 -6.591
78 HB3 GLU 14 2HB GLU 14 -5.313 0.348 -7.725
79 HG2 GLU 14 1HG GLU 14 -5.824 -1.323 -5.871
80 HG3 GLU 14 2HG GLU 14 -6.665 0.005 -5.073
81 H CYS 15 H CYS 15 -3.939 -1.604 -4.832
82 HA CYS 15 HA CYS 15 -1.764 -2.745 -6.370
83 HB2 CYS 15 1HB CYS 15 -2.062 -3.001 -3.851
84 HB3 CYS 15 2HB CYS 15 -3.372 -4.119 -4.219
85 H SER 16 H SER 16 -2.007 -3.992 -8.097
86 HA SER 16 HA SER 16 -4.674 -4.839 -8.882
87 HB2 SER 16 1HB SER 16 -3.670 -5.375 -11.032
88 HB3 SER 16 2HB SER 16 -3.142 -3.771 -10.525
89 HG SER 16 HG SER 16 -1.186 -4.488 -10.672
90 H ILE 17 H ILE 17 -2.866 -6.101 -6.711
91 HA ILE 17 HA ILE 17 -2.974 -8.866 -7.720
92 HB ILE 17 HB ILE 17 -1.331 -7.743 -5.448
93 HG12 ILE 17 1HG1 ILE 17 -0.377 -8.903 -8.069
94 HG13 ILE 17 2HG1 ILE 17 -0.629 -7.179 -7.820
95 HG21 ILE 17 1HG2 ILE 17 -1.456 -10.538 -6.571
96 HG22 ILE 17 2HG2 ILE 17 -0.305 -9.972 -5.361
97 HG23 ILE 17 3HG2 ILE 17 -2.027 -10.021 -4.985
98 HD11 ILE 17 3HD1 ILE 17 1.135 -8.709 -5.965
99 HD12 ILE 17 1HD1 ILE 17 1.734 -8.192 -7.540
100 HD13 ILE 17 2HD1 ILE 17 1.158 -6.995 -6.380
101 H CYS 18 H CYS 18 -3.225 -7.153 -4.597
102 HA CYS 18 HA CYS 18 -5.207 -9.130 -3.735
103 HB2 CYS 18 1HB CYS 18 -4.848 -8.131 -1.472
104 HB3 CYS 18 2HB CYS 18 -3.393 -8.822 -2.181
105 H GLY 19 H GLY 19 -4.737 -5.614 -3.936
106 HA2 GLY 19 1HA GLY 19 -6.821 -4.528 -4.933
107 HA3 GLY 19 2HA GLY 19 -7.646 -5.283 -3.577
108 H LYS 20 H LYS 20 -5.029 -4.695 -2.027
109 HA LYS 20 HA LYS 20 -5.845 -2.622 -0.476
110 HB2 LYS 20 1HB LYS 20 -3.164 -3.710 -1.167
111 HB3 LYS 20 2HB LYS 20 -3.215 -2.173 -0.313
112 HG2 LYS 20 1HG LYS 20 -4.884 -3.517 1.243
113 HG3 LYS 20 2HG LYS 20 -3.970 -4.887 0.608
114 HD2 LYS 20 1HD LYS 20 -1.877 -3.619 1.265
115 HD3 LYS 20 2HD LYS 20 -2.935 -2.514 2.146
116 HE2 LYS 20 1HE LYS 20 -3.094 -5.470 2.601
117 HE3 LYS 20 2HE LYS 20 -1.853 -4.507 3.400
118 HZ1 LYS 20 3HZ LYS 20 -4.474 -4.857 4.202
119 HZ2 LYS 20 1HZ LYS 20 -4.378 -3.258 3.658
120 HZ3 LYS 20 2HZ LYS 20 -3.332 -3.804 4.871
121 H SER 21 H SER 21 -5.282 -0.381 -0.316
122 HA SER 21 HA SER 21 -4.507 0.879 -2.857
123 HB2 SER 21 1HB SER 21 -6.238 2.600 -2.530
124 HB3 SER 21 2HB SER 21 -6.953 0.994 -2.673
125 HG SER 21 HG SER 21 -6.319 1.891 -0.113
126 H PHE 22 H PHE 22 -3.282 2.719 -2.696
127 HA PHE 22 HA PHE 22 -2.682 3.719 0.000
128 HB2 PHE 22 1HB PHE 22 -0.579 3.189 -2.107
129 HB3 PHE 22 2HB PHE 22 -0.308 3.758 -0.463
130 HD1 PHE 22 HD1 PHE 22 -1.340 0.869 -2.502
131 HD2 PHE 22 HD2 PHE 22 -0.209 2.251 1.362
132 HE1 PHE 22 HE1 PHE 22 -1.108 -1.459 -1.741
133 HE2 PHE 22 HE2 PHE 22 0.025 -0.075 2.129
134 HZ PHE 22 HZ PHE 22 -0.423 -1.934 0.577
135 H THR 23 H THR 23 -1.515 5.835 -0.065
136 HA THR 23 HA THR 23 -2.454 7.440 -2.354
137 HB THR 23 HB THR 23 -2.427 9.372 -0.688
138 HG1 THR 23 HG1 THR 23 -2.880 8.362 1.533
139 HG21 THR 23 3HG2 THR 23 -4.658 9.021 -0.110
140 HG22 THR 23 1HG2 THR 23 -4.436 7.282 0.082
141 HG23 THR 23 2HG2 THR 23 -4.450 7.997 -1.530
142 H LYS 24 H LYS 24 0.200 6.060 -1.655
143 HA LYS 24 HA LYS 24 1.867 8.317 -2.446
144 HB2 LYS 24 1HB LYS 24 2.245 6.702 0.058
145 HB3 LYS 24 2HB LYS 24 3.626 7.427 -0.755
146 HG2 LYS 24 1HG LYS 24 3.135 9.078 0.729
147 HG3 LYS 24 2HG LYS 24 2.132 9.593 -0.630
148 HD2 LYS 24 1HD LYS 24 0.582 9.709 1.042
149 HD3 LYS 24 2HD LYS 24 0.360 8.025 0.563
150 HE2 LYS 24 1HE LYS 24 2.137 7.504 2.348
151 HE3 LYS 24 2HE LYS 24 1.816 9.133 2.941
152 HZ1 LYS 24 3HZ LYS 24 -0.580 8.457 3.045
153 HZ2 LYS 24 1HZ LYS 24 0.434 7.676 4.151
154 HZ3 LYS 24 2HZ LYS 24 -0.083 6.865 2.760
155 H LYS 25 H LYS 25 2.938 7.700 -4.193
156 HA LYS 25 HA LYS 25 3.009 5.246 -5.356
157 HB2 LYS 25 1HB LYS 25 3.864 7.459 -6.281
158 HB3 LYS 25 2HB LYS 25 5.378 7.111 -5.457
159 HG2 LYS 25 1HG LYS 25 5.794 6.340 -7.583
160 HG3 LYS 25 2HG LYS 25 5.277 4.868 -6.756
161 HD2 LYS 25 1HD LYS 25 2.935 5.414 -7.604
162 HD3 LYS 25 2HD LYS 25 3.715 6.589 -8.665
163 HE2 LYS 25 1HE LYS 25 4.687 3.763 -8.592
164 HE3 LYS 25 2HE LYS 25 3.242 4.170 -9.516
165 HZ1 LYS 25 3HZ LYS 25 4.925 4.407 -11.054
166 HZ2 LYS 25 1HZ LYS 25 6.019 5.057 -9.939
167 HZ3 LYS 25 2HZ LYS 25 4.735 5.998 -10.511
168 H SER 26 H SER 26 5.233 6.471 -2.905
169 HA SER 26 HA SER 26 7.033 4.289 -2.980
170 HB2 SER 26 1HB SER 26 6.435 6.177 -0.689
171 HB3 SER 26 2HB SER 26 7.857 5.143 -0.833
172 HG SER 26 HG SER 26 8.536 6.345 -2.575
173 H GLN 27 H GLN 27 4.114 4.945 -1.112
174 HA GLN 27 HA GLN 27 4.292 2.826 0.704
175 HB2 GLN 27 1HB GLN 27 1.945 4.312 -0.455
176 HB3 GLN 27 2HB GLN 27 1.735 3.025 0.724
177 HG2 GLN 27 1HG GLN 27 3.475 5.422 1.216
178 HG3 GLN 27 2HG GLN 27 1.762 5.373 1.627
179 HE21 GLN 27 1HE2 GLN 27 3.801 5.779 3.493
180 HE22 GLN 27 2HE2 GLN 27 3.831 4.432 4.574
181 H LEU 28 H LEU 28 2.787 2.977 -2.506
182 HA LEU 28 HA LEU 28 1.819 0.316 -2.488
183 HB2 LEU 28 1HB LEU 28 0.966 2.077 -3.977
184 HB3 LEU 28 2HB LEU 28 2.504 2.079 -4.836
185 HG LEU 28 HG LEU 28 2.018 -0.357 -5.393
186 HD11 LEU 28 1HD1 LEU 28 -0.803 0.424 -4.696
187 HD12 LEU 28 2HD1 LEU 28 0.222 -0.554 -3.646
188 HD13 LEU 28 3HD1 LEU 28 -0.214 -1.144 -5.250
189 HD21 LEU 28 3HD2 LEU 28 0.678 0.235 -7.302
190 HD22 LEU 28 1HD2 LEU 28 1.820 1.539 -6.976
191 HD23 LEU 28 2HD2 LEU 28 0.128 1.711 -6.508
192 H HIS 29 H HIS 29 4.688 1.781 -4.005
193 HA HIS 29 HA HIS 29 5.776 -0.427 -5.220
194 HB2 HIS 29 1HB HIS 29 7.019 1.971 -3.913
195 HB3 HIS 29 2HB HIS 29 8.041 0.698 -4.575
196 HD2 HIS 29 HD2 HIS 29 5.967 0.314 -7.277
197 HE1 HIS 29 HE1 HIS 29 7.391 4.227 -8.091
198 HE2 HIS 29 HE2 HIS 29 6.185 2.217 -9.015
199 H VAL 30 H VAL 30 6.183 0.582 -1.839
200 HA VAL 30 HA VAL 30 7.878 -1.588 -1.130
201 HB VAL 30 HB VAL 30 6.163 0.150 0.650
202 HG11 VAL 30 1HG1 VAL 30 7.228 -0.718 2.487
203 HG12 VAL 30 2HG1 VAL 30 7.147 -2.149 1.458
204 HG13 VAL 30 3HG1 VAL 30 8.644 -1.223 1.566
205 HG21 VAL 30 3HG2 VAL 30 8.922 0.760 0.844
206 HG22 VAL 30 1HG2 VAL 30 8.498 0.739 -0.868
207 HG23 VAL 30 2HG2 VAL 30 7.615 1.782 0.247
208 H HIS 31 H HIS 31 4.402 -1.072 -1.061
209 HA HIS 31 HA HIS 31 3.705 -3.304 0.508
210 HB2 HIS 31 1HB HIS 31 2.016 -1.693 0.210
211 HB3 HIS 31 2HB HIS 31 2.219 -1.675 -1.539
212 HD1 HIS 31 HD1 HIS 31 0.884 -3.928 1.198
213 HD2 HIS 31 HD2 HIS 31 0.543 -3.342 -2.901
214 HE1 HIS 31 HE1 HIS 31 -0.968 -5.457 0.452
215 H GLN 32 H GLN 32 4.092 -2.906 -2.989
216 HA GLN 32 HA GLN 32 3.157 -5.310 -3.915
217 HB2 GLN 32 1HB GLN 32 5.546 -3.707 -4.823
218 HB3 GLN 32 2HB GLN 32 4.935 -5.100 -5.705
219 HG2 GLN 32 1HG GLN 32 2.794 -3.989 -6.009
220 HG3 GLN 32 2HG GLN 32 3.375 -2.600 -5.091
221 HE21 GLN 32 1HE2 GLN 32 3.205 -1.120 -6.711
222 HE22 GLN 32 2HE2 GLN 32 4.176 -1.149 -8.139
223 H GLN 33 H GLN 33 6.022 -4.700 -2.058
224 HA GLN 33 HA GLN 33 7.549 -6.949 -2.627
225 HB2 GLN 33 1HB GLN 33 7.215 -5.547 0.031
226 HB3 GLN 33 2HB GLN 33 8.516 -6.658 -0.375
227 HG2 GLN 33 1HG GLN 33 7.999 -4.133 -1.913
228 HG3 GLN 33 2HG GLN 33 9.051 -4.198 -0.501
229 HE21 GLN 33 1HE2 GLN 33 9.774 -3.497 -3.183
230 HE22 GLN 33 2HE2 GLN 33 10.959 -4.641 -3.704
231 H ILE 34 H ILE 34 4.723 -6.596 -0.581
232 HA ILE 34 HA ILE 34 4.884 -9.042 0.790
233 HB ILE 34 HB ILE 34 3.279 -7.022 1.148
234 HG12 ILE 34 1HG1 ILE 34 2.207 -9.833 1.462
235 HG13 ILE 34 2HG1 ILE 34 3.419 -9.115 2.517
236 HG21 ILE 34 1HG2 ILE 34 2.295 -7.385 -1.180
237 HG22 ILE 34 2HG2 ILE 34 1.424 -8.742 -0.467
238 HG23 ILE 34 3HG2 ILE 34 1.163 -7.109 0.144
239 HD11 ILE 34 3HD1 ILE 34 0.516 -8.678 2.390
240 HD12 ILE 34 1HD1 ILE 34 1.620 -8.619 3.763
241 HD13 ILE 34 2HD1 ILE 34 1.502 -7.242 2.667
242 H HIS 35 H HIS 35 4.366 -8.420 -2.484
243 HA HIS 35 HA HIS 35 3.245 -11.118 -2.870
244 HB2 HIS 35 1HB HIS 35 2.907 -8.846 -4.823
245 HB3 HIS 35 2HB HIS 35 2.035 -10.376 -4.772
246 HD1 HIS 35 HD1 HIS 35 0.452 -10.648 -2.548
247 HD2 HIS 35 HD2 HIS 35 1.605 -6.801 -3.613
248 HE1 HIS 35 HE1 HIS 35 -1.155 -9.114 -1.370
249 H THR 36 H THR 36 5.931 -10.888 -2.592
250 HA THR 36 HA THR 36 6.953 -11.067 -5.352
251 HB THR 36 HB THR 36 8.862 -10.772 -3.092
252 HG1 THR 36 HG1 THR 36 7.647 -8.458 -4.171
253 HG21 THR 36 3HG2 THR 36 8.890 -9.245 -5.662
254 HG22 THR 36 1HG2 THR 36 9.303 -10.959 -5.665
255 HG23 THR 36 2HG2 THR 36 10.241 -9.828 -4.689
256 H GLY 37 H GLY 37 5.622 -13.228 -4.092
257 HA2 GLY 37 1HA GLY 37 6.770 -15.466 -4.711
258 HA3 GLY 37 2HA GLY 37 7.807 -15.052 -3.354
259 H GLU 38 H GLU 38 6.579 -17.397 -3.171
260 HA GLU 38 HA GLU 38 4.265 -16.930 -1.410
261 HB2 GLU 38 1HB GLU 38 5.017 -19.427 -2.939
262 HB3 GLU 38 2HB GLU 38 3.632 -19.271 -1.868
263 HG2 GLU 38 1HG GLU 38 2.848 -19.053 -4.094
264 HG3 GLU 38 2HG GLU 38 2.781 -17.457 -3.348
265 H LYS 39 H LYS 39 5.109 -16.751 0.590
266 HA LYS 39 HA LYS 39 7.323 -18.348 1.480
267 HB2 LYS 39 1HB LYS 39 6.930 -17.255 3.661
268 HB3 LYS 39 2HB LYS 39 7.051 -16.097 2.342
269 HG2 LYS 39 1HG LYS 39 4.703 -15.737 2.332
270 HG3 LYS 39 2HG LYS 39 4.430 -17.090 3.432
271 HD2 LYS 39 1HD LYS 39 4.263 -15.149 4.762
272 HD3 LYS 39 2HD LYS 39 5.857 -15.823 5.109
273 HE2 LYS 39 1HE LYS 39 6.957 -14.123 4.051
274 HE3 LYS 39 2HE LYS 39 5.636 -13.825 2.922
275 HZ1 LYS 39 3HZ LYS 39 5.776 -13.008 5.770
276 HZ2 LYS 39 1HZ LYS 39 4.376 -12.886 4.829
277 HZ3 LYS 39 2HZ LYS 39 5.754 -11.998 4.413
278 HA PRO 40 HA PRO 40 5.117 -21.864 2.943
279 HB2 PRO 40 1HB PRO 40 6.866 -22.725 4.833
280 HB3 PRO 40 2HB PRO 40 7.163 -22.898 3.099
281 HG2 PRO 40 1HG PRO 40 8.207 -20.837 5.003
282 HG3 PRO 40 2HG PRO 40 9.064 -21.710 3.719
283 HD2 PRO 40 1HD PRO 40 8.172 -19.172 3.411
284 HD3 PRO 40 2HD PRO 40 8.253 -20.326 2.064
285 H SER 41 H SER 41 3.351 -20.677 3.885
286 HA SER 41 HA SER 41 3.543 -20.483 6.819
287 HB2 SER 41 1HB SER 41 2.234 -18.624 4.850
288 HB3 SER 41 2HB SER 41 1.672 -18.708 6.520
289 HG SER 41 HG SER 41 3.500 -17.174 5.791
290 H GLY 42 H GLY 42 2.040 -21.553 7.966
291 HA2 GLY 42 1HA GLY 42 -0.526 -22.033 7.763
292 HA3 GLY 42 2HA GLY 42 0.034 -23.062 6.453
293 HA PRO 43 HA PRO 43 0.215 -25.173 10.724
294 HB2 PRO 43 1HB PRO 43 -2.003 -26.725 10.508
295 HB3 PRO 43 2HB PRO 43 -2.027 -25.108 11.221
296 HG2 PRO 43 1HG PRO 43 -2.798 -25.972 8.460
297 HG3 PRO 43 2HG PRO 43 -3.619 -24.837 9.547
298 HD2 PRO 43 1HD PRO 43 -2.042 -24.016 7.505
299 HD3 PRO 43 2HD PRO 43 -2.192 -23.105 9.021
300 H SER 44 H SER 44 -0.315 -26.085 7.422
301 HA SER 44 HA SER 44 -0.182 -28.740 7.223
302 HB2 SER 44 1HB SER 44 1.282 -26.612 5.717
303 HB3 SER 44 2HB SER 44 1.660 -28.300 5.377
304 HG SER 44 HG SER 44 -0.252 -28.564 4.492
305 H SER 45 H SER 45 1.280 -30.414 7.427
306 HA SER 45 HA SER 45 2.907 -31.598 8.500
307 HB2 SER 45 1HB SER 45 4.391 -29.260 7.331
308 HB3 SER 45 2HB SER 45 5.245 -30.480 8.276
309 HG SER 45 HG SER 45 5.289 -31.068 6.114
310 H GLY 46 H GLY 46 1.372 -30.324 10.316
311 HA2 GLY 46 1HA GLY 46 2.624 -28.556 12.082
312 HA3 GLY 46 2HA GLY 46 1.333 -29.667 12.514
Start of MODEL 20
1 H1 GLY 1 H GLY 1 -24.410 -11.573 0.493
2 HA2 GLY 1 1HA GLY 1 -22.717 -10.032 0.273
3 HA3 GLY 1 2HA GLY 1 -22.909 -10.326 -1.449
4 H SER 2 H SER 2 -23.059 -8.488 -2.531
5 HA SER 2 HA SER 2 -23.659 -6.384 -3.152
6 HB2 SER 2 1HB SER 2 -25.921 -6.711 -1.167
7 HB3 SER 2 2HB SER 2 -25.852 -5.565 -2.505
8 HG SER 2 HG SER 2 -27.049 -7.640 -2.805
9 H SER 3 H SER 3 -21.680 -6.595 -1.219
10 HA SER 3 HA SER 3 -22.132 -4.127 0.317
11 HB2 SER 3 1HB SER 3 -20.840 -5.054 2.184
12 HB3 SER 3 2HB SER 3 -22.250 -6.059 1.845
13 HG SER 3 HG SER 3 -20.519 -7.421 2.068
14 H GLY 4 H GLY 4 -20.274 -2.835 0.690
15 HA2 GLY 4 1HA GLY 4 -17.782 -3.599 -0.606
16 HA3 GLY 4 2HA GLY 4 -18.630 -2.236 -1.321
17 H SER 5 H SER 5 -16.063 -2.757 0.394
18 HA SER 5 HA SER 5 -16.509 -0.976 2.631
19 HB2 SER 5 1HB SER 5 -14.885 -3.042 2.462
20 HB3 SER 5 2HB SER 5 -13.778 -1.856 1.771
21 HG SER 5 HG SER 5 -13.468 -1.894 3.978
22 H SER 6 H SER 6 -14.639 -0.943 -0.387
23 HA SER 6 HA SER 6 -13.344 1.456 -0.198
24 HB2 SER 6 1HB SER 6 -13.236 -0.175 -2.120
25 HB3 SER 6 2HB SER 6 -14.742 0.526 -2.714
26 HG SER 6 HG SER 6 -12.510 2.152 -2.146
27 H GLY 7 H GLY 7 -13.805 3.601 -0.909
28 HA2 GLY 7 1HA GLY 7 -16.288 4.543 -1.766
29 HA3 GLY 7 2HA GLY 7 -16.296 4.588 -0.010
30 H THR 8 H THR 8 -16.564 6.918 -0.365
31 HA THR 8 HA THR 8 -15.807 9.068 -0.524
32 HB THR 8 HB THR 8 -13.205 7.907 0.479
33 HG1 THR 8 HG1 THR 8 -14.162 8.244 2.569
34 HG21 THR 8 3HG2 THR 8 -12.585 10.051 0.507
35 HG22 THR 8 1HG2 THR 8 -13.804 10.319 1.752
36 HG23 THR 8 2HG2 THR 8 -14.204 10.585 0.055
37 H GLY 9 H GLY 9 -15.618 7.652 -2.958
38 HA2 GLY 9 1HA GLY 9 -14.835 8.460 -5.036
39 HA3 GLY 9 2HA GLY 9 -13.462 9.184 -4.210
40 H GLU 10 H GLU 10 -11.775 8.326 -5.293
41 HA GLU 10 HA GLU 10 -11.331 5.463 -4.977
42 HB2 GLU 10 1HB GLU 10 -11.436 6.884 -7.628
43 HB3 GLU 10 2HB GLU 10 -10.499 5.413 -7.411
44 HG2 GLU 10 1HG GLU 10 -12.363 4.101 -7.125
45 HG3 GLU 10 2HG GLU 10 -13.364 5.453 -6.598
46 H LYS 11 H LYS 11 -9.390 5.226 -4.112
47 HA LYS 11 HA LYS 11 -7.527 7.239 -3.728
48 HB2 LYS 11 1HB LYS 11 -7.452 4.266 -3.574
49 HB3 LYS 11 2HB LYS 11 -5.917 5.123 -3.550
50 HG2 LYS 11 1HG LYS 11 -6.668 4.699 -1.298
51 HG3 LYS 11 2HG LYS 11 -6.692 6.433 -1.625
52 HD2 LYS 11 1HD LYS 11 -9.178 4.881 -2.129
53 HD3 LYS 11 2HD LYS 11 -8.725 5.200 -0.453
54 HE2 LYS 11 1HE LYS 11 -8.531 7.621 -1.061
55 HE3 LYS 11 2HE LYS 11 -9.205 7.218 -2.640
56 HZ1 LYS 11 3HZ LYS 11 -10.510 7.181 -0.003
57 HZ2 LYS 11 1HZ LYS 11 -11.087 6.173 -1.234
58 HZ3 LYS 11 2HZ LYS 11 -11.056 7.849 -1.458
59 HA PRO 12 HA PRO 12 -5.245 7.698 -7.448
60 HB2 PRO 12 1HB PRO 12 -2.726 8.095 -6.515
61 HB3 PRO 12 2HB PRO 12 -4.007 9.304 -6.367
62 HG2 PRO 12 1HG PRO 12 -3.002 7.350 -4.334
63 HG3 PRO 12 2HG PRO 12 -3.418 9.062 -4.131
64 HD2 PRO 12 1HD PRO 12 -5.090 7.060 -3.402
65 HD3 PRO 12 2HD PRO 12 -5.677 8.627 -3.995
66 H TYR 13 H TYR 13 -3.443 5.668 -5.126
67 HA TYR 13 HA TYR 13 -2.599 3.972 -7.376
68 HB2 TYR 13 1HB TYR 13 -1.421 3.938 -4.601
69 HB3 TYR 13 2HB TYR 13 -0.721 3.309 -6.088
70 HD1 TYR 13 HD1 TYR 13 0.317 4.807 -7.708
71 HD2 TYR 13 HD2 TYR 13 -1.319 6.300 -4.076
72 HE1 TYR 13 HE1 TYR 13 1.516 6.928 -8.047
73 HE2 TYR 13 HE2 TYR 13 -0.126 8.426 -4.405
74 HH TYR 13 HH TYR 13 1.998 9.166 -5.672
75 H GLU 14 H GLU 14 -3.052 1.822 -7.419
76 HA GLU 14 HA GLU 14 -4.356 0.602 -5.103
77 HB2 GLU 14 1HB GLU 14 -6.084 1.557 -6.707
78 HB3 GLU 14 2HB GLU 14 -5.536 0.355 -7.867
79 HG2 GLU 14 1HG GLU 14 -6.213 -1.434 -6.428
80 HG3 GLU 14 2HG GLU 14 -6.593 -0.305 -5.129
81 H CYS 15 H CYS 15 -3.936 -1.541 -4.852
82 HA CYS 15 HA CYS 15 -1.896 -2.670 -6.580
83 HB2 CYS 15 1HB CYS 15 -1.654 -2.828 -4.136
84 HB3 CYS 15 2HB CYS 15 -3.146 -3.759 -4.048
85 H SER 16 H SER 16 -2.428 -3.816 -8.308
86 HA SER 16 HA SER 16 -5.068 -4.980 -8.561
87 HB2 SER 16 1HB SER 16 -2.732 -4.953 -10.487
88 HB3 SER 16 2HB SER 16 -4.358 -5.522 -10.863
89 HG SER 16 HG SER 16 -3.602 -3.174 -11.291
90 H ILE 17 H ILE 17 -3.293 -6.102 -6.563
91 HA ILE 17 HA ILE 17 -3.013 -8.832 -7.643
92 HB ILE 17 HB ILE 17 -1.393 -7.618 -5.401
93 HG12 ILE 17 1HG1 ILE 17 -0.421 -8.362 -8.160
94 HG13 ILE 17 2HG1 ILE 17 -0.947 -6.733 -7.748
95 HG21 ILE 17 1HG2 ILE 17 -1.370 -10.310 -6.737
96 HG22 ILE 17 2HG2 ILE 17 0.000 -9.700 -5.812
97 HG23 ILE 17 3HG2 ILE 17 -1.559 -9.937 -5.024
98 HD11 ILE 17 3HD1 ILE 17 0.994 -7.803 -5.869
99 HD12 ILE 17 1HD1 ILE 17 1.600 -7.715 -7.523
100 HD13 ILE 17 2HD1 ILE 17 0.975 -6.266 -6.734
101 H CYS 18 H CYS 18 -3.181 -7.245 -4.449
102 HA CYS 18 HA CYS 18 -4.926 -9.410 -3.530
103 HB2 CYS 18 1HB CYS 18 -4.440 -8.579 -1.267
104 HB3 CYS 18 2HB CYS 18 -2.960 -8.932 -2.153
105 H GLY 19 H GLY 19 -4.772 -5.872 -3.701
106 HA2 GLY 19 1HA GLY 19 -6.928 -4.838 -4.434
107 HA3 GLY 19 2HA GLY 19 -7.683 -5.822 -3.189
108 H LYS 20 H LYS 20 -4.621 -4.110 -2.879
109 HA LYS 20 HA LYS 20 -5.763 -2.611 -0.638
110 HB2 LYS 20 1HB LYS 20 -3.031 -3.515 -1.389
111 HB3 LYS 20 2HB LYS 20 -3.162 -2.019 -0.473
112 HG2 LYS 20 1HG LYS 20 -4.739 -3.519 1.037
113 HG3 LYS 20 2HG LYS 20 -3.751 -4.806 0.342
114 HD2 LYS 20 1HD LYS 20 -2.664 -4.174 2.339
115 HD3 LYS 20 2HD LYS 20 -1.732 -3.433 1.036
116 HE2 LYS 20 1HE LYS 20 -1.932 -1.712 2.582
117 HE3 LYS 20 2HE LYS 20 -3.233 -1.374 1.442
118 HZ1 LYS 20 3HZ LYS 20 -4.020 -1.152 3.694
119 HZ2 LYS 20 1HZ LYS 20 -3.517 -2.722 4.072
120 HZ3 LYS 20 2HZ LYS 20 -4.774 -2.480 2.967
121 H SER 21 H SER 21 -5.004 -0.344 -0.346
122 HA SER 21 HA SER 21 -4.506 1.045 -2.882
123 HB2 SER 21 1HB SER 21 -6.280 2.581 -2.584
124 HB3 SER 21 2HB SER 21 -6.991 1.003 -2.247
125 HG SER 21 HG SER 21 -6.201 1.688 0.051
126 H PHE 22 H PHE 22 -3.101 2.697 -2.734
127 HA PHE 22 HA PHE 22 -2.391 3.677 -0.052
128 HB2 PHE 22 1HB PHE 22 -0.431 3.087 -2.280
129 HB3 PHE 22 2HB PHE 22 -0.034 3.705 -0.680
130 HD1 PHE 22 HD1 PHE 22 -1.522 0.787 -2.425
131 HD2 PHE 22 HD2 PHE 22 0.423 2.243 1.069
132 HE1 PHE 22 HE1 PHE 22 -1.282 -1.519 -1.601
133 HE2 PHE 22 HE2 PHE 22 0.667 -0.060 1.898
134 HZ PHE 22 HZ PHE 22 -0.186 -1.945 0.562
135 H THR 23 H THR 23 -1.213 5.773 -0.113
136 HA THR 23 HA THR 23 -2.145 7.432 -2.366
137 HB THR 23 HB THR 23 -2.157 9.328 -0.656
138 HG1 THR 23 HG1 THR 23 -2.299 8.699 1.506
139 HG21 THR 23 3HG2 THR 23 -4.339 8.980 -0.975
140 HG22 THR 23 1HG2 THR 23 -4.310 7.933 0.443
141 HG23 THR 23 2HG2 THR 23 -4.095 7.245 -1.167
142 H LYS 24 H LYS 24 0.491 6.041 -1.668
143 HA LYS 24 HA LYS 24 2.173 8.285 -2.420
144 HB2 LYS 24 1HB LYS 24 2.332 6.904 0.209
145 HB3 LYS 24 2HB LYS 24 3.850 7.291 -0.591
146 HG2 LYS 24 1HG LYS 24 3.329 9.619 -0.610
147 HG3 LYS 24 2HG LYS 24 1.686 9.309 -0.042
148 HD2 LYS 24 1HD LYS 24 2.732 9.941 1.912
149 HD3 LYS 24 2HD LYS 24 2.908 8.186 1.977
150 HE2 LYS 24 1HE LYS 24 5.166 8.413 1.002
151 HE3 LYS 24 2HE LYS 24 4.982 10.166 1.040
152 HZ1 LYS 24 3HZ LYS 24 6.080 9.799 2.991
153 HZ2 LYS 24 1HZ LYS 24 5.364 8.290 3.261
154 HZ3 LYS 24 2HZ LYS 24 4.484 9.706 3.545
155 H LYS 25 H LYS 25 3.141 7.556 -4.189
156 HA LYS 25 HA LYS 25 3.330 5.069 -5.200
157 HB2 LYS 25 1HB LYS 25 5.096 7.454 -5.412
158 HB3 LYS 25 2HB LYS 25 5.709 5.937 -6.057
159 HG2 LYS 25 1HG LYS 25 3.664 5.752 -7.441
160 HG3 LYS 25 2HG LYS 25 3.169 7.342 -6.858
161 HD2 LYS 25 1HD LYS 25 5.761 6.788 -8.299
162 HD3 LYS 25 2HD LYS 25 4.294 7.381 -9.082
163 HE2 LYS 25 1HE LYS 25 4.335 9.335 -7.550
164 HE3 LYS 25 2HE LYS 25 5.875 8.758 -6.914
165 HZ1 LYS 25 3HZ LYS 25 6.868 9.024 -9.065
166 HZ2 LYS 25 1HZ LYS 25 6.116 10.478 -8.638
167 HZ3 LYS 25 2HZ LYS 25 5.385 9.445 -9.760
168 H SER 26 H SER 26 5.546 6.464 -2.823
169 HA SER 26 HA SER 26 7.384 4.339 -2.747
170 HB2 SER 26 1HB SER 26 7.651 6.669 -1.744
171 HB3 SER 26 2HB SER 26 6.684 6.089 -0.388
172 HG SER 26 HG SER 26 8.448 5.251 0.354
173 H GLN 27 H GLN 27 4.522 5.010 -0.751
174 HA GLN 27 HA GLN 27 4.727 2.826 0.970
175 HB2 GLN 27 1HB GLN 27 2.241 4.208 -0.052
176 HB3 GLN 27 2HB GLN 27 2.290 3.113 1.322
177 HG2 GLN 27 1HG GLN 27 3.868 5.667 1.158
178 HG3 GLN 27 2HG GLN 27 2.276 5.534 1.906
179 HE21 GLN 27 1HE2 GLN 27 2.583 5.695 4.014
180 HE22 GLN 27 2HE2 GLN 27 3.733 4.799 4.940
181 H LEU 28 H LEU 28 3.081 3.107 -2.160
182 HA LEU 28 HA LEU 28 2.002 0.502 -2.186
183 HB2 LEU 28 1HB LEU 28 1.119 2.155 -3.659
184 HB3 LEU 28 2HB LEU 28 2.697 2.419 -4.400
185 HG LEU 28 HG LEU 28 2.495 -0.034 -5.177
186 HD11 LEU 28 1HD1 LEU 28 0.046 -0.601 -5.586
187 HD12 LEU 28 2HD1 LEU 28 -0.319 0.583 -4.331
188 HD13 LEU 28 3HD1 LEU 28 0.664 -0.832 -3.950
189 HD21 LEU 28 3HD2 LEU 28 1.041 2.346 -6.245
190 HD22 LEU 28 1HD2 LEU 28 0.882 0.786 -7.054
191 HD23 LEU 28 2HD2 LEU 28 2.472 1.527 -6.872
192 H HIS 29 H HIS 29 5.005 1.831 -3.531
193 HA HIS 29 HA HIS 29 5.951 -0.406 -4.855
194 HB2 HIS 29 1HB HIS 29 7.468 1.732 -3.353
195 HB3 HIS 29 2HB HIS 29 8.241 0.532 -4.385
196 HD2 HIS 29 HD2 HIS 29 5.732 0.927 -6.729
197 HE1 HIS 29 HE1 HIS 29 7.622 4.709 -7.078
198 HE2 HIS 29 HE2 HIS 29 5.991 3.095 -8.116
199 H VAL 30 H VAL 30 6.426 0.493 -1.449
200 HA VAL 30 HA VAL 30 7.962 -1.798 -0.785
201 HB VAL 30 HB VAL 30 6.347 0.026 1.002
202 HG11 VAL 30 1HG1 VAL 30 7.863 -2.403 1.548
203 HG12 VAL 30 2HG1 VAL 30 8.390 -1.021 2.510
204 HG13 VAL 30 3HG1 VAL 30 6.704 -1.539 2.558
205 HG21 VAL 30 3HG2 VAL 30 9.327 0.027 0.648
206 HG22 VAL 30 1HG2 VAL 30 8.270 0.972 -0.401
207 HG23 VAL 30 2HG2 VAL 30 8.295 1.280 1.335
208 H HIS 31 H HIS 31 4.662 -1.385 -1.407
209 HA HIS 31 HA HIS 31 3.795 -3.585 0.283
210 HB2 HIS 31 1HB HIS 31 2.195 -1.858 0.164
211 HB3 HIS 31 2HB HIS 31 2.375 -1.694 -1.580
212 HD1 HIS 31 HD1 HIS 31 0.976 -4.130 0.965
213 HD2 HIS 31 HD2 HIS 31 0.577 -3.124 -3.046
214 HE1 HIS 31 HE1 HIS 31 -0.970 -5.483 0.122
215 H GLN 32 H GLN 32 4.297 -2.878 -3.137
216 HA GLN 32 HA GLN 32 3.196 -5.153 -4.272
217 HB2 GLN 32 1HB GLN 32 5.645 -3.605 -5.131
218 HB3 GLN 32 2HB GLN 32 4.817 -4.793 -6.128
219 HG2 GLN 32 1HG GLN 32 2.735 -3.347 -5.799
220 HG3 GLN 32 2HG GLN 32 3.849 -2.108 -5.223
221 HE21 GLN 32 1HE2 GLN 32 2.659 -1.152 -7.194
222 HE22 GLN 32 2HE2 GLN 32 3.494 -1.292 -8.699
223 H GLN 33 H GLN 33 6.216 -4.742 -2.569
224 HA GLN 33 HA GLN 33 7.441 -7.159 -3.392
225 HB2 GLN 33 1HB GLN 33 8.861 -6.828 -1.346
226 HB3 GLN 33 2HB GLN 33 8.821 -5.457 -2.447
227 HG2 GLN 33 1HG GLN 33 7.685 -4.134 -0.988
228 HG3 GLN 33 2HG GLN 33 6.869 -5.493 -0.217
229 HE21 GLN 33 1HE2 GLN 33 9.788 -3.602 -0.357
230 HE22 GLN 33 2HE2 GLN 33 10.452 -4.148 1.142
231 H ILE 34 H ILE 34 4.914 -6.459 -1.186
232 HA ILE 34 HA ILE 34 5.200 -8.642 0.585
233 HB ILE 34 HB ILE 34 3.659 -6.540 0.744
234 HG12 ILE 34 1HG1 ILE 34 2.719 -9.270 1.652
235 HG13 ILE 34 2HG1 ILE 34 3.903 -8.267 2.482
236 HG21 ILE 34 1HG2 ILE 34 1.580 -6.602 -0.180
237 HG22 ILE 34 2HG2 ILE 34 2.450 -7.530 -1.400
238 HG23 ILE 34 3HG2 ILE 34 1.504 -8.363 -0.167
239 HD11 ILE 34 3HD1 ILE 34 2.333 -6.888 3.340
240 HD12 ILE 34 1HD1 ILE 34 1.263 -7.055 1.948
241 HD13 ILE 34 2HD1 ILE 34 1.338 -8.333 3.161
242 H HIS 35 H HIS 35 4.420 -8.549 -2.685
243 HA HIS 35 HA HIS 35 3.173 -11.216 -2.528
244 HB2 HIS 35 1HB HIS 35 2.817 -9.393 -4.888
245 HB3 HIS 35 2HB HIS 35 1.810 -10.741 -4.369
246 HD1 HIS 35 HD1 HIS 35 0.477 -10.256 -2.020
247 HD2 HIS 35 HD2 HIS 35 1.869 -6.967 -4.143
248 HE1 HIS 35 HE1 HIS 35 -0.826 -8.291 -1.145
249 H THR 36 H THR 36 5.959 -10.829 -2.511
250 HA THR 36 HA THR 36 6.769 -11.602 -5.231
251 HB THR 36 HB THR 36 8.818 -11.072 -3.141
252 HG1 THR 36 HG1 THR 36 8.602 -8.793 -3.579
253 HG21 THR 36 3HG2 THR 36 9.131 -11.683 -5.651
254 HG22 THR 36 1HG2 THR 36 10.137 -10.424 -4.937
255 HG23 THR 36 2HG2 THR 36 8.748 -9.985 -5.930
256 H GLY 37 H GLY 37 8.023 -13.454 -5.578
257 HA2 GLY 37 1HA GLY 37 7.469 -15.617 -3.765
258 HA3 GLY 37 2HA GLY 37 8.341 -15.727 -5.287
259 H GLU 38 H GLU 38 8.713 -14.495 -1.969
260 HA GLU 38 HA GLU 38 11.513 -15.403 -2.065
261 HB2 GLU 38 1HB GLU 38 10.439 -12.912 -0.732
262 HB3 GLU 38 2HB GLU 38 12.084 -13.510 -0.563
263 HG2 GLU 38 1HG GLU 38 12.605 -13.041 -2.796
264 HG3 GLU 38 2HG GLU 38 10.909 -12.858 -3.241
265 H LYS 39 H LYS 39 10.804 -17.373 -1.105
266 HA LYS 39 HA LYS 39 10.304 -18.796 0.605
267 HB2 LYS 39 1HB LYS 39 12.429 -17.718 1.397
268 HB3 LYS 39 2HB LYS 39 11.449 -16.599 2.336
269 HG2 LYS 39 1HG LYS 39 10.424 -18.808 3.310
270 HG3 LYS 39 2HG LYS 39 11.952 -19.500 2.760
271 HD2 LYS 39 1HD LYS 39 13.028 -17.500 4.002
272 HD3 LYS 39 2HD LYS 39 11.469 -17.378 4.820
273 HE2 LYS 39 1HE LYS 39 12.727 -18.740 6.232
274 HE3 LYS 39 2HE LYS 39 11.759 -19.884 5.304
275 HZ1 LYS 39 3HZ LYS 39 14.416 -20.046 5.612
276 HZ2 LYS 39 1HZ LYS 39 14.318 -19.235 4.130
277 HZ3 LYS 39 2HZ LYS 39 13.565 -20.737 4.323
278 HA PRO 40 HA PRO 40 6.559 -16.167 1.782
279 HB2 PRO 40 1HB PRO 40 4.750 -17.484 0.245
280 HB3 PRO 40 2HB PRO 40 5.670 -16.090 -0.335
281 HG2 PRO 40 1HG PRO 40 6.164 -19.008 -0.790
282 HG3 PRO 40 2HG PRO 40 6.262 -17.663 -1.942
283 HD2 PRO 40 1HD PRO 40 8.453 -18.747 -0.778
284 HD3 PRO 40 2HD PRO 40 8.356 -17.030 -1.218
285 H SER 41 H SER 41 4.385 -17.141 2.554
286 HA SER 41 HA SER 41 4.840 -19.797 3.740
287 HB2 SER 41 1HB SER 41 3.724 -17.353 5.136
288 HB3 SER 41 2HB SER 41 3.744 -18.978 5.820
289 HG SER 41 HG SER 41 6.053 -18.911 5.591
290 H GLY 42 H GLY 42 2.880 -20.927 4.376
291 HA2 GLY 42 1HA GLY 42 0.796 -20.558 2.409
292 HA3 GLY 42 2HA GLY 42 0.907 -21.860 3.584
293 HA PRO 43 HA PRO 43 -2.050 -18.266 4.851
294 HB2 PRO 43 1HB PRO 43 -4.364 -19.018 3.647
295 HB3 PRO 43 2HB PRO 43 -3.209 -17.908 2.900
296 HG2 PRO 43 1HG PRO 43 -3.591 -20.841 2.435
297 HG3 PRO 43 2HG PRO 43 -3.321 -19.547 1.253
298 HD2 PRO 43 1HD PRO 43 -1.343 -21.202 2.079
299 HD3 PRO 43 2HD PRO 43 -1.046 -19.512 1.624
300 H SER 44 H SER 44 -2.262 -18.937 6.913
301 HA SER 44 HA SER 44 -3.035 -21.544 7.690
302 HB2 SER 44 1HB SER 44 -1.776 -19.649 9.012
303 HB3 SER 44 2HB SER 44 -3.405 -19.197 9.515
304 HG SER 44 HG SER 44 -3.661 -21.187 10.451
305 H SER 45 H SER 45 -4.973 -22.410 8.211
306 HA SER 45 HA SER 45 -7.314 -21.510 7.090
307 HB2 SER 45 1HB SER 45 -6.954 -23.808 7.955
308 HB3 SER 45 2HB SER 45 -7.092 -23.189 9.601
309 HG SER 45 HG SER 45 -9.050 -23.689 7.728
310 H GLY 46 H GLY 46 -9.063 -20.307 7.743
311 HA2 GLY 46 1HA GLY 46 -8.814 -18.921 10.337
312 HA3 GLY 46 2HA GLY 46 -9.174 -18.032 8.865