Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
504597 | 2emf RC | 10183 | 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 -1.571 -29.012 -12.221
2 HA2 GLY 1 1HA GLY 1 -2.204 -27.323 -13.883
3 HA3 GLY 1 2HA GLY 1 -3.641 -28.172 -13.330
4 H SER 2 H SER 2 -4.756 -26.214 -14.037
5 HA SER 2 HA SER 2 -4.373 -23.865 -12.350
6 HB2 SER 2 1HB SER 2 -4.754 -23.811 -14.908
7 HB3 SER 2 2HB SER 2 -6.445 -24.123 -14.518
8 HG SER 2 HG SER 2 -5.986 -21.881 -14.681
9 H SER 3 H SER 3 -5.638 -23.367 -10.679
10 HA SER 3 HA SER 3 -8.131 -24.901 -10.325
11 HB2 SER 3 1HB SER 3 -6.259 -23.872 -8.178
12 HB3 SER 3 2HB SER 3 -7.766 -24.743 -7.895
13 HG SER 3 HG SER 3 -5.345 -25.741 -8.364
14 H GLY 4 H GLY 4 -6.525 -21.874 -9.326
15 HA2 GLY 4 1HA GLY 4 -9.185 -20.607 -9.212
16 HA3 GLY 4 2HA GLY 4 -7.759 -20.040 -8.355
17 H SER 5 H SER 5 -8.977 -18.121 -9.614
18 HA SER 5 HA SER 5 -7.473 -17.743 -12.121
19 HB2 SER 5 1HB SER 5 -10.265 -16.856 -11.395
20 HB3 SER 5 2HB SER 5 -9.366 -16.140 -12.733
21 HG SER 5 HG SER 5 -10.078 -17.769 -13.841
22 H SER 6 H SER 6 -9.202 -15.818 -9.662
23 HA SER 6 HA SER 6 -6.863 -14.033 -9.551
24 HB2 SER 6 1HB SER 6 -9.783 -13.282 -9.699
25 HB3 SER 6 2HB SER 6 -8.544 -12.161 -9.134
26 HG SER 6 HG SER 6 -9.091 -13.061 -11.685
27 H GLY 7 H GLY 7 -6.201 -15.227 -7.687
28 HA2 GLY 7 1HA GLY 7 -5.957 -15.417 -5.409
29 HA3 GLY 7 2HA GLY 7 -7.102 -14.094 -5.248
30 H THR 8 H THR 8 -7.991 -15.162 -3.413
31 HA THR 8 HA THR 8 -9.368 -17.691 -3.891
32 HB THR 8 HB THR 8 -9.922 -17.575 -1.456
33 HG1 THR 8 HG1 THR 8 -9.439 -15.831 -0.340
34 HG21 THR 8 3HG2 THR 8 -7.397 -18.032 -2.691
35 HG22 THR 8 1HG2 THR 8 -8.063 -18.782 -1.241
36 HG23 THR 8 2HG2 THR 8 -7.117 -17.299 -1.112
37 H GLY 9 H GLY 9 -10.133 -14.400 -2.758
38 HA2 GLY 9 1HA GLY 9 -12.606 -14.348 -4.171
39 HA3 GLY 9 2HA GLY 9 -12.870 -14.652 -2.460
40 H GLY 10 H GLY 10 -11.047 -13.073 -1.229
41 HA2 GLY 10 1HA GLY 10 -12.230 -10.592 -1.115
42 HA3 GLY 10 2HA GLY 10 -10.574 -10.907 -0.619
43 H LYS 11 H LYS 11 -11.982 -8.632 -2.069
44 HA LYS 11 HA LYS 11 -10.599 -8.611 -4.629
45 HB2 LYS 11 1HB LYS 11 -12.697 -6.948 -3.325
46 HB3 LYS 11 2HB LYS 11 -11.689 -6.179 -4.543
47 HG2 LYS 11 1HG LYS 11 -13.402 -6.925 -5.846
48 HG3 LYS 11 2HG LYS 11 -12.316 -8.314 -5.942
49 HD2 LYS 11 1HD LYS 11 -13.634 -9.608 -4.568
50 HD3 LYS 11 2HD LYS 11 -14.347 -8.210 -3.759
51 HE2 LYS 11 1HE LYS 11 -15.651 -7.704 -5.749
52 HE3 LYS 11 2HE LYS 11 -14.903 -9.053 -6.602
53 HZ1 LYS 11 3HZ LYS 11 -16.226 -10.529 -5.589
54 HZ2 LYS 11 1HZ LYS 11 -17.225 -9.201 -5.273
55 HZ3 LYS 11 2HZ LYS 11 -16.150 -9.751 -4.089
56 H HIS 12 H HIS 12 -8.444 -8.636 -3.743
57 HA HIS 12 HA HIS 12 -7.605 -6.168 -2.403
58 HB2 HIS 12 1HB HIS 12 -5.780 -7.314 -1.574
59 HB3 HIS 12 2HB HIS 12 -6.961 -8.616 -1.682
60 HD1 HIS 12 HD1 HIS 12 -6.340 -10.590 -3.085
61 HD2 HIS 12 HD2 HIS 12 -3.865 -7.323 -3.764
62 HE1 HIS 12 HE1 HIS 12 -4.504 -11.438 -4.580
63 H PHE 13 H PHE 13 -6.604 -4.601 -3.478
64 HA PHE 13 HA PHE 13 -5.700 -5.148 -6.216
65 HB2 PHE 13 1HB PHE 13 -6.315 -2.510 -4.867
66 HB3 PHE 13 2HB PHE 13 -5.841 -2.711 -6.551
67 HD1 PHE 13 HD2 PHE 13 -8.460 -3.685 -4.103
68 HD2 PHE 13 HD1 PHE 13 -7.450 -3.044 -8.188
69 HE1 PHE 13 HE2 PHE 13 -10.822 -3.971 -4.729
70 HE2 PHE 13 HE1 PHE 13 -9.811 -3.327 -8.820
71 HZ PHE 13 HZ PHE 13 -11.500 -3.793 -7.090
72 H GLU 14 H GLU 14 -3.599 -5.296 -6.607
73 HA GLU 14 HA GLU 14 -1.705 -4.359 -4.588
74 HB2 GLU 14 1HB GLU 14 -1.570 -6.697 -5.458
75 HB3 GLU 14 2HB GLU 14 -1.181 -6.042 -7.043
76 HG2 GLU 14 1HG GLU 14 0.870 -5.130 -6.247
77 HG3 GLU 14 2HG GLU 14 0.454 -5.511 -4.577
78 H CYS 15 H CYS 15 0.169 -3.141 -5.172
79 HA CYS 15 HA CYS 15 -0.406 -1.164 -7.220
80 HB2 CYS 15 1HB CYS 15 0.381 -0.527 -4.925
81 HB3 CYS 15 2HB CYS 15 1.931 -1.269 -5.306
82 H THR 16 H THR 16 0.278 -1.432 -9.229
83 HA THR 16 HA THR 16 2.107 -3.412 -10.038
84 HB THR 16 HB THR 16 2.106 -2.199 -12.243
85 HG1 THR 16 HG1 THR 16 0.855 -0.371 -12.444
86 HG21 THR 16 3HG2 THR 16 0.422 -3.658 -12.477
87 HG22 THR 16 1HG2 THR 16 -0.650 -2.297 -12.151
88 HG23 THR 16 2HG2 THR 16 -0.164 -3.370 -10.839
89 H GLU 17 H GLU 17 2.616 -0.335 -8.698
90 HA GLU 17 HA GLU 17 5.153 0.185 -9.953
91 HB2 GLU 17 1HB GLU 17 3.939 1.434 -7.482
92 HB3 GLU 17 2HB GLU 17 5.318 2.049 -8.382
93 HG2 GLU 17 1HG GLU 17 2.635 1.685 -9.665
94 HG3 GLU 17 2HG GLU 17 3.053 3.147 -8.772
95 H CYS 18 H CYS 18 4.302 -0.346 -6.528
96 HA CYS 18 HA CYS 18 6.978 -1.455 -6.096
97 HB2 CYS 18 1HB CYS 18 6.446 -1.202 -3.685
98 HB3 CYS 18 2HB CYS 18 6.338 0.317 -4.570
99 H GLY 19 H GLY 19 3.558 -2.223 -5.526
100 HA2 GLY 19 1HA GLY 19 2.885 -4.531 -6.084
101 HA3 GLY 19 2HA GLY 19 4.354 -5.058 -5.277
102 H LYS 20 H LYS 20 2.661 -2.448 -3.830
103 HA LYS 20 HA LYS 20 2.156 -3.990 -1.468
104 HB2 LYS 20 1HB LYS 20 2.794 -1.504 -1.620
105 HB3 LYS 20 2HB LYS 20 1.101 -1.221 -2.002
106 HG2 LYS 20 1HG LYS 20 0.385 -1.838 0.106
107 HG3 LYS 20 2HG LYS 20 1.846 -2.770 0.441
108 HD2 LYS 20 1HD LYS 20 3.138 -0.779 0.716
109 HD3 LYS 20 2HD LYS 20 1.812 0.228 0.130
110 HE2 LYS 20 1HE LYS 20 1.568 0.519 2.385
111 HE3 LYS 20 2HE LYS 20 0.527 -0.883 2.143
112 HZ1 LYS 20 3HZ LYS 20 3.000 -1.950 2.570
113 HZ2 LYS 20 1HZ LYS 20 1.749 -1.856 3.704
114 HZ3 LYS 20 2HZ LYS 20 2.940 -0.656 3.658
115 H ALA 21 H ALA 21 0.356 -5.029 -0.902
116 HA ALA 21 HA ALA 21 -1.947 -4.908 -2.681
117 HB1 ALA 21 3HB ALA 21 -1.117 -6.786 -0.493
118 HB2 ALA 21 1HB ALA 21 -2.737 -6.826 -1.187
119 HB3 ALA 21 2HB ALA 21 -1.331 -7.116 -2.212
120 H PHE 22 H PHE 22 -3.655 -3.686 -2.258
121 HA PHE 22 HA PHE 22 -4.116 -2.828 0.522
122 HB2 PHE 22 1HB PHE 22 -4.935 -1.424 -2.030
123 HB3 PHE 22 2HB PHE 22 -5.196 -0.832 -0.393
124 HD1 PHE 22 HD2 PHE 22 -2.638 -1.565 -2.941
125 HD2 PHE 22 HD1 PHE 22 -3.479 0.270 0.806
126 HE1 PHE 22 HE2 PHE 22 -0.451 -0.440 -3.005
127 HE2 PHE 22 HE1 PHE 22 -1.294 1.399 0.748
128 HZ PHE 22 HZ PHE 22 0.224 1.044 -1.159
129 H THR 23 H THR 23 -6.117 -3.047 1.419
130 HA THR 23 HA THR 23 -7.915 -4.902 0.123
131 HB THR 23 HB THR 23 -7.513 -5.239 2.475
132 HG1 THR 23 HG1 THR 23 -10.124 -4.252 1.905
133 HG21 THR 23 3HG2 THR 23 -6.924 -3.013 3.175
134 HG22 THR 23 1HG2 THR 23 -8.294 -3.556 4.142
135 HG23 THR 23 2HG2 THR 23 -8.546 -2.422 2.814
136 H ARG 24 H ARG 24 -7.517 -1.719 -0.251
137 HA ARG 24 HA ARG 24 -10.368 -1.297 -0.819
138 HB2 ARG 24 1HB ARG 24 -8.498 0.576 0.623
139 HB3 ARG 24 2HB ARG 24 -9.975 1.135 -0.150
140 HG2 ARG 24 1HG ARG 24 -10.099 -1.111 1.809
141 HG3 ARG 24 2HG ARG 24 -9.958 0.552 2.383
142 HD2 ARG 24 1HD ARG 24 -12.226 0.398 2.299
143 HD3 ARG 24 2HD ARG 24 -11.925 0.916 0.641
144 HE ARG 24 HE ARG 24 -12.543 -1.178 -0.107
145 HH11 ARG 24 1HH1 ARG 24 -12.272 -1.172 3.363
146 HH12 ARG 24 2HH1 ARG 24 -13.033 -2.717 3.556
147 HH21 ARG 24 1HH2 ARG 24 -13.546 -3.212 0.133
148 HH22 ARG 24 2HH2 ARG 24 -13.756 -3.877 1.717
149 H LYS 25 H LYS 25 -10.776 -0.499 -2.790
150 HA LYS 25 HA LYS 25 -8.671 -0.230 -4.680
151 HB2 LYS 25 1HB LYS 25 -10.856 -1.050 -5.356
152 HB3 LYS 25 2HB LYS 25 -11.607 0.466 -4.874
153 HG2 LYS 25 1HG LYS 25 -9.928 1.489 -6.607
154 HG3 LYS 25 2HG LYS 25 -9.937 -0.151 -7.258
155 HD2 LYS 25 1HD LYS 25 -12.480 1.343 -6.681
156 HD3 LYS 25 2HD LYS 25 -11.628 1.510 -8.218
157 HE2 LYS 25 1HE LYS 25 -12.363 -1.183 -7.118
158 HE3 LYS 25 2HE LYS 25 -13.514 -0.228 -8.051
159 HZ1 LYS 25 3HZ LYS 25 -12.235 -1.836 -9.395
160 HZ2 LYS 25 1HZ LYS 25 -10.815 -0.996 -9.018
161 HZ3 LYS 25 2HZ LYS 25 -12.035 -0.237 -9.911
162 H SER 26 H SER 26 -10.627 2.051 -2.857
163 HA SER 26 HA SER 26 -9.729 4.365 -4.272
164 HB2 SER 26 1HB SER 26 -10.790 5.624 -2.424
165 HB3 SER 26 2HB SER 26 -11.861 4.384 -3.076
166 HG SER 26 HG SER 26 -10.795 3.079 -1.253
167 H THR 27 H THR 27 -8.795 2.761 -1.265
168 HA THR 27 HA THR 27 -6.989 4.665 -0.310
169 HB THR 27 HB THR 27 -6.906 1.658 0.004
170 HG1 THR 27 HG1 THR 27 -8.772 2.961 0.818
171 HG21 THR 27 3HG2 THR 27 -5.019 1.875 1.167
172 HG22 THR 27 1HG2 THR 27 -5.757 3.104 2.193
173 HG23 THR 27 2HG2 THR 27 -4.953 3.573 0.696
174 H LEU 28 H LEU 28 -6.395 1.828 -2.377
175 HA LEU 28 HA LEU 28 -3.643 2.133 -2.670
176 HB2 LEU 28 1HB LEU 28 -4.448 0.120 -3.446
177 HB3 LEU 28 2HB LEU 28 -5.790 0.869 -4.307
178 HG LEU 28 HG LEU 28 -4.211 1.669 -6.023
179 HD11 LEU 28 1HD1 LEU 28 -1.930 0.743 -6.055
180 HD12 LEU 28 2HD1 LEU 28 -2.193 0.082 -4.442
181 HD13 LEU 28 3HD1 LEU 28 -2.200 1.827 -4.691
182 HD21 LEU 28 3HD2 LEU 28 -5.160 -0.926 -5.610
183 HD22 LEU 28 1HD2 LEU 28 -3.489 -1.115 -6.141
184 HD23 LEU 28 2HD2 LEU 28 -4.632 -0.208 -7.133
185 H SER 29 H SER 29 -6.209 3.232 -4.892
186 HA SER 29 HA SER 29 -4.760 4.504 -6.800
187 HB2 SER 29 1HB SER 29 -7.305 5.526 -5.516
188 HB3 SER 29 2HB SER 29 -6.665 6.071 -7.067
189 HG SER 29 HG SER 29 -6.976 3.332 -6.758
190 H MET 30 H MET 30 -5.338 5.610 -3.525
191 HA MET 30 HA MET 30 -4.225 8.223 -3.960
192 HB2 MET 30 1HB MET 30 -4.956 6.703 -1.457
193 HB3 MET 30 2HB MET 30 -4.297 8.333 -1.435
194 HG2 MET 30 1HG MET 30 -6.228 9.008 -2.902
195 HG3 MET 30 2HG MET 30 -6.914 7.417 -2.585
196 HE1 MET 30 3HE MET 30 -7.739 6.553 -0.623
197 HE2 MET 30 1HE MET 30 -6.636 6.891 0.712
198 HE3 MET 30 2HE MET 30 -8.306 7.453 0.784
199 H HIS 31 H HIS 31 -3.055 5.108 -2.891
200 HA HIS 31 HA HIS 31 -0.568 6.060 -1.857
201 HB2 HIS 31 1HB HIS 31 -1.056 4.000 -0.960
202 HB3 HIS 31 2HB HIS 31 -1.760 3.395 -2.456
203 HD1 HIS 31 HD1 HIS 31 1.616 4.052 -0.883
204 HD2 HIS 31 HD2 HIS 31 -0.075 1.890 -4.003
205 HE1 HIS 31 HE1 HIS 31 3.462 2.592 -1.767
206 H GLN 32 H GLN 32 -1.574 4.577 -4.918
207 HA GLN 32 HA GLN 32 0.881 4.324 -6.154
208 HB2 GLN 32 1HB GLN 32 -1.715 5.152 -7.463
209 HB3 GLN 32 2HB GLN 32 -0.323 4.454 -8.280
210 HG2 GLN 32 1HG GLN 32 -0.613 2.421 -6.857
211 HG3 GLN 32 2HG GLN 32 -2.122 3.122 -6.275
212 HE21 GLN 32 1HE2 GLN 32 -3.916 2.882 -7.455
213 HE22 GLN 32 2HE2 GLN 32 -3.981 2.158 -9.022
214 H LYS 33 H LYS 33 -0.895 7.190 -5.413
215 HA LYS 33 HA LYS 33 0.161 8.970 -7.296
216 HB2 LYS 33 1HB LYS 33 -0.831 9.367 -4.478
217 HB3 LYS 33 2HB LYS 33 -0.293 10.709 -5.478
218 HG2 LYS 33 1HG LYS 33 -1.998 9.789 -7.197
219 HG3 LYS 33 2HG LYS 33 -2.684 8.949 -5.804
220 HD2 LYS 33 1HD LYS 33 -2.509 11.351 -4.717
221 HD3 LYS 33 2HD LYS 33 -2.566 11.862 -6.406
222 HE2 LYS 33 1HE LYS 33 -4.666 10.782 -6.738
223 HE3 LYS 33 2HE LYS 33 -4.570 9.984 -5.169
224 HZ1 LYS 33 3HZ LYS 33 -4.347 12.698 -4.681
225 HZ2 LYS 33 1HZ LYS 33 -5.668 11.698 -4.333
226 HZ3 LYS 33 2HZ LYS 33 -5.606 12.537 -5.800
227 H ILE 34 H ILE 34 1.557 7.559 -4.453
228 HA ILE 34 HA ILE 34 3.637 9.436 -4.040
229 HB ILE 34 HB ILE 34 4.564 7.931 -2.520
230 HG12 ILE 34 1HG1 ILE 34 3.163 5.689 -3.995
231 HG13 ILE 34 2HG1 ILE 34 4.880 6.066 -4.097
232 HG21 ILE 34 1HG2 ILE 34 2.776 8.080 -1.216
233 HG22 ILE 34 2HG2 ILE 34 1.722 8.173 -2.626
234 HG23 ILE 34 3HG2 ILE 34 2.145 6.603 -1.944
235 HD11 ILE 34 3HD1 ILE 34 5.025 5.627 -1.639
236 HD12 ILE 34 1HD1 ILE 34 3.366 5.036 -1.717
237 HD13 ILE 34 2HD1 ILE 34 4.636 4.223 -2.632
238 H HIS 35 H HIS 35 3.200 6.831 -6.278
239 HA HIS 35 HA HIS 35 6.002 6.637 -6.963
240 HB2 HIS 35 1HB HIS 35 3.514 5.408 -8.158
241 HB3 HIS 35 2HB HIS 35 5.133 5.127 -8.793
242 HD1 HIS 35 HD1 HIS 35 6.853 4.209 -6.765
243 HD2 HIS 35 HD2 HIS 35 2.774 3.508 -6.397
244 HE1 HIS 35 HE1 HIS 35 6.642 2.312 -5.128
245 H THR 36 H THR 36 3.098 8.147 -8.242
246 HA THR 36 HA THR 36 4.522 9.118 -10.590
247 HB THR 36 HB THR 36 2.181 8.314 -10.808
248 HG1 THR 36 HG1 THR 36 2.936 9.806 -12.331
249 HG21 THR 36 3HG2 THR 36 1.072 10.804 -9.694
250 HG22 THR 36 1HG2 THR 36 1.687 9.657 -8.505
251 HG23 THR 36 2HG2 THR 36 0.438 9.160 -9.646
252 H GLY 37 H GLY 37 4.878 10.011 -7.644
253 HA2 GLY 37 1HA GLY 37 4.390 12.889 -8.041
254 HA3 GLY 37 2HA GLY 37 4.642 12.108 -6.487
255 H GLU 38 H GLU 38 6.396 12.353 -9.586
256 HA GLU 38 HA GLU 38 8.822 12.963 -8.028
257 HB2 GLU 38 1HB GLU 38 8.386 11.246 -10.431
258 HB3 GLU 38 2HB GLU 38 9.922 12.086 -10.268
259 HG2 GLU 38 1HG GLU 38 8.726 10.050 -8.414
260 HG3 GLU 38 2HG GLU 38 10.208 9.924 -9.360
261 H LYS 39 H LYS 39 10.525 14.021 -9.609
262 HA LYS 39 HA LYS 39 9.971 16.602 -10.039
263 HB2 LYS 39 1HB LYS 39 11.724 14.754 -11.635
264 HB3 LYS 39 2HB LYS 39 11.616 16.463 -12.034
265 HG2 LYS 39 1HG LYS 39 12.321 17.003 -9.724
266 HG3 LYS 39 2HG LYS 39 12.536 15.276 -9.425
267 HD2 LYS 39 1HD LYS 39 13.886 16.464 -11.793
268 HD3 LYS 39 2HD LYS 39 14.544 16.827 -10.195
269 HE2 LYS 39 1HE LYS 39 15.711 14.920 -10.776
270 HE3 LYS 39 2HE LYS 39 14.376 14.260 -9.833
271 HZ1 LYS 39 3HZ LYS 39 15.051 13.361 -12.236
272 HZ2 LYS 39 1HZ LYS 39 13.911 14.526 -12.689
273 HZ3 LYS 39 2HZ LYS 39 13.473 13.281 -11.631
274 HA PRO 40 HA PRO 40 7.013 17.122 -13.243
275 HB2 PRO 40 1HB PRO 40 7.826 19.476 -14.324
276 HB3 PRO 40 2HB PRO 40 7.045 19.364 -12.743
277 HG2 PRO 40 1HG PRO 40 9.955 19.605 -13.406
278 HG3 PRO 40 2HG PRO 40 9.023 20.432 -12.144
279 HD2 PRO 40 1HD PRO 40 10.594 18.288 -11.626
280 HD3 PRO 40 2HD PRO 40 9.103 18.620 -10.721
281 H SER 41 H SER 41 7.271 15.561 -14.784
282 HA SER 41 HA SER 41 9.505 15.445 -16.550
283 HB2 SER 41 1HB SER 41 8.203 13.441 -15.957
284 HB3 SER 41 2HB SER 41 6.794 14.112 -16.777
285 HG SER 41 HG SER 41 7.905 13.985 -18.722
286 H GLY 42 H GLY 42 6.079 16.303 -17.067
287 HA2 GLY 42 1HA GLY 42 6.659 18.477 -18.768
288 HA3 GLY 42 2HA GLY 42 6.315 17.059 -19.749
289 HA PRO 43 HA PRO 43 2.329 18.281 -17.230
290 HB2 PRO 43 1HB PRO 43 2.237 20.899 -16.519
291 HB3 PRO 43 2HB PRO 43 2.881 19.638 -15.460
292 HG2 PRO 43 1HG PRO 43 4.347 21.563 -17.224
293 HG3 PRO 43 2HG PRO 43 4.720 21.058 -15.565
294 HD2 PRO 43 1HD PRO 43 6.000 20.036 -17.722
295 HD3 PRO 43 2HD PRO 43 5.700 19.088 -16.251
296 H SER 44 H SER 44 0.495 19.876 -17.790
297 HA SER 44 HA SER 44 0.892 21.204 -20.361
298 HB2 SER 44 1HB SER 44 0.085 18.702 -20.551
299 HB3 SER 44 2HB SER 44 -1.477 19.390 -20.109
300 HG SER 44 HG SER 44 0.084 20.475 -22.197
301 H SER 45 H SER 45 -1.430 22.104 -21.046
302 HA SER 45 HA SER 45 -2.194 23.848 -18.879
303 HB2 SER 45 1HB SER 45 -1.927 24.641 -21.239
304 HB3 SER 45 2HB SER 45 -3.352 23.696 -21.672
305 HG SER 45 HG SER 45 -3.466 26.098 -20.963
306 H GLY 46 H GLY 46 -2.861 21.428 -18.007
307 HA2 GLY 46 1HA GLY 46 -5.794 21.323 -18.360
308 HA3 GLY 46 2HA GLY 46 -4.813 19.879 -18.155
Start of MODEL 2
1 H1 GLY 1 H GLY 1 6.336 -28.924 -5.431
2 HA2 GLY 1 1HA GLY 1 5.844 -31.521 -6.016
3 HA3 GLY 1 2HA GLY 1 5.970 -31.540 -4.263
4 H SER 2 H SER 2 4.653 -29.618 -3.243
5 HA SER 2 HA SER 2 1.956 -29.808 -4.397
6 HB2 SER 2 1HB SER 2 2.817 -29.194 -1.560
7 HB3 SER 2 2HB SER 2 1.147 -29.283 -2.119
8 HG SER 2 HG SER 2 2.824 -31.280 -1.409
9 H SER 3 H SER 3 2.096 -28.091 -5.848
10 HA SER 3 HA SER 3 2.364 -25.425 -4.619
11 HB2 SER 3 1HB SER 3 4.131 -25.860 -6.260
12 HB3 SER 3 2HB SER 3 2.919 -26.249 -7.480
13 HG SER 3 HG SER 3 3.325 -23.742 -6.212
14 H GLY 4 H GLY 4 0.367 -24.690 -4.236
15 HA2 GLY 4 1HA GLY 4 -1.378 -24.049 -6.370
16 HA3 GLY 4 2HA GLY 4 -1.979 -25.466 -5.522
17 H SER 5 H SER 5 -2.984 -25.233 -3.583
18 HA SER 5 HA SER 5 -4.242 -24.155 -2.013
19 HB2 SER 5 1HB SER 5 -2.034 -24.016 -0.950
20 HB3 SER 5 2HB SER 5 -1.711 -22.504 -1.798
21 HG SER 5 HG SER 5 -3.804 -21.849 -0.686
22 H SER 6 H SER 6 -4.788 -23.293 -4.607
23 HA SER 6 HA SER 6 -4.754 -20.493 -4.925
24 HB2 SER 6 1HB SER 6 -6.464 -20.875 -6.670
25 HB3 SER 6 2HB SER 6 -5.117 -22.004 -6.815
26 HG SER 6 HG SER 6 -6.569 -23.409 -5.444
27 H GLY 7 H GLY 7 -6.729 -19.108 -5.021
28 HA2 GLY 7 1HA GLY 7 -9.097 -18.984 -4.198
29 HA3 GLY 7 2HA GLY 7 -8.484 -19.717 -2.723
30 H THR 8 H THR 8 -9.883 -17.311 -2.727
31 HA THR 8 HA THR 8 -7.963 -15.613 -1.415
32 HB THR 8 HB THR 8 -7.708 -14.894 -3.768
33 HG1 THR 8 HG1 THR 8 -7.748 -12.771 -3.227
34 HG21 THR 8 3HG2 THR 8 -9.708 -13.524 -4.657
35 HG22 THR 8 1HG2 THR 8 -10.669 -14.471 -3.523
36 HG23 THR 8 2HG2 THR 8 -9.765 -15.280 -4.803
37 H GLY 9 H GLY 9 -8.965 -13.856 -0.240
38 HA2 GLY 9 1HA GLY 9 -11.518 -14.606 0.819
39 HA3 GLY 9 2HA GLY 9 -10.569 -13.202 1.285
40 H GLY 10 H GLY 10 -10.830 -11.242 0.152
41 HA2 GLY 10 1HA GLY 10 -13.396 -11.097 -1.292
42 HA3 GLY 10 2HA GLY 10 -12.664 -9.774 -0.397
43 H LYS 11 H LYS 11 -11.682 -8.265 -1.558
44 HA LYS 11 HA LYS 11 -10.396 -8.996 -4.082
45 HB2 LYS 11 1HB LYS 11 -11.437 -6.787 -5.003
46 HB3 LYS 11 2HB LYS 11 -12.384 -8.269 -5.019
47 HG2 LYS 11 1HG LYS 11 -13.775 -7.563 -3.331
48 HG3 LYS 11 2HG LYS 11 -12.588 -6.429 -2.682
49 HD2 LYS 11 1HD LYS 11 -12.888 -5.049 -4.739
50 HD3 LYS 11 2HD LYS 11 -14.194 -6.135 -5.219
51 HE2 LYS 11 1HE LYS 11 -14.251 -4.864 -2.518
52 HE3 LYS 11 2HE LYS 11 -14.714 -3.917 -3.931
53 HZ1 LYS 11 3HZ LYS 11 -15.925 -6.512 -3.145
54 HZ2 LYS 11 1HZ LYS 11 -16.391 -5.552 -4.458
55 HZ3 LYS 11 2HZ LYS 11 -16.618 -4.993 -2.878
56 H HIS 12 H HIS 12 -8.362 -8.354 -3.858
57 HA HIS 12 HA HIS 12 -7.845 -5.771 -2.534
58 HB2 HIS 12 1HB HIS 12 -5.899 -6.611 -1.565
59 HB3 HIS 12 2HB HIS 12 -7.005 -7.975 -1.445
60 HD1 HIS 12 HD1 HIS 12 -6.414 -10.086 -2.732
61 HD2 HIS 12 HD2 HIS 12 -3.832 -6.921 -3.493
62 HE1 HIS 12 HE1 HIS 12 -4.489 -11.080 -4.010
63 H PHE 13 H PHE 13 -6.402 -4.356 -3.477
64 HA PHE 13 HA PHE 13 -5.637 -5.008 -6.243
65 HB2 PHE 13 1HB PHE 13 -6.176 -2.318 -4.971
66 HB3 PHE 13 2HB PHE 13 -5.635 -2.554 -6.629
67 HD1 PHE 13 HD2 PHE 13 -8.385 -3.446 -4.294
68 HD2 PHE 13 HD1 PHE 13 -7.184 -2.823 -8.329
69 HE1 PHE 13 HE2 PHE 13 -10.726 -3.665 -5.020
70 HE2 PHE 13 HE1 PHE 13 -9.523 -3.040 -9.062
71 HZ PHE 13 HZ PHE 13 -11.297 -3.462 -7.407
72 H GLU 14 H GLU 14 -3.546 -5.207 -6.676
73 HA GLU 14 HA GLU 14 -1.600 -4.363 -4.669
74 HB2 GLU 14 1HB GLU 14 -1.591 -6.690 -5.638
75 HB3 GLU 14 2HB GLU 14 -1.107 -5.979 -7.171
76 HG2 GLU 14 1HG GLU 14 0.871 -4.998 -5.955
77 HG3 GLU 14 2HG GLU 14 0.427 -6.022 -4.590
78 H CYS 15 H CYS 15 0.146 -3.022 -5.113
79 HA CYS 15 HA CYS 15 -0.331 -1.057 -7.171
80 HB2 CYS 15 1HB CYS 15 0.445 -0.460 -4.871
81 HB3 CYS 15 2HB CYS 15 1.980 -1.243 -5.229
82 H THR 16 H THR 16 0.400 -1.232 -9.173
83 HA THR 16 HA THR 16 2.202 -3.239 -10.012
84 HB THR 16 HB THR 16 0.492 -2.269 -11.504
85 HG1 THR 16 HG1 THR 16 2.802 -3.079 -12.155
86 HG21 THR 16 3HG2 THR 16 0.492 0.033 -10.987
87 HG22 THR 16 1HG2 THR 16 1.134 -0.071 -12.625
88 HG23 THR 16 2HG2 THR 16 2.228 0.177 -11.264
89 H GLU 17 H GLU 17 2.716 -0.179 -8.628
90 HA GLU 17 HA GLU 17 5.256 0.357 -9.862
91 HB2 GLU 17 1HB GLU 17 4.136 1.548 -7.323
92 HB3 GLU 17 2HB GLU 17 5.414 2.212 -8.331
93 HG2 GLU 17 1HG GLU 17 2.650 1.772 -9.397
94 HG3 GLU 17 2HG GLU 17 3.082 3.234 -8.511
95 H CYS 18 H CYS 18 4.391 -0.291 -6.460
96 HA CYS 18 HA CYS 18 7.067 -1.423 -6.065
97 HB2 CYS 18 1HB CYS 18 6.570 -1.199 -3.648
98 HB3 CYS 18 2HB CYS 18 6.459 0.336 -4.504
99 H GLY 19 H GLY 19 3.646 -2.140 -5.407
100 HA2 GLY 19 1HA GLY 19 2.960 -4.450 -6.043
101 HA3 GLY 19 2HA GLY 19 4.402 -4.991 -5.196
102 H LYS 20 H LYS 20 2.732 -2.360 -3.778
103 HA LYS 20 HA LYS 20 2.128 -3.903 -1.442
104 HB2 LYS 20 1HB LYS 20 2.772 -1.359 -1.708
105 HB3 LYS 20 2HB LYS 20 1.033 -1.154 -1.868
106 HG2 LYS 20 1HG LYS 20 0.627 -1.939 0.300
107 HG3 LYS 20 2HG LYS 20 2.242 -2.638 0.441
108 HD2 LYS 20 1HD LYS 20 3.235 -0.599 0.838
109 HD3 LYS 20 2HD LYS 20 1.967 0.300 0.002
110 HE2 LYS 20 1HE LYS 20 0.458 0.017 1.822
111 HE3 LYS 20 2HE LYS 20 1.528 -1.144 2.607
112 HZ1 LYS 20 3HZ LYS 20 1.554 1.158 3.552
113 HZ2 LYS 20 1HZ LYS 20 2.291 1.678 2.120
114 HZ3 LYS 20 2HZ LYS 20 3.071 0.552 3.112
115 H ALA 21 H ALA 21 0.271 -4.853 -0.880
116 HA ALA 21 HA ALA 21 -1.988 -4.654 -2.723
117 HB1 ALA 21 3HB ALA 21 -2.846 -6.634 -1.470
118 HB2 ALA 21 1HB ALA 21 -1.287 -6.891 -2.254
119 HB3 ALA 21 2HB ALA 21 -1.364 -6.607 -0.515
120 H PHE 22 H PHE 22 -3.850 -3.671 -2.232
121 HA PHE 22 HA PHE 22 -4.273 -2.822 0.558
122 HB2 PHE 22 1HB PHE 22 -5.028 -1.301 -1.947
123 HB3 PHE 22 2HB PHE 22 -5.332 -0.781 -0.293
124 HD1 PHE 22 HD1 PHE 22 -3.520 0.008 1.119
125 HD2 PHE 22 HD2 PHE 22 -2.832 -1.163 -2.915
126 HE1 PHE 22 HE1 PHE 22 -1.329 1.126 1.172
127 HE2 PHE 22 HE2 PHE 22 -0.640 -0.047 -2.868
128 HZ PHE 22 HZ PHE 22 0.115 1.098 -0.823
129 H THR 23 H THR 23 -6.264 -3.122 1.428
130 HA THR 23 HA THR 23 -8.086 -4.835 -0.035
131 HB THR 23 HB THR 23 -7.553 -5.319 2.329
132 HG1 THR 23 HG1 THR 23 -9.690 -5.766 2.891
133 HG21 THR 23 3HG2 THR 23 -8.260 -2.537 2.640
134 HG22 THR 23 1HG2 THR 23 -7.456 -3.621 3.774
135 HG23 THR 23 2HG2 THR 23 -9.217 -3.554 3.717
136 H ARG 24 H ARG 24 -7.748 -1.946 -0.735
137 HA ARG 24 HA ARG 24 -10.550 -1.355 -1.042
138 HB2 ARG 24 1HB ARG 24 -8.776 0.418 0.639
139 HB3 ARG 24 2HB ARG 24 -10.294 0.960 -0.064
140 HG2 ARG 24 1HG ARG 24 -11.451 -0.855 1.175
141 HG3 ARG 24 2HG ARG 24 -9.918 -1.229 1.965
142 HD2 ARG 24 1HD ARG 24 -10.798 0.183 3.522
143 HD3 ARG 24 2HD ARG 24 -9.981 1.362 2.498
144 HE ARG 24 HE ARG 24 -12.024 2.195 1.884
145 HH11 ARG 24 1HH1 ARG 24 -12.459 -0.914 3.390
146 HH12 ARG 24 2HH1 ARG 24 -14.186 -0.790 3.447
147 HH21 ARG 24 1HH2 ARG 24 -14.297 2.369 1.954
148 HH22 ARG 24 2HH2 ARG 24 -15.231 1.077 2.629
149 H LYS 25 H LYS 25 -10.605 -0.944 -3.148
150 HA LYS 25 HA LYS 25 -8.524 -0.235 -4.798
151 HB2 LYS 25 1HB LYS 25 -10.664 -1.031 -5.649
152 HB3 LYS 25 2HB LYS 25 -11.454 0.445 -5.110
153 HG2 LYS 25 1HG LYS 25 -9.672 1.585 -6.666
154 HG3 LYS 25 2HG LYS 25 -9.652 -0.006 -7.431
155 HD2 LYS 25 1HD LYS 25 -12.278 1.286 -6.865
156 HD3 LYS 25 2HD LYS 25 -11.322 1.864 -8.231
157 HE2 LYS 25 1HE LYS 25 -11.747 -1.068 -7.909
158 HE3 LYS 25 2HE LYS 25 -13.076 -0.080 -8.513
159 HZ1 LYS 25 3HZ LYS 25 -11.977 -0.717 -10.425
160 HZ2 LYS 25 1HZ LYS 25 -10.439 -0.575 -9.733
161 HZ3 LYS 25 2HZ LYS 25 -11.317 0.814 -10.136
162 H SER 26 H SER 26 -10.516 1.822 -2.799
163 HA SER 26 HA SER 26 -9.770 4.291 -3.993
164 HB2 SER 26 1HB SER 26 -11.783 3.875 -2.495
165 HB3 SER 26 2HB SER 26 -10.664 3.906 -1.133
166 HG SER 26 HG SER 26 -11.810 5.958 -2.235
167 H THR 27 H THR 27 -8.741 2.725 -0.960
168 HA THR 27 HA THR 27 -6.831 4.525 -0.141
169 HB THR 27 HB THR 27 -6.873 1.521 0.125
170 HG1 THR 27 HG1 THR 27 -7.335 2.265 2.369
171 HG21 THR 27 3HG2 THR 27 -4.761 1.564 0.833
172 HG22 THR 27 1HG2 THR 27 -5.260 2.634 2.142
173 HG23 THR 27 2HG2 THR 27 -4.684 3.313 0.619
174 H LEU 28 H LEU 28 -6.377 1.768 -2.341
175 HA LEU 28 HA LEU 28 -3.641 2.057 -2.774
176 HB2 LEU 28 1HB LEU 28 -4.611 0.082 -3.549
177 HB3 LEU 28 2HB LEU 28 -5.874 0.941 -4.428
178 HG LEU 28 HG LEU 28 -4.217 1.661 -6.089
179 HD11 LEU 28 1HD1 LEU 28 -1.975 0.648 -6.069
180 HD12 LEU 28 2HD1 LEU 28 -2.309 -0.022 -4.473
181 HD13 LEU 28 3HD1 LEU 28 -2.240 1.725 -4.698
182 HD21 LEU 28 3HD2 LEU 28 -3.656 -0.705 -6.925
183 HD22 LEU 28 1HD2 LEU 28 -5.354 -0.267 -6.734
184 HD23 LEU 28 2HD2 LEU 28 -4.558 -1.262 -5.515
185 H SER 29 H SER 29 -6.301 3.246 -4.836
186 HA SER 29 HA SER 29 -4.952 4.590 -6.756
187 HB2 SER 29 1HB SER 29 -7.427 4.482 -6.577
188 HB3 SER 29 2HB SER 29 -7.367 5.700 -5.304
189 HG SER 29 HG SER 29 -7.786 6.542 -7.439
190 H MET 30 H MET 30 -5.332 5.575 -3.413
191 HA MET 30 HA MET 30 -4.162 8.176 -3.831
192 HB2 MET 30 1HB MET 30 -4.823 6.654 -1.305
193 HB3 MET 30 2HB MET 30 -4.223 8.307 -1.339
194 HG2 MET 30 1HG MET 30 -6.267 8.732 -2.885
195 HG3 MET 30 2HG MET 30 -6.877 7.240 -2.175
196 HE1 MET 30 3HE MET 30 -6.732 8.137 1.641
197 HE2 MET 30 1HE MET 30 -7.745 7.159 0.578
198 HE3 MET 30 2HE MET 30 -5.988 7.025 0.491
199 H HIS 31 H HIS 31 -3.091 5.005 -2.809
200 HA HIS 31 HA HIS 31 -0.549 5.847 -1.823
201 HB2 HIS 31 1HB HIS 31 -1.150 3.792 -0.951
202 HB3 HIS 31 2HB HIS 31 -1.820 3.222 -2.476
203 HD1 HIS 31 HD1 HIS 31 1.399 3.518 -0.595
204 HD2 HIS 31 HD2 HIS 31 0.004 1.986 -4.196
205 HE1 HIS 31 HE1 HIS 31 3.275 2.107 -1.497
206 H GLN 32 H GLN 32 -1.703 4.533 -4.900
207 HA GLN 32 HA GLN 32 0.734 4.186 -6.184
208 HB2 GLN 32 1HB GLN 32 -2.012 4.868 -7.197
209 HB3 GLN 32 2HB GLN 32 -0.652 4.714 -8.301
210 HG2 GLN 32 1HG GLN 32 -0.293 2.416 -7.226
211 HG3 GLN 32 2HG GLN 32 -1.924 2.616 -6.586
212 HE21 GLN 32 1HE2 GLN 32 -0.641 0.816 -8.658
213 HE22 GLN 32 2HE2 GLN 32 -1.689 0.940 -10.026
214 H LYS 33 H LYS 33 -0.791 7.071 -5.200
215 HA LYS 33 HA LYS 33 0.283 8.845 -7.141
216 HB2 LYS 33 1HB LYS 33 -0.817 9.236 -4.365
217 HB3 LYS 33 2HB LYS 33 -0.174 10.578 -5.303
218 HG2 LYS 33 1HG LYS 33 -1.826 9.734 -7.130
219 HG3 LYS 33 2HG LYS 33 -2.625 8.943 -5.768
220 HD2 LYS 33 1HD LYS 33 -1.889 11.818 -5.513
221 HD3 LYS 33 2HD LYS 33 -3.279 11.389 -6.514
222 HE2 LYS 33 1HE LYS 33 -4.276 10.201 -4.630
223 HE3 LYS 33 2HE LYS 33 -2.878 10.593 -3.631
224 HZ1 LYS 33 3HZ LYS 33 -4.369 12.219 -3.043
225 HZ2 LYS 33 1HZ LYS 33 -5.019 12.362 -4.598
226 HZ3 LYS 33 2HZ LYS 33 -3.495 13.012 -4.255
227 H ILE 34 H ILE 34 1.721 7.096 -4.653
228 HA ILE 34 HA ILE 34 3.765 8.985 -3.946
229 HB ILE 34 HB ILE 34 4.704 7.306 -2.596
230 HG12 ILE 34 1HG1 ILE 34 3.113 5.260 -4.159
231 HG13 ILE 34 2HG1 ILE 34 4.835 5.567 -4.356
232 HG21 ILE 34 1HG2 ILE 34 2.868 7.742 -1.367
233 HG22 ILE 34 2HG2 ILE 34 1.767 7.429 -2.708
234 HG23 ILE 34 3HG2 ILE 34 2.438 6.084 -1.785
235 HD11 ILE 34 3HD1 ILE 34 5.052 4.984 -1.892
236 HD12 ILE 34 1HD1 ILE 34 3.410 4.353 -2.017
237 HD13 ILE 34 2HD1 ILE 34 4.698 3.666 -3.008
238 H HIS 35 H HIS 35 3.230 6.964 -6.598
239 HA HIS 35 HA HIS 35 6.093 6.921 -7.277
240 HB2 HIS 35 1HB HIS 35 3.889 5.300 -8.559
241 HB3 HIS 35 2HB HIS 35 5.624 5.096 -8.776
242 HD1 HIS 35 HD1 HIS 35 6.936 4.313 -6.522
243 HD2 HIS 35 HD2 HIS 35 2.818 3.763 -6.591
244 HE1 HIS 35 HE1 HIS 35 6.451 2.641 -4.708
245 H THR 36 H THR 36 2.972 8.097 -8.211
246 HA THR 36 HA THR 36 3.424 8.722 -10.897
247 HB THR 36 HB THR 36 1.714 10.576 -10.493
248 HG1 THR 36 HG1 THR 36 1.979 10.949 -8.309
249 HG21 THR 36 3HG2 THR 36 1.419 7.892 -10.868
250 HG22 THR 36 1HG2 THR 36 0.096 9.058 -10.880
251 HG23 THR 36 2HG2 THR 36 0.461 8.152 -9.411
252 H GLY 37 H GLY 37 4.183 10.523 -7.950
253 HA2 GLY 37 1HA GLY 37 4.825 13.000 -8.742
254 HA3 GLY 37 2HA GLY 37 5.867 12.098 -7.652
255 H GLU 38 H GLU 38 7.325 10.460 -8.889
256 HA GLU 38 HA GLU 38 8.821 12.033 -10.805
257 HB2 GLU 38 1HB GLU 38 10.565 10.409 -10.541
258 HB3 GLU 38 2HB GLU 38 9.920 10.776 -8.947
259 HG2 GLU 38 1HG GLU 38 8.427 8.693 -9.359
260 HG3 GLU 38 2HG GLU 38 9.641 8.292 -10.573
261 H LYS 39 H LYS 39 6.322 11.231 -11.784
262 HA LYS 39 HA LYS 39 7.164 9.797 -14.154
263 HB2 LYS 39 1HB LYS 39 5.261 8.656 -12.152
264 HB3 LYS 39 2HB LYS 39 4.968 8.358 -13.860
265 HG2 LYS 39 1HG LYS 39 7.466 7.616 -13.873
266 HG3 LYS 39 2HG LYS 39 7.216 7.436 -12.135
267 HD2 LYS 39 1HD LYS 39 6.617 5.342 -12.824
268 HD3 LYS 39 2HD LYS 39 5.051 6.148 -12.946
269 HE2 LYS 39 1HE LYS 39 5.361 4.912 -14.953
270 HE3 LYS 39 2HE LYS 39 5.590 6.614 -15.353
271 HZ1 LYS 39 3HZ LYS 39 8.044 6.156 -15.029
272 HZ2 LYS 39 1HZ LYS 39 7.327 5.487 -16.408
273 HZ3 LYS 39 2HZ LYS 39 7.650 4.511 -15.065
274 HA PRO 40 HA PRO 40 4.347 12.585 -16.052
275 HB2 PRO 40 1HB PRO 40 3.786 11.224 -18.333
276 HB3 PRO 40 2HB PRO 40 5.339 12.018 -18.045
277 HG2 PRO 40 1HG PRO 40 4.602 9.132 -17.741
278 HG3 PRO 40 2HG PRO 40 6.063 9.845 -18.449
279 HD2 PRO 40 1HD PRO 40 6.003 8.838 -15.936
280 HD3 PRO 40 2HD PRO 40 7.034 10.211 -16.390
281 H SER 41 H SER 41 2.138 12.617 -17.132
282 HA SER 41 HA SER 41 -0.098 12.177 -17.117
283 HB2 SER 41 1HB SER 41 0.766 9.814 -17.684
284 HB3 SER 41 2HB SER 41 0.460 9.440 -15.988
285 HG SER 41 HG SER 41 -1.501 9.085 -16.653
286 H GLY 42 H GLY 42 1.257 13.345 -14.861
287 HA2 GLY 42 1HA GLY 42 -0.588 12.510 -12.707
288 HA3 GLY 42 2HA GLY 42 1.064 13.021 -12.392
289 HA PRO 43 HA PRO 43 -1.991 16.625 -12.162
290 HB2 PRO 43 1HB PRO 43 -1.775 17.083 -9.494
291 HB3 PRO 43 2HB PRO 43 -2.977 15.988 -10.187
292 HG2 PRO 43 1HG PRO 43 -0.339 15.351 -8.923
293 HG3 PRO 43 2HG PRO 43 -1.901 14.536 -8.722
294 HD2 PRO 43 1HD PRO 43 0.048 13.573 -10.337
295 HD3 PRO 43 2HD PRO 43 -1.679 13.354 -10.688
296 H SER 44 H SER 44 -1.456 18.838 -11.368
297 HA SER 44 HA SER 44 1.127 19.595 -12.158
298 HB2 SER 44 1HB SER 44 -0.924 21.055 -12.190
299 HB3 SER 44 2HB SER 44 -0.756 21.227 -10.443
300 HG SER 44 HG SER 44 0.577 22.777 -10.890
301 H SER 45 H SER 45 2.889 18.955 -11.086
302 HA SER 45 HA SER 45 2.909 19.215 -8.152
303 HB2 SER 45 1HB SER 45 4.230 17.294 -10.027
304 HB3 SER 45 2HB SER 45 5.027 17.675 -8.500
305 HG SER 45 HG SER 45 2.848 16.122 -8.976
306 H GLY 46 H GLY 46 4.072 20.821 -7.338
307 HA2 GLY 46 1HA GLY 46 6.272 21.852 -7.126
308 HA3 GLY 46 2HA GLY 46 6.401 21.783 -8.877
Start of MODEL 3
1 H1 GLY 1 H GLY 1 -9.333 -29.711 -17.264
2 HA2 GLY 1 1HA GLY 1 -11.621 -29.121 -18.962
3 HA3 GLY 1 2HA GLY 1 -11.673 -29.673 -17.295
4 H SER 2 H SER 2 -11.993 -27.029 -19.361
5 HA SER 2 HA SER 2 -11.567 -25.062 -17.242
6 HB2 SER 2 1HB SER 2 -10.776 -24.784 -19.692
7 HB3 SER 2 2HB SER 2 -12.465 -24.420 -20.043
8 HG SER 2 HG SER 2 -10.997 -22.600 -19.493
9 H SER 3 H SER 3 -13.348 -25.664 -15.927
10 HA SER 3 HA SER 3 -15.917 -24.663 -16.951
11 HB2 SER 3 1HB SER 3 -17.036 -26.444 -15.552
12 HB3 SER 3 2HB SER 3 -16.161 -27.049 -16.958
13 HG SER 3 HG SER 3 -15.846 -28.080 -14.761
14 H GLY 4 H GLY 4 -15.334 -22.685 -15.882
15 HA2 GLY 4 1HA GLY 4 -15.625 -21.206 -14.144
16 HA3 GLY 4 2HA GLY 4 -16.385 -22.511 -13.245
17 H SER 5 H SER 5 -13.716 -20.492 -13.445
18 HA SER 5 HA SER 5 -12.244 -22.175 -11.526
19 HB2 SER 5 1HB SER 5 -11.060 -22.036 -13.696
20 HB3 SER 5 2HB SER 5 -11.039 -20.278 -13.557
21 HG SER 5 HG SER 5 -9.109 -21.505 -12.818
22 H SER 6 H SER 6 -12.941 -21.234 -9.662
23 HA SER 6 HA SER 6 -11.781 -18.742 -8.920
24 HB2 SER 6 1HB SER 6 -13.654 -17.794 -10.132
25 HB3 SER 6 2HB SER 6 -14.786 -18.840 -9.275
26 HG SER 6 HG SER 6 -13.867 -16.447 -8.550
27 H GLY 7 H GLY 7 -11.460 -18.695 -6.769
28 HA2 GLY 7 1HA GLY 7 -12.899 -20.715 -5.163
29 HA3 GLY 7 2HA GLY 7 -11.233 -20.235 -4.875
30 H THR 8 H THR 8 -14.195 -18.341 -5.424
31 HA THR 8 HA THR 8 -14.829 -16.383 -4.358
32 HB THR 8 HB THR 8 -16.102 -18.176 -3.254
33 HG1 THR 8 HG1 THR 8 -15.359 -16.393 -1.197
34 HG21 THR 8 3HG2 THR 8 -14.060 -18.102 -1.044
35 HG22 THR 8 1HG2 THR 8 -14.010 -19.302 -2.334
36 HG23 THR 8 2HG2 THR 8 -15.404 -19.224 -1.256
37 H GLY 9 H GLY 9 -12.099 -16.241 -4.626
38 HA2 GLY 9 1HA GLY 9 -10.867 -15.726 -2.065
39 HA3 GLY 9 2HA GLY 9 -10.142 -15.468 -3.645
40 H GLY 10 H GLY 10 -9.656 -13.606 -1.778
41 HA2 GLY 10 1HA GLY 10 -11.615 -11.464 -2.013
42 HA3 GLY 10 2HA GLY 10 -10.145 -11.432 -1.051
43 H LYS 11 H LYS 11 -11.583 -9.987 -3.560
44 HA LYS 11 HA LYS 11 -9.444 -9.852 -5.454
45 HB2 LYS 11 1HB LYS 11 -11.978 -8.266 -5.073
46 HB3 LYS 11 2HB LYS 11 -10.814 -7.878 -6.333
47 HG2 LYS 11 1HG LYS 11 -12.045 -10.603 -6.051
48 HG3 LYS 11 2HG LYS 11 -12.778 -9.314 -7.009
49 HD2 LYS 11 1HD LYS 11 -9.928 -10.166 -7.429
50 HD3 LYS 11 2HD LYS 11 -11.270 -10.997 -8.220
51 HE2 LYS 11 1HE LYS 11 -11.999 -8.762 -9.104
52 HE3 LYS 11 2HE LYS 11 -10.489 -8.099 -8.481
53 HZ1 LYS 11 3HZ LYS 11 -9.321 -8.993 -10.148
54 HZ2 LYS 11 1HZ LYS 11 -10.809 -9.126 -10.943
55 HZ3 LYS 11 2HZ LYS 11 -10.171 -10.456 -10.115
56 H HIS 12 H HIS 12 -7.656 -9.278 -4.117
57 HA HIS 12 HA HIS 12 -7.686 -6.662 -2.849
58 HB2 HIS 12 1HB HIS 12 -5.542 -7.243 -1.944
59 HB3 HIS 12 2HB HIS 12 -6.585 -8.653 -1.786
60 HD1 HIS 12 HD1 HIS 12 -6.141 -10.620 -3.526
61 HD2 HIS 12 HD2 HIS 12 -3.245 -7.645 -3.387
62 HE1 HIS 12 HE1 HIS 12 -4.124 -11.590 -4.674
63 H PHE 13 H PHE 13 -6.749 -4.860 -3.629
64 HA PHE 13 HA PHE 13 -5.737 -4.951 -6.357
65 HB2 PHE 13 1HB PHE 13 -6.114 -2.480 -4.673
66 HB3 PHE 13 2HB PHE 13 -6.082 -2.606 -6.429
67 HD1 PHE 13 HD1 PHE 13 -7.933 -4.531 -7.208
68 HD2 PHE 13 HD2 PHE 13 -8.171 -1.909 -3.864
69 HE1 PHE 13 HE1 PHE 13 -10.387 -4.719 -7.240
70 HE2 PHE 13 HE2 PHE 13 -10.625 -2.093 -3.890
71 HZ PHE 13 HZ PHE 13 -11.736 -3.500 -5.578
72 H GLU 14 H GLU 14 -3.640 -5.272 -6.665
73 HA GLU 14 HA GLU 14 -1.733 -4.404 -4.621
74 HB2 GLU 14 1HB GLU 14 -1.613 -6.742 -5.392
75 HB3 GLU 14 2HB GLU 14 -1.320 -6.180 -7.032
76 HG2 GLU 14 1HG GLU 14 0.752 -5.085 -6.235
77 HG3 GLU 14 2HG GLU 14 0.473 -5.796 -4.647
78 H CYS 15 H CYS 15 0.007 -3.064 -5.070
79 HA CYS 15 HA CYS 15 -0.433 -1.152 -7.171
80 HB2 CYS 15 1HB CYS 15 0.388 -0.540 -4.888
81 HB3 CYS 15 2HB CYS 15 1.906 -1.350 -5.264
82 H THR 16 H THR 16 0.344 -1.259 -9.162
83 HA THR 16 HA THR 16 2.097 -3.347 -9.988
84 HB THR 16 HB THR 16 1.375 -0.901 -11.602
85 HG1 THR 16 HG1 THR 16 -0.533 -1.881 -10.796
86 HG21 THR 16 3HG2 THR 16 1.628 -2.433 -13.501
87 HG22 THR 16 1HG2 THR 16 2.062 -3.734 -12.394
88 HG23 THR 16 2HG2 THR 16 3.114 -2.328 -12.559
89 H GLU 17 H GLU 17 2.675 -0.378 -8.547
90 HA GLU 17 HA GLU 17 5.188 0.159 -9.886
91 HB2 GLU 17 1HB GLU 17 3.975 1.466 -7.445
92 HB3 GLU 17 2HB GLU 17 5.370 2.049 -8.341
93 HG2 GLU 17 1HG GLU 17 3.781 3.368 -9.262
94 HG3 GLU 17 2HG GLU 17 3.648 1.986 -10.347
95 H CYS 18 H CYS 18 4.303 -0.362 -6.467
96 HA CYS 18 HA CYS 18 6.988 -1.433 -5.994
97 HB2 CYS 18 1HB CYS 18 6.457 -1.159 -3.603
98 HB3 CYS 18 2HB CYS 18 6.265 0.349 -4.492
99 H GLY 19 H GLY 19 3.571 -2.237 -5.445
100 HA2 GLY 19 1HA GLY 19 2.941 -4.561 -6.023
101 HA3 GLY 19 2HA GLY 19 4.397 -5.063 -5.177
102 H LYS 20 H LYS 20 2.623 -2.466 -3.798
103 HA LYS 20 HA LYS 20 2.068 -4.019 -1.445
104 HB2 LYS 20 1HB LYS 20 2.732 -1.530 -1.579
105 HB3 LYS 20 2HB LYS 20 1.043 -1.239 -1.971
106 HG2 LYS 20 1HG LYS 20 0.308 -1.933 0.126
107 HG3 LYS 20 2HG LYS 20 1.816 -2.781 0.476
108 HD2 LYS 20 1HD LYS 20 2.990 -0.741 0.790
109 HD3 LYS 20 2HD LYS 20 1.656 0.206 0.127
110 HE2 LYS 20 1HE LYS 20 0.256 -0.479 2.032
111 HE3 LYS 20 2HE LYS 20 1.622 -1.371 2.699
112 HZ1 LYS 20 3HZ LYS 20 1.170 0.980 3.557
113 HZ2 LYS 20 1HZ LYS 20 1.845 1.509 2.099
114 HZ3 LYS 20 2HZ LYS 20 2.765 0.574 3.166
115 H ALA 21 H ALA 21 0.190 -4.910 -0.815
116 HA ALA 21 HA ALA 21 -2.065 -4.757 -2.679
117 HB1 ALA 21 3HB ALA 21 -1.231 -6.987 -2.139
118 HB2 ALA 21 1HB ALA 21 -1.544 -6.696 -0.427
119 HB3 ALA 21 2HB ALA 21 -2.886 -6.772 -1.569
120 H PHE 22 H PHE 22 -3.756 -3.526 -2.219
121 HA PHE 22 HA PHE 22 -4.224 -2.771 0.589
122 HB2 PHE 22 1HB PHE 22 -5.061 -1.266 -1.898
123 HB3 PHE 22 2HB PHE 22 -5.249 -0.724 -0.234
124 HD1 PHE 22 HD2 PHE 22 -2.858 -1.317 -2.950
125 HD2 PHE 22 HD1 PHE 22 -3.408 0.188 0.993
126 HE1 PHE 22 HE2 PHE 22 -0.648 -0.241 -3.057
127 HE2 PHE 22 HE1 PHE 22 -1.200 1.268 0.892
128 HZ PHE 22 HZ PHE 22 0.184 1.054 -1.134
129 H THR 23 H THR 23 -6.255 -2.945 1.457
130 HA THR 23 HA THR 23 -8.064 -4.745 0.083
131 HB THR 23 HB THR 23 -7.572 -5.102 2.469
132 HG1 THR 23 HG1 THR 23 -10.273 -4.392 1.886
133 HG21 THR 23 3HG2 THR 23 -9.211 -2.661 3.086
134 HG22 THR 23 1HG2 THR 23 -7.457 -2.575 2.931
135 HG23 THR 23 2HG2 THR 23 -8.184 -3.604 4.165
136 H ARG 24 H ARG 24 -7.628 -1.638 -0.335
137 HA ARG 24 HA ARG 24 -10.469 -1.125 -0.813
138 HB2 ARG 24 1HB ARG 24 -8.625 0.511 0.877
139 HB3 ARG 24 2HB ARG 24 -9.855 1.331 -0.076
140 HG2 ARG 24 1HG ARG 24 -11.606 0.145 1.043
141 HG3 ARG 24 2HG ARG 24 -10.438 -0.877 1.882
142 HD2 ARG 24 1HD ARG 24 -9.515 1.240 2.907
143 HD3 ARG 24 2HD ARG 24 -10.926 2.069 2.252
144 HE ARG 24 HE ARG 24 -12.067 0.083 3.621
145 HH11 ARG 24 1HH1 ARG 24 -9.528 2.301 4.487
146 HH12 ARG 24 2HH1 ARG 24 -9.922 2.298 6.174
147 HH21 ARG 24 1HH2 ARG 24 -12.596 0.070 5.840
148 HH22 ARG 24 2HH2 ARG 24 -11.667 1.028 6.943
149 H LYS 25 H LYS 25 -10.803 -0.417 -2.813
150 HA LYS 25 HA LYS 25 -8.752 -0.083 -4.682
151 HB2 LYS 25 1HB LYS 25 -11.198 -0.619 -5.121
152 HB3 LYS 25 2HB LYS 25 -11.516 1.100 -4.934
153 HG2 LYS 25 1HG LYS 25 -11.304 0.941 -7.204
154 HG3 LYS 25 2HG LYS 25 -9.646 1.339 -6.747
155 HD2 LYS 25 1HD LYS 25 -9.237 -0.435 -8.124
156 HD3 LYS 25 2HD LYS 25 -9.446 -1.300 -6.599
157 HE2 LYS 25 1HE LYS 25 -10.790 -2.507 -8.044
158 HE3 LYS 25 2HE LYS 25 -11.942 -1.406 -7.290
159 HZ1 LYS 25 3HZ LYS 25 -12.360 -1.391 -9.604
160 HZ2 LYS 25 1HZ LYS 25 -10.725 -1.173 -9.983
161 HZ3 LYS 25 2HZ LYS 25 -11.597 0.077 -9.251
162 H SER 26 H SER 26 -10.591 2.297 -2.826
163 HA SER 26 HA SER 26 -9.489 4.581 -4.096
164 HB2 SER 26 1HB SER 26 -11.613 4.465 -2.681
165 HB3 SER 26 2HB SER 26 -10.553 4.504 -1.272
166 HG SER 26 HG SER 26 -11.019 6.489 -3.208
167 H THR 27 H THR 27 -8.674 2.848 -1.113
168 HA THR 27 HA THR 27 -6.705 4.513 -0.116
169 HB THR 27 HB THR 27 -6.728 1.489 -0.035
170 HG1 THR 27 HG1 THR 27 -8.097 3.484 1.365
171 HG21 THR 27 3HG2 THR 27 -5.005 3.541 1.210
172 HG22 THR 27 1HG2 THR 27 -4.660 1.857 0.820
173 HG23 THR 27 2HG2 THR 27 -5.573 2.256 2.275
174 H LEU 28 H LEU 28 -6.326 1.821 -2.413
175 HA LEU 28 HA LEU 28 -3.549 2.074 -2.749
176 HB2 LEU 28 1HB LEU 28 -4.440 0.070 -3.499
177 HB3 LEU 28 2HB LEU 28 -5.753 0.865 -4.365
178 HG LEU 28 HG LEU 28 -4.123 1.630 -6.060
179 HD11 LEU 28 1HD1 LEU 28 -2.138 1.623 -4.606
180 HD12 LEU 28 2HD1 LEU 28 -1.884 0.717 -6.097
181 HD13 LEU 28 3HD1 LEU 28 -2.180 -0.140 -4.584
182 HD21 LEU 28 3HD2 LEU 28 -4.984 -1.078 -5.554
183 HD22 LEU 28 1HD2 LEU 28 -3.476 -1.047 -6.469
184 HD23 LEU 28 2HD2 LEU 28 -4.894 -0.191 -7.076
185 H SER 29 H SER 29 -6.179 3.188 -4.888
186 HA SER 29 HA SER 29 -4.754 4.498 -6.803
187 HB2 SER 29 1HB SER 29 -7.342 4.278 -6.418
188 HB3 SER 29 2HB SER 29 -7.169 5.868 -5.674
189 HG SER 29 HG SER 29 -5.839 5.810 -8.001
190 H MET 30 H MET 30 -5.274 5.500 -3.503
191 HA MET 30 HA MET 30 -4.250 8.165 -3.923
192 HB2 MET 30 1HB MET 30 -5.073 6.602 -1.487
193 HB3 MET 30 2HB MET 30 -4.293 8.172 -1.352
194 HG2 MET 30 1HG MET 30 -6.121 9.081 -2.822
195 HG3 MET 30 2HG MET 30 -6.936 7.531 -2.624
196 HE1 MET 30 3HE MET 30 -7.857 7.314 1.013
197 HE2 MET 30 1HE MET 30 -8.822 7.330 -0.464
198 HE3 MET 30 2HE MET 30 -7.291 6.455 -0.421
199 H HIS 31 H HIS 31 -3.022 5.059 -2.932
200 HA HIS 31 HA HIS 31 -0.555 6.065 -1.868
201 HB2 HIS 31 1HB HIS 31 -1.017 4.016 -0.934
202 HB3 HIS 31 2HB HIS 31 -1.714 3.375 -2.418
203 HD1 HIS 31 HD1 HIS 31 1.646 4.082 -0.840
204 HD2 HIS 31 HD2 HIS 31 -0.002 1.886 -3.958
205 HE1 HIS 31 HE1 HIS 31 3.513 2.635 -1.704
206 H GLN 32 H GLN 32 -1.556 4.531 -4.905
207 HA GLN 32 HA GLN 32 0.911 4.291 -6.136
208 HB2 GLN 32 1HB GLN 32 -1.772 4.945 -7.363
209 HB3 GLN 32 2HB GLN 32 -0.351 4.473 -8.286
210 HG2 GLN 32 1HG GLN 32 -0.331 2.361 -6.871
211 HG3 GLN 32 2HG GLN 32 -1.949 2.830 -6.353
212 HE21 GLN 32 1HE2 GLN 32 -3.255 3.638 -8.433
213 HE22 GLN 32 2HE2 GLN 32 -3.288 2.471 -9.706
214 H LYS 33 H LYS 33 -0.879 7.130 -5.395
215 HA LYS 33 HA LYS 33 0.124 8.891 -7.343
216 HB2 LYS 33 1HB LYS 33 -0.928 9.305 -4.553
217 HB3 LYS 33 2HB LYS 33 -0.363 10.652 -5.533
218 HG2 LYS 33 1HG LYS 33 -2.023 9.592 -7.298
219 HG3 LYS 33 2HG LYS 33 -2.784 8.965 -5.834
220 HD2 LYS 33 1HD LYS 33 -2.138 11.869 -6.341
221 HD3 LYS 33 2HD LYS 33 -3.727 11.133 -6.561
222 HE2 LYS 33 1HE LYS 33 -3.361 10.365 -4.078
223 HE3 LYS 33 2HE LYS 33 -2.228 11.715 -4.048
224 HZ1 LYS 33 3HZ LYS 33 -4.150 13.065 -4.983
225 HZ2 LYS 33 1HZ LYS 33 -4.245 12.615 -3.355
226 HZ3 LYS 33 2HZ LYS 33 -5.145 11.778 -4.517
227 H ILE 34 H ILE 34 1.562 7.518 -4.522
228 HA ILE 34 HA ILE 34 3.580 9.463 -4.087
229 HB ILE 34 HB ILE 34 4.563 7.967 -2.586
230 HG12 ILE 34 1HG1 ILE 34 3.179 5.698 -4.035
231 HG13 ILE 34 2HG1 ILE 34 4.881 6.118 -4.196
232 HG21 ILE 34 1HG2 ILE 34 2.770 8.125 -1.287
233 HG22 ILE 34 2HG2 ILE 34 1.698 8.114 -2.686
234 HG23 ILE 34 3HG2 ILE 34 2.206 6.593 -1.953
235 HD11 ILE 34 3HD1 ILE 34 4.889 5.785 -1.603
236 HD12 ILE 34 1HD1 ILE 34 3.451 4.821 -1.937
237 HD13 ILE 34 2HD1 ILE 34 4.989 4.403 -2.694
238 H HIS 35 H HIS 35 3.251 6.799 -6.295
239 HA HIS 35 HA HIS 35 6.053 6.756 -7.005
240 HB2 HIS 35 1HB HIS 35 3.647 5.379 -8.214
241 HB3 HIS 35 2HB HIS 35 5.305 5.134 -8.756
242 HD1 HIS 35 HD1 HIS 35 6.961 4.255 -6.718
243 HD2 HIS 35 HD2 HIS 35 2.875 3.619 -6.314
244 HE1 HIS 35 HE1 HIS 35 6.731 2.439 -4.994
245 H THR 36 H THR 36 3.042 8.014 -8.331
246 HA THR 36 HA THR 36 4.513 9.182 -10.586
247 HB THR 36 HB THR 36 2.472 7.910 -11.139
248 HG1 THR 36 HG1 THR 36 2.775 10.632 -11.694
249 HG21 THR 36 3HG2 THR 36 1.042 10.064 -9.577
250 HG22 THR 36 1HG2 THR 36 1.195 8.374 -9.097
251 HG23 THR 36 2HG2 THR 36 0.274 8.802 -10.539
252 H GLY 37 H GLY 37 4.276 10.095 -7.635
253 HA2 GLY 37 1HA GLY 37 2.960 12.657 -7.850
254 HA3 GLY 37 2HA GLY 37 3.863 12.058 -6.467
255 H GLU 38 H GLU 38 4.397 14.513 -6.734
256 HA GLU 38 HA GLU 38 6.160 15.393 -8.715
257 HB2 GLU 38 1HB GLU 38 6.758 17.184 -7.165
258 HB3 GLU 38 2HB GLU 38 5.021 16.911 -7.163
259 HG2 GLU 38 1HG GLU 38 5.016 16.050 -5.040
260 HG3 GLU 38 2HG GLU 38 6.697 15.528 -5.131
261 H LYS 39 H LYS 39 8.453 15.811 -8.580
262 HA LYS 39 HA LYS 39 9.898 13.915 -6.851
263 HB2 LYS 39 1HB LYS 39 11.367 13.324 -8.638
264 HB3 LYS 39 2HB LYS 39 9.724 13.146 -9.239
265 HG2 LYS 39 1HG LYS 39 9.876 15.113 -10.529
266 HG3 LYS 39 2HG LYS 39 11.359 15.620 -9.716
267 HD2 LYS 39 1HD LYS 39 12.031 14.782 -11.820
268 HD3 LYS 39 2HD LYS 39 12.425 13.518 -10.653
269 HE2 LYS 39 1HE LYS 39 11.401 12.246 -12.243
270 HE3 LYS 39 2HE LYS 39 9.990 12.691 -11.285
271 HZ1 LYS 39 3HZ LYS 39 10.321 13.104 -13.966
272 HZ2 LYS 39 1HZ LYS 39 10.579 14.634 -13.292
273 HZ3 LYS 39 2HZ LYS 39 9.135 13.808 -12.987
274 HA PRO 40 HA PRO 40 12.434 17.294 -5.650
275 HB2 PRO 40 1HB PRO 40 14.766 16.009 -5.124
276 HB3 PRO 40 2HB PRO 40 13.345 15.886 -4.080
277 HG2 PRO 40 1HG PRO 40 14.331 13.982 -6.169
278 HG3 PRO 40 2HG PRO 40 13.699 13.636 -4.548
279 HD2 PRO 40 1HD PRO 40 12.199 13.363 -6.786
280 HD3 PRO 40 2HD PRO 40 11.505 13.841 -5.223
281 H SER 41 H SER 41 12.511 18.380 -7.689
282 HA SER 41 HA SER 41 14.212 17.722 -9.809
283 HB2 SER 41 1HB SER 41 12.326 19.415 -9.830
284 HB3 SER 41 2HB SER 41 13.427 20.535 -9.029
285 HG SER 41 HG SER 41 14.858 19.852 -10.943
286 H GLY 42 H GLY 42 16.226 18.609 -10.464
287 HA2 GLY 42 1HA GLY 42 18.127 20.059 -9.957
288 HA3 GLY 42 2HA GLY 42 17.832 19.735 -8.256
289 HA PRO 43 HA PRO 43 21.260 16.952 -9.560
290 HB2 PRO 43 1HB PRO 43 22.666 17.249 -7.257
291 HB3 PRO 43 2HB PRO 43 22.802 18.370 -8.617
292 HG2 PRO 43 1HG PRO 43 21.211 18.635 -6.095
293 HG3 PRO 43 2HG PRO 43 22.195 19.851 -6.930
294 HD2 PRO 43 1HD PRO 43 19.498 19.760 -7.149
295 HD3 PRO 43 2HD PRO 43 20.545 20.310 -8.473
296 H SER 44 H SER 44 22.155 15.034 -8.353
297 HA SER 44 HA SER 44 19.959 13.608 -7.126
298 HB2 SER 44 1HB SER 44 22.752 12.769 -7.922
299 HB3 SER 44 2HB SER 44 21.591 11.679 -7.165
300 HG SER 44 HG SER 44 20.201 12.050 -8.937
301 H SER 45 H SER 45 20.811 15.718 -5.527
302 HA SER 45 HA SER 45 22.701 15.401 -3.623
303 HB2 SER 45 1HB SER 45 20.999 17.256 -3.758
304 HB3 SER 45 2HB SER 45 19.860 16.185 -2.944
305 HG SER 45 HG SER 45 20.740 16.868 -1.172
306 H GLY 46 H GLY 46 23.283 13.502 -2.752
307 HA2 GLY 46 1HA GLY 46 23.050 11.958 -0.968
308 HA3 GLY 46 2HA GLY 46 21.304 12.131 -1.080
Start of MODEL 4
1 H1 GLY 1 H GLY 1 11.265 -21.553 -11.800
2 HA2 GLY 1 1HA GLY 1 10.397 -23.828 -10.248
3 HA3 GLY 1 2HA GLY 1 11.687 -22.906 -9.492
4 H SER 2 H SER 2 8.378 -22.756 -10.681
5 HA SER 2 HA SER 2 7.620 -20.995 -8.556
6 HB2 SER 2 1HB SER 2 8.598 -19.354 -10.114
7 HB3 SER 2 2HB SER 2 7.516 -19.919 -11.386
8 HG SER 2 HG SER 2 7.016 -18.022 -9.718
9 H SER 3 H SER 3 5.576 -21.413 -8.018
10 HA SER 3 HA SER 3 3.497 -21.901 -9.886
11 HB2 SER 3 1HB SER 3 3.121 -24.213 -9.658
12 HB3 SER 3 2HB SER 3 4.866 -24.090 -9.878
13 HG SER 3 HG SER 3 3.767 -25.362 -7.990
14 H GLY 4 H GLY 4 1.666 -21.268 -8.950
15 HA2 GLY 4 1HA GLY 4 0.172 -21.750 -6.976
16 HA3 GLY 4 2HA GLY 4 1.557 -21.287 -5.997
17 H SER 5 H SER 5 -1.254 -20.218 -7.498
18 HA SER 5 HA SER 5 -0.620 -17.544 -8.096
19 HB2 SER 5 1HB SER 5 -3.219 -18.886 -7.346
20 HB3 SER 5 2HB SER 5 -3.121 -17.179 -7.776
21 HG SER 5 HG SER 5 -2.053 -17.981 -9.760
22 H SER 6 H SER 6 -1.894 -19.044 -5.144
23 HA SER 6 HA SER 6 -1.955 -18.344 -2.980
24 HB2 SER 6 1HB SER 6 0.280 -16.599 -4.015
25 HB3 SER 6 2HB SER 6 -0.225 -16.586 -2.326
26 HG SER 6 HG SER 6 1.464 -18.229 -3.432
27 H GLY 7 H GLY 7 -3.897 -17.302 -4.671
28 HA2 GLY 7 1HA GLY 7 -4.476 -14.791 -3.282
29 HA3 GLY 7 2HA GLY 7 -4.491 -14.770 -5.039
30 H THR 8 H THR 8 -5.743 -16.956 -2.514
31 HA THR 8 HA THR 8 -8.262 -17.108 -4.014
32 HB THR 8 HB THR 8 -7.192 -19.261 -3.532
33 HG1 THR 8 HG1 THR 8 -9.648 -18.719 -3.246
34 HG21 THR 8 3HG2 THR 8 -7.290 -18.231 -0.726
35 HG22 THR 8 1HG2 THR 8 -5.977 -19.046 -1.573
36 HG23 THR 8 2HG2 THR 8 -7.377 -19.966 -1.025
37 H GLY 9 H GLY 9 -7.809 -14.763 -2.557
38 HA2 GLY 9 1HA GLY 9 -9.541 -15.093 -0.193
39 HA3 GLY 9 2HA GLY 9 -8.416 -13.765 -0.437
40 H GLY 10 H GLY 10 -9.508 -11.933 -0.673
41 HA2 GLY 10 1HA GLY 10 -12.097 -11.995 -2.061
42 HA3 GLY 10 2HA GLY 10 -11.533 -10.713 -1.000
43 H LYS 11 H LYS 11 -11.646 -8.964 -2.293
44 HA LYS 11 HA LYS 11 -10.268 -9.096 -4.892
45 HB2 LYS 11 1HB LYS 11 -12.459 -7.265 -3.906
46 HB3 LYS 11 2HB LYS 11 -11.594 -7.016 -5.418
47 HG2 LYS 11 1HG LYS 11 -12.480 -8.974 -6.370
48 HG3 LYS 11 2HG LYS 11 -13.049 -9.570 -4.808
49 HD2 LYS 11 1HD LYS 11 -14.993 -8.781 -5.810
50 HD3 LYS 11 2HD LYS 11 -14.502 -7.434 -4.781
51 HE2 LYS 11 1HE LYS 11 -15.029 -6.412 -6.806
52 HE3 LYS 11 2HE LYS 11 -13.274 -6.562 -6.864
53 HZ1 LYS 11 3HZ LYS 11 -15.304 -8.140 -8.315
54 HZ2 LYS 11 1HZ LYS 11 -13.738 -8.738 -8.086
55 HZ3 LYS 11 2HZ LYS 11 -13.976 -7.296 -8.936
56 H HIS 12 H HIS 12 -8.203 -8.779 -3.914
57 HA HIS 12 HA HIS 12 -7.762 -6.156 -2.680
58 HB2 HIS 12 1HB HIS 12 -5.897 -7.023 -1.639
59 HB3 HIS 12 2HB HIS 12 -6.891 -8.471 -1.762
60 HD1 HIS 12 HD1 HIS 12 -5.955 -10.400 -3.071
61 HD2 HIS 12 HD2 HIS 12 -3.774 -6.902 -3.591
62 HE1 HIS 12 HE1 HIS 12 -3.895 -11.075 -4.346
63 H PHE 13 H PHE 13 -6.407 -4.638 -3.548
64 HA PHE 13 HA PHE 13 -5.584 -5.115 -6.328
65 HB2 PHE 13 1HB PHE 13 -6.068 -2.517 -4.855
66 HB3 PHE 13 2HB PHE 13 -5.551 -2.644 -6.533
67 HD1 PHE 13 HD2 PHE 13 -8.320 -3.295 -4.193
68 HD2 PHE 13 HD1 PHE 13 -7.095 -3.118 -8.265
69 HE1 PHE 13 HE2 PHE 13 -10.672 -3.416 -4.902
70 HE2 PHE 13 HE1 PHE 13 -9.446 -3.238 -8.981
71 HZ PHE 13 HZ PHE 13 -11.238 -3.389 -7.298
72 H GLU 14 H GLU 14 -3.495 -5.157 -6.861
73 HA GLU 14 HA GLU 14 -1.535 -4.478 -4.782
74 HB2 GLU 14 1HB GLU 14 -1.552 -6.798 -5.741
75 HB3 GLU 14 2HB GLU 14 -1.099 -6.103 -7.291
76 HG2 GLU 14 1HG GLU 14 0.900 -5.105 -6.056
77 HG3 GLU 14 2HG GLU 14 0.497 -6.230 -4.760
78 H CYS 15 H CYS 15 0.058 -3.003 -5.115
79 HA CYS 15 HA CYS 15 -0.325 -1.100 -7.224
80 HB2 CYS 15 1HB CYS 15 0.386 -0.509 -4.890
81 HB3 CYS 15 2HB CYS 15 1.948 -1.243 -5.236
82 H THR 16 H THR 16 0.369 -1.446 -9.222
83 HA THR 16 HA THR 16 2.287 -3.373 -9.951
84 HB THR 16 HB THR 16 1.484 -0.984 -11.614
85 HG1 THR 16 HG1 THR 16 0.060 -3.247 -10.834
86 HG21 THR 16 3HG2 THR 16 1.769 -2.760 -13.442
87 HG22 THR 16 1HG2 THR 16 2.628 -3.697 -12.220
88 HG23 THR 16 2HG2 THR 16 3.232 -2.112 -12.702
89 H GLU 17 H GLU 17 2.707 -0.369 -8.537
90 HA GLU 17 HA GLU 17 5.216 0.278 -9.826
91 HB2 GLU 17 1HB GLU 17 4.011 1.517 -7.349
92 HB3 GLU 17 2HB GLU 17 5.279 2.193 -8.362
93 HG2 GLU 17 1HG GLU 17 2.366 1.875 -8.990
94 HG3 GLU 17 2HG GLU 17 3.323 3.354 -8.925
95 H CYS 18 H CYS 18 4.239 -0.494 -6.481
96 HA CYS 18 HA CYS 18 6.981 -1.439 -5.987
97 HB2 CYS 18 1HB CYS 18 6.428 -1.165 -3.579
98 HB3 CYS 18 2HB CYS 18 6.318 0.341 -4.484
99 H GLY 19 H GLY 19 3.568 -2.276 -5.618
100 HA2 GLY 19 1HA GLY 19 2.957 -4.598 -6.100
101 HA3 GLY 19 2HA GLY 19 4.405 -5.082 -5.230
102 H LYS 20 H LYS 20 2.814 -2.479 -3.770
103 HA LYS 20 HA LYS 20 2.166 -4.014 -1.461
104 HB2 LYS 20 1HB LYS 20 2.779 -1.457 -1.757
105 HB3 LYS 20 2HB LYS 20 1.034 -1.283 -1.884
106 HG2 LYS 20 1HG LYS 20 0.723 -2.239 0.294
107 HG3 LYS 20 2HG LYS 20 2.442 -2.619 0.417
108 HD2 LYS 20 1HD LYS 20 3.043 -0.389 0.684
109 HD3 LYS 20 2HD LYS 20 1.537 0.202 -0.022
110 HE2 LYS 20 1HE LYS 20 1.187 0.618 2.215
111 HE3 LYS 20 2HE LYS 20 0.445 -0.971 2.036
112 HZ1 LYS 20 3HZ LYS 20 1.732 -1.338 3.856
113 HZ2 LYS 20 1HZ LYS 20 2.917 -0.217 3.406
114 HZ3 LYS 20 2HZ LYS 20 2.865 -1.736 2.665
115 H ALA 21 H ALA 21 0.243 -4.785 -0.744
116 HA ALA 21 HA ALA 21 -1.981 -4.725 -2.654
117 HB1 ALA 21 3HB ALA 21 -1.976 -6.483 -0.247
118 HB2 ALA 21 1HB ALA 21 -2.658 -6.765 -1.849
119 HB3 ALA 21 2HB ALA 21 -0.915 -6.874 -1.600
120 H PHE 22 H PHE 22 -3.884 -3.777 -2.213
121 HA PHE 22 HA PHE 22 -4.308 -2.745 0.513
122 HB2 PHE 22 1HB PHE 22 -5.069 -1.370 -2.072
123 HB3 PHE 22 2HB PHE 22 -5.351 -0.753 -0.447
124 HD1 PHE 22 HD2 PHE 22 -2.817 -1.430 -3.009
125 HD2 PHE 22 HD1 PHE 22 -3.586 0.239 0.831
126 HE1 PHE 22 HE2 PHE 22 -0.619 -0.325 -3.052
127 HE2 PHE 22 HE1 PHE 22 -1.390 1.348 0.793
128 HZ PHE 22 HZ PHE 22 0.097 1.066 -1.150
129 H THR 23 H THR 23 -6.271 -3.071 1.406
130 HA THR 23 HA THR 23 -8.067 -4.889 0.089
131 HB THR 23 HB THR 23 -8.225 -3.530 2.783
132 HG1 THR 23 HG1 THR 23 -7.275 -5.308 3.501
133 HG21 THR 23 3HG2 THR 23 -10.141 -5.287 1.337
134 HG22 THR 23 1HG2 THR 23 -10.451 -3.969 2.466
135 HG23 THR 23 2HG2 THR 23 -9.928 -5.542 3.068
136 H ARG 24 H ARG 24 -7.673 -1.657 -0.201
137 HA ARG 24 HA ARG 24 -10.491 -1.278 -0.940
138 HB2 ARG 24 1HB ARG 24 -8.817 0.391 0.872
139 HB3 ARG 24 2HB ARG 24 -9.927 1.220 -0.211
140 HG2 ARG 24 1HG ARG 24 -11.807 0.207 0.762
141 HG3 ARG 24 2HG ARG 24 -10.826 -1.006 1.586
142 HD2 ARG 24 1HD ARG 24 -10.031 0.537 3.155
143 HD3 ARG 24 2HD ARG 24 -10.508 1.918 2.169
144 HE ARG 24 HE ARG 24 -12.651 1.749 3.002
145 HH11 ARG 24 1HH1 ARG 24 -10.780 -1.032 3.943
146 HH12 ARG 24 2HH1 ARG 24 -11.958 -1.602 5.079
147 HH21 ARG 24 1HH2 ARG 24 -14.209 1.009 4.494
148 HH22 ARG 24 2HH2 ARG 24 -13.908 -0.441 5.391
149 H LYS 25 H LYS 25 -10.722 -0.625 -2.972
150 HA LYS 25 HA LYS 25 -8.530 -0.190 -4.684
151 HB2 LYS 25 1HB LYS 25 -10.876 -0.990 -5.294
152 HB3 LYS 25 2HB LYS 25 -11.356 0.701 -5.241
153 HG2 LYS 25 1HG LYS 25 -9.631 1.187 -6.959
154 HG3 LYS 25 2HG LYS 25 -9.319 -0.547 -7.072
155 HD2 LYS 25 1HD LYS 25 -11.805 -0.801 -7.560
156 HD3 LYS 25 2HD LYS 25 -11.829 0.950 -7.784
157 HE2 LYS 25 1HE LYS 25 -9.859 -0.775 -9.244
158 HE3 LYS 25 2HE LYS 25 -11.500 -0.558 -9.849
159 HZ1 LYS 25 3HZ LYS 25 -10.417 1.134 -10.905
160 HZ2 LYS 25 1HZ LYS 25 -9.325 1.397 -9.639
161 HZ3 LYS 25 2HZ LYS 25 -10.919 1.948 -9.509
162 H SER 26 H SER 26 -10.539 1.982 -2.831
163 HA SER 26 HA SER 26 -9.707 4.366 -4.177
164 HB2 SER 26 1HB SER 26 -11.848 4.189 -2.920
165 HB3 SER 26 2HB SER 26 -10.927 4.074 -1.421
166 HG SER 26 HG SER 26 -11.348 6.266 -3.097
167 H THR 27 H THR 27 -8.837 2.816 -1.103
168 HA THR 27 HA THR 27 -7.017 4.714 -0.187
169 HB THR 27 HB THR 27 -7.015 1.719 0.224
170 HG1 THR 27 HG1 THR 27 -8.011 2.311 2.199
171 HG21 THR 27 3HG2 THR 27 -5.788 3.056 2.385
172 HG22 THR 27 1HG2 THR 27 -5.028 3.662 0.915
173 HG23 THR 27 2HG2 THR 27 -5.048 1.930 1.247
174 H LEU 28 H LEU 28 -6.495 1.906 -2.290
175 HA LEU 28 HA LEU 28 -3.705 2.133 -2.503
176 HB2 LEU 28 1HB LEU 28 -4.430 0.123 -3.292
177 HB3 LEU 28 2HB LEU 28 -5.861 0.816 -4.053
178 HG LEU 28 HG LEU 28 -4.379 1.709 -5.854
179 HD11 LEU 28 1HD1 LEU 28 -2.295 1.676 -4.510
180 HD12 LEU 28 2HD1 LEU 28 -2.136 0.885 -6.078
181 HD13 LEU 28 3HD1 LEU 28 -2.300 -0.085 -4.615
182 HD21 LEU 28 3HD2 LEU 28 -4.170 -0.394 -7.011
183 HD22 LEU 28 1HD2 LEU 28 -5.662 -0.396 -6.070
184 HD23 LEU 28 2HD2 LEU 28 -4.252 -1.282 -5.489
185 H SER 29 H SER 29 -6.286 3.373 -4.615
186 HA SER 29 HA SER 29 -4.803 4.541 -6.599
187 HB2 SER 29 1HB SER 29 -7.422 5.220 -5.333
188 HB3 SER 29 2HB SER 29 -6.717 6.375 -6.464
189 HG SER 29 HG SER 29 -8.145 4.382 -7.140
190 H MET 30 H MET 30 -5.359 5.724 -3.338
191 HA MET 30 HA MET 30 -4.170 8.288 -3.794
192 HB2 MET 30 1HB MET 30 -4.730 6.827 -1.207
193 HB3 MET 30 2HB MET 30 -4.274 8.520 -1.340
194 HG2 MET 30 1HG MET 30 -6.336 8.874 -2.713
195 HG3 MET 30 2HG MET 30 -6.806 7.225 -2.309
196 HE1 MET 30 3HE MET 30 -8.035 7.328 1.220
197 HE2 MET 30 1HE MET 30 -8.067 6.563 -0.369
198 HE3 MET 30 2HE MET 30 -6.581 6.558 0.581
199 H HIS 31 H HIS 31 -3.041 5.151 -2.748
200 HA HIS 31 HA HIS 31 -0.506 6.065 -1.788
201 HB2 HIS 31 1HB HIS 31 -1.042 4.037 -0.833
202 HB3 HIS 31 2HB HIS 31 -1.765 3.410 -2.312
203 HD1 HIS 31 HD1 HIS 31 1.584 3.935 -0.673
204 HD2 HIS 31 HD2 HIS 31 -0.066 1.961 -3.935
205 HE1 HIS 31 HE1 HIS 31 3.415 2.457 -1.561
206 H GLN 32 H GLN 32 -1.673 4.632 -4.805
207 HA GLN 32 HA GLN 32 0.747 4.255 -6.104
208 HB2 GLN 32 1HB GLN 32 -1.906 5.093 -7.284
209 HB3 GLN 32 2HB GLN 32 -0.544 4.476 -8.210
210 HG2 GLN 32 1HG GLN 32 -0.686 2.354 -7.026
211 HG3 GLN 32 2HG GLN 32 -2.031 2.971 -6.068
212 HE21 GLN 32 1HE2 GLN 32 -1.683 0.749 -8.101
213 HE22 GLN 32 2HE2 GLN 32 -2.998 0.977 -9.197
214 H LYS 33 H LYS 33 -0.833 7.176 -5.257
215 HA LYS 33 HA LYS 33 0.212 8.897 -7.233
216 HB2 LYS 33 1HB LYS 33 -0.819 9.321 -4.442
217 HB3 LYS 33 2HB LYS 33 -0.135 10.655 -5.361
218 HG2 LYS 33 1HG LYS 33 -1.805 9.990 -7.191
219 HG3 LYS 33 2HG LYS 33 -2.607 9.062 -5.922
220 HD2 LYS 33 1HD LYS 33 -1.904 11.887 -5.333
221 HD3 LYS 33 2HD LYS 33 -3.243 11.589 -6.444
222 HE2 LYS 33 1HE LYS 33 -3.183 10.040 -3.914
223 HE3 LYS 33 2HE LYS 33 -3.578 11.754 -3.808
224 HZ1 LYS 33 3HZ LYS 33 -5.634 11.202 -4.377
225 HZ2 LYS 33 1HZ LYS 33 -5.194 9.600 -4.696
226 HZ3 LYS 33 2HZ LYS 33 -5.064 10.769 -5.910
227 H ILE 34 H ILE 34 1.658 7.349 -4.540
228 HA ILE 34 HA ILE 34 3.773 9.210 -4.093
229 HB ILE 34 HB ILE 34 4.699 7.650 -2.617
230 HG12 ILE 34 1HG1 ILE 34 3.155 5.488 -4.067
231 HG13 ILE 34 2HG1 ILE 34 4.884 5.784 -4.208
232 HG21 ILE 34 1HG2 ILE 34 1.907 8.094 -2.594
233 HG22 ILE 34 2HG2 ILE 34 2.186 6.442 -2.045
234 HG23 ILE 34 3HG2 ILE 34 2.977 7.789 -1.226
235 HD11 ILE 34 3HD1 ILE 34 4.463 3.910 -2.751
236 HD12 ILE 34 1HD1 ILE 34 5.150 5.248 -1.831
237 HD13 ILE 34 2HD1 ILE 34 3.423 4.903 -1.732
238 H HIS 35 H HIS 35 3.129 7.035 -6.581
239 HA HIS 35 HA HIS 35 5.972 6.824 -7.305
240 HB2 HIS 35 1HB HIS 35 3.614 5.256 -8.369
241 HB3 HIS 35 2HB HIS 35 5.301 5.006 -8.807
242 HD1 HIS 35 HD1 HIS 35 6.875 4.346 -6.634
243 HD2 HIS 35 HD2 HIS 35 2.785 3.678 -6.335
244 HE1 HIS 35 HE1 HIS 35 6.599 2.696 -4.757
245 H THR 36 H THR 36 2.983 8.273 -8.159
246 HA THR 36 HA THR 36 3.454 8.726 -10.913
247 HB THR 36 HB THR 36 1.803 10.678 -10.529
248 HG1 THR 36 HG1 THR 36 1.648 11.065 -8.433
249 HG21 THR 36 3HG2 THR 36 1.460 7.867 -10.752
250 HG22 THR 36 1HG2 THR 36 0.380 9.149 -11.298
251 HG23 THR 36 2HG2 THR 36 0.208 8.483 -9.674
252 H GLY 37 H GLY 37 4.166 10.615 -8.004
253 HA2 GLY 37 1HA GLY 37 5.218 12.847 -9.478
254 HA3 GLY 37 2HA GLY 37 5.318 12.602 -7.740
255 H GLU 38 H GLU 38 6.805 11.874 -10.834
256 HA GLU 38 HA GLU 38 9.340 11.424 -9.427
257 HB2 GLU 38 1HB GLU 38 8.101 9.276 -10.276
258 HB3 GLU 38 2HB GLU 38 8.693 9.787 -11.851
259 HG2 GLU 38 1HG GLU 38 10.393 8.421 -11.226
260 HG3 GLU 38 2HG GLU 38 10.983 9.944 -10.565
261 H LYS 39 H LYS 39 11.229 11.853 -10.701
262 HA LYS 39 HA LYS 39 11.335 14.190 -12.035
263 HB2 LYS 39 1HB LYS 39 12.992 11.709 -12.308
264 HB3 LYS 39 2HB LYS 39 13.318 13.091 -13.345
265 HG2 LYS 39 1HG LYS 39 13.317 14.389 -11.058
266 HG3 LYS 39 2HG LYS 39 13.685 12.788 -10.412
267 HD2 LYS 39 1HD LYS 39 15.219 13.950 -12.718
268 HD3 LYS 39 2HD LYS 39 15.653 14.303 -11.044
269 HE2 LYS 39 1HE LYS 39 15.332 11.493 -12.061
270 HE3 LYS 39 2HE LYS 39 16.859 12.366 -12.184
271 HZ1 LYS 39 3HZ LYS 39 15.426 11.502 -9.751
272 HZ2 LYS 39 1HZ LYS 39 16.577 12.740 -9.691
273 HZ3 LYS 39 2HZ LYS 39 17.026 11.192 -10.203
274 HA PRO 40 HA PRO 40 9.379 13.856 -15.952
275 HB2 PRO 40 1HB PRO 40 10.884 15.566 -17.429
276 HB3 PRO 40 2HB PRO 40 9.747 16.111 -16.191
277 HG2 PRO 40 1HG PRO 40 12.717 15.778 -16.020
278 HG3 PRO 40 2HG PRO 40 11.702 17.097 -15.408
279 HD2 PRO 40 1HD PRO 40 12.638 15.120 -13.813
280 HD3 PRO 40 2HD PRO 40 11.076 15.914 -13.532
281 H SER 41 H SER 41 12.832 13.301 -15.738
282 HA SER 41 HA SER 41 13.468 12.473 -18.280
283 HB2 SER 41 1HB SER 41 14.899 12.591 -16.079
284 HB3 SER 41 2HB SER 41 14.481 10.883 -15.950
285 HG SER 41 HG SER 41 15.299 10.719 -18.168
286 H GLY 42 H GLY 42 13.163 10.683 -19.511
287 HA2 GLY 42 1HA GLY 42 11.532 8.521 -18.328
288 HA3 GLY 42 2HA GLY 42 11.228 9.153 -19.939
289 HA PRO 43 HA PRO 43 14.405 5.578 -19.839
290 HB2 PRO 43 1HB PRO 43 12.773 3.520 -20.527
291 HB3 PRO 43 2HB PRO 43 13.106 3.963 -18.849
292 HG2 PRO 43 1HG PRO 43 10.738 4.636 -20.552
293 HG3 PRO 43 2HG PRO 43 10.785 4.118 -18.857
294 HD2 PRO 43 1HD PRO 43 10.474 6.709 -19.579
295 HD3 PRO 43 2HD PRO 43 11.321 6.226 -18.096
296 H SER 44 H SER 44 15.479 5.283 -21.695
297 HA SER 44 HA SER 44 14.347 6.200 -24.167
298 HB2 SER 44 1HB SER 44 16.612 5.426 -25.081
299 HB3 SER 44 2HB SER 44 16.641 6.706 -23.868
300 HG SER 44 HG SER 44 16.767 4.101 -22.919
301 H SER 45 H SER 45 14.289 3.273 -22.539
302 HA SER 45 HA SER 45 13.929 1.091 -23.148
303 HB2 SER 45 1HB SER 45 11.756 2.371 -23.608
304 HB3 SER 45 2HB SER 45 12.199 2.284 -25.313
305 HG SER 45 HG SER 45 12.184 -0.047 -23.741
306 H GLY 46 H GLY 46 16.309 1.897 -24.222
307 HA2 GLY 46 1HA GLY 46 17.767 1.634 -26.007
308 HA3 GLY 46 2HA GLY 46 17.029 0.039 -26.026
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -15.620 -21.975 -5.930
2 HA2 GLY 1 1HA GLY 1 -14.348 -23.388 -7.217
3 HA3 GLY 1 2HA GLY 1 -13.690 -21.946 -7.975
4 H SER 2 H SER 2 -12.262 -24.355 -7.401
5 HA SER 2 HA SER 2 -10.601 -23.797 -5.093
6 HB2 SER 2 1HB SER 2 -11.310 -26.132 -5.962
7 HB3 SER 2 2HB SER 2 -10.030 -25.914 -7.155
8 HG SER 2 HG SER 2 -9.860 -26.442 -4.463
9 H SER 3 H SER 3 -10.418 -21.665 -6.723
10 HA SER 3 HA SER 3 -8.206 -21.896 -8.549
11 HB2 SER 3 1HB SER 3 -9.685 -19.483 -7.476
12 HB3 SER 3 2HB SER 3 -8.426 -19.409 -8.709
13 HG SER 3 HG SER 3 -10.432 -21.227 -9.217
14 H GLY 4 H GLY 4 -8.723 -20.319 -5.397
15 HA2 GLY 4 1HA GLY 4 -6.085 -19.385 -5.081
16 HA3 GLY 4 2HA GLY 4 -7.239 -19.643 -3.781
17 H SER 5 H SER 5 -4.416 -20.769 -5.314
18 HA SER 5 HA SER 5 -4.261 -23.438 -4.778
19 HB2 SER 5 1HB SER 5 -2.465 -22.089 -5.848
20 HB3 SER 5 2HB SER 5 -2.034 -21.452 -4.260
21 HG SER 5 HG SER 5 -1.938 -23.900 -3.783
22 H SER 6 H SER 6 -3.571 -20.807 -2.489
23 HA SER 6 HA SER 6 -4.368 -22.507 -0.282
24 HB2 SER 6 1HB SER 6 -1.899 -22.937 -0.670
25 HB3 SER 6 2HB SER 6 -1.618 -21.255 -0.223
26 HG SER 6 HG SER 6 -3.014 -23.081 1.432
27 H GLY 7 H GLY 7 -5.467 -21.342 1.160
28 HA2 GLY 7 1HA GLY 7 -5.555 -19.411 2.640
29 HA3 GLY 7 2HA GLY 7 -4.921 -18.445 1.316
30 H THR 8 H THR 8 -7.096 -17.501 2.551
31 HA THR 8 HA THR 8 -9.161 -17.812 0.499
32 HB THR 8 HB THR 8 -9.839 -17.802 3.444
33 HG1 THR 8 HG1 THR 8 -10.576 -20.056 2.675
34 HG21 THR 8 3HG2 THR 8 -11.758 -18.730 1.406
35 HG22 THR 8 1HG2 THR 8 -11.395 -17.006 1.383
36 HG23 THR 8 2HG2 THR 8 -12.022 -17.755 2.851
37 H GLY 9 H GLY 9 -9.971 -15.914 -0.159
38 HA2 GLY 9 1HA GLY 9 -10.374 -13.670 1.524
39 HA3 GLY 9 2HA GLY 9 -8.884 -13.471 0.615
40 H GLY 10 H GLY 10 -10.771 -11.621 0.213
41 HA2 GLY 10 1HA GLY 10 -12.316 -12.406 -2.149
42 HA3 GLY 10 2HA GLY 10 -12.498 -10.910 -1.245
43 H LYS 11 H LYS 11 -12.449 -9.769 -3.246
44 HA LYS 11 HA LYS 11 -10.196 -9.892 -4.987
45 HB2 LYS 11 1HB LYS 11 -11.168 -7.824 -5.981
46 HB3 LYS 11 2HB LYS 11 -12.314 -9.153 -5.862
47 HG2 LYS 11 1HG LYS 11 -13.643 -7.516 -5.063
48 HG3 LYS 11 2HG LYS 11 -12.846 -7.939 -3.546
49 HD2 LYS 11 1HD LYS 11 -11.583 -6.036 -3.520
50 HD3 LYS 11 2HD LYS 11 -11.540 -5.910 -5.280
51 HE2 LYS 11 1HE LYS 11 -13.994 -5.395 -3.608
52 HE3 LYS 11 2HE LYS 11 -12.881 -4.135 -4.137
53 HZ1 LYS 11 3HZ LYS 11 -13.598 -5.670 -6.364
54 HZ2 LYS 11 1HZ LYS 11 -13.951 -4.045 -6.055
55 HZ3 LYS 11 2HZ LYS 11 -15.019 -5.254 -5.548
56 H HIS 12 H HIS 12 -8.348 -8.736 -5.005
57 HA HIS 12 HA HIS 12 -8.053 -6.537 -3.081
58 HB2 HIS 12 1HB HIS 12 -7.044 -8.902 -2.430
59 HB3 HIS 12 2HB HIS 12 -5.743 -8.381 -3.497
60 HD1 HIS 12 HD1 HIS 12 -6.682 -8.296 -0.071
61 HD2 HIS 12 HD2 HIS 12 -4.810 -5.627 -2.647
62 HE1 HIS 12 HE1 HIS 12 -5.480 -6.660 1.413
63 H PHE 13 H PHE 13 -6.372 -5.026 -3.593
64 HA PHE 13 HA PHE 13 -5.612 -5.072 -6.440
65 HB2 PHE 13 1HB PHE 13 -6.108 -2.626 -4.731
66 HB3 PHE 13 2HB PHE 13 -5.757 -2.650 -6.457
67 HD1 PHE 13 HD2 PHE 13 -8.201 -4.176 -4.081
68 HD2 PHE 13 HD1 PHE 13 -7.531 -2.359 -7.872
69 HE1 PHE 13 HE2 PHE 13 -10.611 -4.301 -4.564
70 HE2 PHE 13 HE1 PHE 13 -9.939 -2.481 -8.360
71 HZ PHE 13 HZ PHE 13 -11.482 -3.454 -6.706
72 H GLU 14 H GLU 14 -3.508 -5.032 -6.886
73 HA GLU 14 HA GLU 14 -1.645 -4.373 -4.704
74 HB2 GLU 14 1HB GLU 14 -1.689 -6.725 -5.767
75 HB3 GLU 14 2HB GLU 14 -0.922 -5.962 -7.152
76 HG2 GLU 14 1HG GLU 14 1.034 -5.555 -6.022
77 HG3 GLU 14 2HG GLU 14 0.252 -5.572 -4.443
78 H CYS 15 H CYS 15 0.132 -3.055 -5.098
79 HA CYS 15 HA CYS 15 -0.246 -1.117 -7.200
80 HB2 CYS 15 1HB CYS 15 0.485 -0.582 -4.827
81 HB3 CYS 15 2HB CYS 15 2.054 -1.260 -5.249
82 H THR 16 H THR 16 0.457 -1.492 -9.189
83 HA THR 16 HA THR 16 2.323 -3.470 -9.899
84 HB THR 16 HB THR 16 2.349 -2.378 -12.137
85 HG1 THR 16 HG1 THR 16 1.268 -0.484 -12.449
86 HG21 THR 16 3HG2 THR 16 0.328 -3.250 -12.679
87 HG22 THR 16 1HG2 THR 16 -0.518 -2.355 -11.417
88 HG23 THR 16 2HG2 THR 16 0.376 -3.821 -11.011
89 H GLU 17 H GLU 17 2.805 -0.426 -8.539
90 HA GLU 17 HA GLU 17 5.367 0.100 -9.767
91 HB2 GLU 17 1HB GLU 17 3.965 1.406 -7.429
92 HB3 GLU 17 2HB GLU 17 5.482 1.964 -8.120
93 HG2 GLU 17 1HG GLU 17 3.062 1.672 -9.845
94 HG3 GLU 17 2HG GLU 17 3.264 3.091 -8.819
95 H CYS 18 H CYS 18 4.371 -0.426 -6.379
96 HA CYS 18 HA CYS 18 7.052 -1.468 -5.816
97 HB2 CYS 18 1HB CYS 18 6.430 -1.191 -3.438
98 HB3 CYS 18 2HB CYS 18 6.294 0.313 -4.343
99 H GLY 19 H GLY 19 3.624 -2.300 -5.454
100 HA2 GLY 19 1HA GLY 19 3.001 -4.612 -5.988
101 HA3 GLY 19 2HA GLY 19 4.456 -5.118 -5.142
102 H LYS 20 H LYS 20 2.564 -2.547 -3.815
103 HA LYS 20 HA LYS 20 2.017 -4.140 -1.464
104 HB2 LYS 20 1HB LYS 20 2.709 -1.611 -1.632
105 HB3 LYS 20 2HB LYS 20 0.982 -1.356 -1.845
106 HG2 LYS 20 1HG LYS 20 0.489 -2.244 0.286
107 HG3 LYS 20 2HG LYS 20 2.120 -2.893 0.472
108 HD2 LYS 20 1HD LYS 20 3.023 -0.627 0.551
109 HD3 LYS 20 2HD LYS 20 1.402 0.036 0.329
110 HE2 LYS 20 1HE LYS 20 1.934 0.149 2.656
111 HE3 LYS 20 2HE LYS 20 0.723 -1.113 2.436
112 HZ1 LYS 20 3HZ LYS 20 3.242 -1.334 3.618
113 HZ2 LYS 20 1HZ LYS 20 3.269 -2.264 2.205
114 HZ3 LYS 20 2HZ LYS 20 2.090 -2.551 3.384
115 H ALA 21 H ALA 21 0.144 -5.083 -0.950
116 HA ALA 21 HA ALA 21 -2.106 -4.768 -2.793
117 HB1 ALA 21 3HB ALA 21 -1.216 -7.038 -2.284
118 HB2 ALA 21 1HB ALA 21 -1.761 -6.825 -0.619
119 HB3 ALA 21 2HB ALA 21 -2.934 -6.844 -1.937
120 H PHE 22 H PHE 22 -3.679 -3.413 -2.268
121 HA PHE 22 HA PHE 22 -4.159 -2.827 0.573
122 HB2 PHE 22 1HB PHE 22 -5.055 -1.225 -1.830
123 HB3 PHE 22 2HB PHE 22 -5.149 -0.739 -0.140
124 HD1 PHE 22 HD2 PHE 22 -2.828 -1.441 -2.923
125 HD2 PHE 22 HD1 PHE 22 -3.313 0.260 0.949
126 HE1 PHE 22 HE2 PHE 22 -0.606 -0.399 -3.105
127 HE2 PHE 22 HE1 PHE 22 -1.093 1.305 0.772
128 HZ PHE 22 HZ PHE 22 0.265 0.975 -1.256
129 H THR 23 H THR 23 -6.205 -2.955 1.448
130 HA THR 23 HA THR 23 -8.052 -4.688 0.015
131 HB THR 23 HB THR 23 -7.462 -5.172 2.382
132 HG1 THR 23 HG1 THR 23 -9.474 -5.878 2.772
133 HG21 THR 23 3HG2 THR 23 -7.571 -2.593 2.902
134 HG22 THR 23 1HG2 THR 23 -7.971 -3.781 4.142
135 HG23 THR 23 2HG2 THR 23 -9.258 -2.958 3.260
136 H ARG 24 H ARG 24 -7.608 -1.639 -0.370
137 HA ARG 24 HA ARG 24 -10.449 -1.037 -0.653
138 HB2 ARG 24 1HB ARG 24 -8.520 0.480 1.052
139 HB3 ARG 24 2HB ARG 24 -9.765 1.369 0.186
140 HG2 ARG 24 1HG ARG 24 -11.420 -0.256 1.250
141 HG3 ARG 24 2HG ARG 24 -10.093 -0.707 2.322
142 HD2 ARG 24 1HD ARG 24 -9.868 1.813 2.765
143 HD3 ARG 24 2HD ARG 24 -11.470 1.944 2.041
144 HE ARG 24 HE ARG 24 -11.433 -0.036 4.071
145 HH11 ARG 24 1HH1 ARG 24 -11.470 3.409 3.575
146 HH12 ARG 24 2HH1 ARG 24 -12.252 3.750 5.083
147 HH21 ARG 24 1HH2 ARG 24 -12.463 0.399 6.059
148 HH22 ARG 24 2HH2 ARG 24 -12.816 2.037 6.496
149 H LYS 25 H LYS 25 -10.518 -0.846 -2.809
150 HA LYS 25 HA LYS 25 -8.578 -0.191 -4.593
151 HB2 LYS 25 1HB LYS 25 -10.758 -0.925 -5.327
152 HB3 LYS 25 2HB LYS 25 -11.508 0.539 -4.704
153 HG2 LYS 25 1HG LYS 25 -10.217 1.855 -6.350
154 HG3 LYS 25 2HG LYS 25 -9.585 0.345 -7.012
155 HD2 LYS 25 1HD LYS 25 -11.781 -0.361 -7.662
156 HD3 LYS 25 2HD LYS 25 -12.522 1.000 -6.819
157 HE2 LYS 25 1HE LYS 25 -10.560 1.373 -9.065
158 HE3 LYS 25 2HE LYS 25 -12.289 1.185 -9.349
159 HZ1 LYS 25 3HZ LYS 25 -10.861 3.487 -8.526
160 HZ2 LYS 25 1HZ LYS 25 -12.039 3.099 -7.375
161 HZ3 LYS 25 2HZ LYS 25 -12.483 3.348 -8.988
162 H SER 26 H SER 26 -10.627 2.081 -2.810
163 HA SER 26 HA SER 26 -9.667 4.427 -4.052
164 HB2 SER 26 1HB SER 26 -10.975 3.948 -1.371
165 HB3 SER 26 2HB SER 26 -10.564 5.558 -1.962
166 HG SER 26 HG SER 26 -12.434 5.449 -2.910
167 H THR 27 H THR 27 -8.723 2.778 -1.055
168 HA THR 27 HA THR 27 -6.840 4.580 -0.118
169 HB THR 27 HB THR 27 -6.684 1.565 0.063
170 HG1 THR 27 HG1 THR 27 -8.193 3.508 1.402
171 HG21 THR 27 3HG2 THR 27 -4.938 1.791 1.448
172 HG22 THR 27 1HG2 THR 27 -5.689 3.136 2.305
173 HG23 THR 27 2HG2 THR 27 -4.792 3.431 0.816
174 H LEU 28 H LEU 28 -6.279 1.764 -2.232
175 HA LEU 28 HA LEU 28 -3.548 2.122 -2.619
176 HB2 LEU 28 1HB LEU 28 -4.372 0.096 -3.365
177 HB3 LEU 28 2HB LEU 28 -5.720 0.843 -4.219
178 HG LEU 28 HG LEU 28 -4.080 1.688 -5.907
179 HD11 LEU 28 1HD1 LEU 28 -2.090 1.575 -4.460
180 HD12 LEU 28 2HD1 LEU 28 -1.868 0.720 -5.986
181 HD13 LEU 28 3HD1 LEU 28 -2.179 -0.186 -4.506
182 HD21 LEU 28 3HD2 LEU 28 -4.176 -1.304 -5.529
183 HD22 LEU 28 1HD2 LEU 28 -3.835 -0.455 -7.037
184 HD23 LEU 28 2HD2 LEU 28 -5.427 -0.320 -6.291
185 H SER 29 H SER 29 -6.263 3.355 -4.555
186 HA SER 29 HA SER 29 -4.885 4.609 -6.578
187 HB2 SER 29 1HB SER 29 -7.495 5.131 -5.227
188 HB3 SER 29 2HB SER 29 -6.874 6.357 -6.332
189 HG SER 29 HG SER 29 -6.562 4.352 -7.754
190 H MET 30 H MET 30 -5.269 5.607 -3.254
191 HA MET 30 HA MET 30 -4.236 8.260 -3.691
192 HB2 MET 30 1HB MET 30 -4.667 6.733 -1.117
193 HB3 MET 30 2HB MET 30 -4.300 8.448 -1.240
194 HG2 MET 30 1HG MET 30 -6.457 8.445 -2.755
195 HG3 MET 30 2HG MET 30 -6.822 6.997 -1.819
196 HE1 MET 30 3HE MET 30 -7.635 6.851 0.327
197 HE2 MET 30 1HE MET 30 -8.231 8.183 1.318
198 HE3 MET 30 2HE MET 30 -8.961 7.860 -0.255
199 H HIS 31 H HIS 31 -2.967 5.132 -2.852
200 HA HIS 31 HA HIS 31 -0.438 6.115 -1.903
201 HB2 HIS 31 1HB HIS 31 -0.972 4.048 -0.975
202 HB3 HIS 31 2HB HIS 31 -1.575 3.406 -2.500
203 HD1 HIS 31 HD1 HIS 31 1.747 4.414 -0.950
204 HD2 HIS 31 HD2 HIS 31 0.194 1.803 -3.784
205 HE1 HIS 31 HE1 HIS 31 3.688 3.000 -1.696
206 H GLN 32 H GLN 32 -1.622 4.616 -4.891
207 HA GLN 32 HA GLN 32 0.791 4.413 -6.254
208 HB2 GLN 32 1HB GLN 32 -2.025 4.855 -7.225
209 HB3 GLN 32 2HB GLN 32 -0.676 4.665 -8.336
210 HG2 GLN 32 1HG GLN 32 -0.202 2.484 -7.082
211 HG3 GLN 32 2HG GLN 32 -1.828 2.669 -6.426
212 HE21 GLN 32 1HE2 GLN 32 -3.574 2.928 -8.023
213 HE22 GLN 32 2HE2 GLN 32 -3.462 2.051 -9.507
214 H LYS 33 H LYS 33 -0.840 7.195 -5.246
215 HA LYS 33 HA LYS 33 -0.056 8.974 -7.331
216 HB2 LYS 33 1HB LYS 33 -0.967 9.424 -4.491
217 HB3 LYS 33 2HB LYS 33 -0.573 10.744 -5.584
218 HG2 LYS 33 1HG LYS 33 -2.287 9.643 -7.167
219 HG3 LYS 33 2HG LYS 33 -2.837 8.796 -5.719
220 HD2 LYS 33 1HD LYS 33 -3.020 11.067 -4.619
221 HD3 LYS 33 2HD LYS 33 -2.772 11.765 -6.221
222 HE2 LYS 33 1HE LYS 33 -4.732 10.453 -7.020
223 HE3 LYS 33 2HE LYS 33 -5.012 9.940 -5.357
224 HZ1 LYS 33 3HZ LYS 33 -4.812 12.809 -5.957
225 HZ2 LYS 33 1HZ LYS 33 -5.671 12.027 -4.727
226 HZ3 LYS 33 2HZ LYS 33 -6.250 11.994 -6.316
227 H ILE 34 H ILE 34 1.562 7.580 -4.652
228 HA ILE 34 HA ILE 34 3.563 9.632 -4.385
229 HB ILE 34 HB ILE 34 4.529 8.340 -2.711
230 HG12 ILE 34 1HG1 ILE 34 3.199 5.905 -3.919
231 HG13 ILE 34 2HG1 ILE 34 4.903 6.322 -4.064
232 HG21 ILE 34 1HG2 ILE 34 1.934 7.057 -2.271
233 HG22 ILE 34 2HG2 ILE 34 2.812 8.216 -1.275
234 HG23 ILE 34 3HG2 ILE 34 1.843 8.780 -2.635
235 HD11 ILE 34 3HD1 ILE 34 4.695 4.636 -2.407
236 HD12 ILE 34 1HD1 ILE 34 5.072 6.149 -1.583
237 HD13 ILE 34 2HD1 ILE 34 3.421 5.527 -1.575
238 H HIS 35 H HIS 35 3.031 7.013 -6.489
239 HA HIS 35 HA HIS 35 5.840 6.636 -7.134
240 HB2 HIS 35 1HB HIS 35 3.293 5.385 -8.153
241 HB3 HIS 35 2HB HIS 35 4.857 5.068 -8.897
242 HD1 HIS 35 HD1 HIS 35 6.722 4.336 -6.853
243 HD2 HIS 35 HD2 HIS 35 2.690 3.455 -6.379
244 HE1 HIS 35 HE1 HIS 35 6.634 2.483 -5.155
245 H THR 36 H THR 36 2.972 8.152 -8.478
246 HA THR 36 HA THR 36 4.327 8.867 -10.940
247 HB THR 36 HB THR 36 1.925 8.302 -10.978
248 HG1 THR 36 HG1 THR 36 3.009 9.973 -12.404
249 HG21 THR 36 3HG2 THR 36 1.405 10.930 -9.612
250 HG22 THR 36 1HG2 THR 36 1.497 9.415 -8.714
251 HG23 THR 36 2HG2 THR 36 0.268 9.628 -9.961
252 H GLY 37 H GLY 37 3.424 10.355 -7.898
253 HA2 GLY 37 1HA GLY 37 4.267 12.280 -6.930
254 HA3 GLY 37 2HA GLY 37 5.249 12.527 -8.366
255 H GLU 38 H GLU 38 4.391 13.680 -10.127
256 HA GLU 38 HA GLU 38 2.065 15.336 -9.415
257 HB2 GLU 38 1HB GLU 38 4.362 16.404 -9.792
258 HB3 GLU 38 2HB GLU 38 4.135 16.020 -11.493
259 HG2 GLU 38 1HG GLU 38 1.978 17.499 -10.090
260 HG3 GLU 38 2HG GLU 38 3.462 18.360 -10.492
261 H LYS 39 H LYS 39 0.650 16.014 -11.169
262 HA LYS 39 HA LYS 39 -0.449 13.954 -12.608
263 HB2 LYS 39 1HB LYS 39 -0.512 16.929 -12.961
264 HB3 LYS 39 2HB LYS 39 -1.291 15.896 -14.152
265 HG2 LYS 39 1HG LYS 39 -3.054 16.260 -12.774
266 HG3 LYS 39 2HG LYS 39 -2.375 14.833 -11.986
267 HD2 LYS 39 1HD LYS 39 -1.247 16.210 -10.361
268 HD3 LYS 39 2HD LYS 39 -1.748 17.679 -11.202
269 HE2 LYS 39 1HE LYS 39 -4.128 16.967 -10.783
270 HE3 LYS 39 2HE LYS 39 -3.485 15.706 -9.732
271 HZ1 LYS 39 3HZ LYS 39 -3.526 18.611 -9.337
272 HZ2 LYS 39 1HZ LYS 39 -2.255 17.725 -8.657
273 HZ3 LYS 39 2HZ LYS 39 -3.854 17.369 -8.235
274 HA PRO 40 HA PRO 40 2.274 13.135 -15.969
275 HB2 PRO 40 1HB PRO 40 0.506 11.992 -17.683
276 HB3 PRO 40 2HB PRO 40 1.109 11.173 -16.237
277 HG2 PRO 40 1HG PRO 40 -1.481 12.615 -16.657
278 HG3 PRO 40 2HG PRO 40 -1.179 11.072 -15.836
279 HD2 PRO 40 1HD PRO 40 -1.539 13.393 -14.489
280 HD3 PRO 40 2HD PRO 40 -0.481 12.097 -13.894
281 H SER 41 H SER 41 2.164 13.314 -18.504
282 HA SER 41 HA SER 41 2.213 15.959 -19.223
283 HB2 SER 41 1HB SER 41 2.185 15.216 -21.550
284 HB3 SER 41 2HB SER 41 3.168 14.119 -20.580
285 HG SER 41 HG SER 41 1.779 12.561 -20.922
286 H GLY 42 H GLY 42 0.828 17.304 -20.481
287 HA2 GLY 42 1HA GLY 42 -1.709 17.684 -19.600
288 HA3 GLY 42 2HA GLY 42 -1.193 18.148 -21.215
289 HA PRO 43 HA PRO 43 -3.771 15.154 -23.112
290 HB2 PRO 43 1HB PRO 43 -2.173 13.833 -24.864
291 HB3 PRO 43 2HB PRO 43 -2.681 15.509 -25.103
292 HG2 PRO 43 1HG PRO 43 -0.096 14.449 -24.029
293 HG3 PRO 43 2HG PRO 43 -0.372 15.771 -25.177
294 HD2 PRO 43 1HD PRO 43 0.152 16.204 -22.556
295 HD3 PRO 43 2HD PRO 43 -0.889 17.278 -23.512
296 H SER 44 H SER 44 -4.396 13.743 -21.500
297 HA SER 44 HA SER 44 -2.818 11.757 -20.327
298 HB2 SER 44 1HB SER 44 -5.114 12.628 -19.582
299 HB3 SER 44 2HB SER 44 -5.794 11.486 -20.741
300 HG SER 44 HG SER 44 -3.921 10.652 -18.805
301 H SER 45 H SER 45 -2.880 9.450 -20.602
302 HA SER 45 HA SER 45 -2.512 8.647 -23.286
303 HB2 SER 45 1HB SER 45 -2.193 6.397 -22.373
304 HB3 SER 45 2HB SER 45 -1.340 7.587 -21.388
305 HG SER 45 HG SER 45 -3.928 6.591 -20.790
306 H GLY 46 H GLY 46 -5.318 9.115 -21.525
307 HA2 GLY 46 1HA GLY 46 -7.101 8.461 -23.498
308 HA3 GLY 46 2HA GLY 46 -6.893 6.969 -22.593
Start of MODEL 6
1 H1 GLY 1 H GLY 1 6.637 -20.996 -17.267
2 HA2 GLY 1 1HA GLY 1 7.179 -20.499 -14.875
3 HA3 GLY 1 2HA GLY 1 7.640 -18.900 -15.440
4 H SER 2 H SER 2 5.610 -19.721 -13.467
5 HA SER 2 HA SER 2 3.426 -18.126 -14.538
6 HB2 SER 2 1HB SER 2 2.618 -20.296 -15.123
7 HB3 SER 2 2HB SER 2 3.087 -20.964 -13.560
8 HG SER 2 HG SER 2 1.036 -19.072 -14.074
9 H SER 3 H SER 3 2.273 -17.022 -12.984
10 HA SER 3 HA SER 3 3.534 -16.892 -10.374
11 HB2 SER 3 1HB SER 3 1.508 -15.203 -11.820
12 HB3 SER 3 2HB SER 3 1.787 -14.993 -10.092
13 HG SER 3 HG SER 3 3.540 -14.550 -12.246
14 H GLY 4 H GLY 4 2.274 -16.882 -8.388
15 HA2 GLY 4 1HA GLY 4 -0.061 -18.685 -8.573
16 HA3 GLY 4 2HA GLY 4 1.115 -18.753 -7.269
17 H SER 5 H SER 5 -1.585 -16.999 -8.619
18 HA SER 5 HA SER 5 -1.841 -15.549 -6.065
19 HB2 SER 5 1HB SER 5 -1.289 -14.012 -7.907
20 HB3 SER 5 2HB SER 5 -2.686 -14.593 -8.812
21 HG SER 5 HG SER 5 -2.868 -13.426 -6.236
22 H SER 6 H SER 6 -3.421 -16.461 -4.935
23 HA SER 6 HA SER 6 -5.827 -17.380 -6.365
24 HB2 SER 6 1HB SER 6 -4.807 -18.271 -3.657
25 HB3 SER 6 2HB SER 6 -6.209 -18.920 -4.508
26 HG SER 6 HG SER 6 -3.474 -19.196 -5.117
27 H GLY 7 H GLY 7 -7.852 -16.783 -5.637
28 HA2 GLY 7 1HA GLY 7 -8.036 -15.039 -3.296
29 HA3 GLY 7 2HA GLY 7 -8.499 -14.353 -4.846
30 H THR 8 H THR 8 -9.475 -16.251 -2.192
31 HA THR 8 HA THR 8 -11.682 -17.569 -3.454
32 HB THR 8 HB THR 8 -10.981 -18.689 -1.541
33 HG1 THR 8 HG1 THR 8 -12.742 -18.010 0.100
34 HG21 THR 8 3HG2 THR 8 -9.540 -17.237 -0.439
35 HG22 THR 8 1HG2 THR 8 -10.872 -17.390 0.706
36 HG23 THR 8 2HG2 THR 8 -10.752 -15.961 -0.322
37 H GLY 9 H GLY 9 -12.491 -15.567 -4.521
38 HA2 GLY 9 1HA GLY 9 -14.475 -14.312 -4.624
39 HA3 GLY 9 2HA GLY 9 -14.604 -14.414 -2.874
40 H GLY 10 H GLY 10 -12.397 -13.354 -1.882
41 HA2 GLY 10 1HA GLY 10 -12.742 -10.591 -2.193
42 HA3 GLY 10 2HA GLY 10 -11.376 -11.358 -1.397
43 H LYS 11 H LYS 11 -11.665 -9.013 -3.288
44 HA LYS 11 HA LYS 11 -9.598 -9.887 -5.195
45 HB2 LYS 11 1HB LYS 11 -11.918 -8.016 -5.676
46 HB3 LYS 11 2HB LYS 11 -10.536 -8.134 -6.757
47 HG2 LYS 11 1HG LYS 11 -11.050 -10.388 -7.304
48 HG3 LYS 11 2HG LYS 11 -12.269 -10.481 -6.031
49 HD2 LYS 11 1HD LYS 11 -13.455 -10.202 -8.059
50 HD3 LYS 11 2HD LYS 11 -13.495 -8.634 -7.250
51 HE2 LYS 11 1HE LYS 11 -11.400 -8.104 -8.652
52 HE3 LYS 11 2HE LYS 11 -11.881 -9.491 -9.628
53 HZ1 LYS 11 3HZ LYS 11 -12.918 -6.860 -9.650
54 HZ2 LYS 11 1HZ LYS 11 -14.154 -7.956 -9.289
55 HZ3 LYS 11 2HZ LYS 11 -13.247 -8.142 -10.704
56 H HIS 12 H HIS 12 -7.919 -9.141 -3.901
57 HA HIS 12 HA HIS 12 -7.908 -6.415 -2.944
58 HB2 HIS 12 1HB HIS 12 -5.911 -6.951 -1.833
59 HB3 HIS 12 2HB HIS 12 -6.828 -8.455 -1.798
60 HD1 HIS 12 HD1 HIS 12 -5.965 -10.403 -3.284
61 HD2 HIS 12 HD2 HIS 12 -3.561 -7.015 -3.330
62 HE1 HIS 12 HE1 HIS 12 -3.799 -11.130 -4.334
63 H PHE 13 H PHE 13 -6.561 -4.756 -3.645
64 HA PHE 13 HA PHE 13 -5.643 -5.045 -6.415
65 HB2 PHE 13 1HB PHE 13 -6.225 -2.575 -4.769
66 HB3 PHE 13 2HB PHE 13 -5.641 -2.554 -6.429
67 HD1 PHE 13 HD2 PHE 13 -8.340 -4.305 -4.530
68 HD2 PHE 13 HD1 PHE 13 -7.242 -2.077 -7.987
69 HE1 PHE 13 HE2 PHE 13 -10.660 -4.428 -5.342
70 HE2 PHE 13 HE1 PHE 13 -9.560 -2.195 -8.804
71 HZ PHE 13 HZ PHE 13 -11.272 -3.373 -7.481
72 H GLU 14 H GLU 14 -3.547 -5.112 -6.881
73 HA GLU 14 HA GLU 14 -1.629 -4.418 -4.766
74 HB2 GLU 14 1HB GLU 14 -1.705 -6.759 -5.827
75 HB3 GLU 14 2HB GLU 14 -1.000 -6.001 -7.247
76 HG2 GLU 14 1HG GLU 14 0.901 -6.681 -6.227
77 HG3 GLU 14 2HG GLU 14 0.730 -5.102 -5.461
78 H CYS 15 H CYS 15 0.027 -2.996 -5.119
79 HA CYS 15 HA CYS 15 -0.348 -1.078 -7.217
80 HB2 CYS 15 1HB CYS 15 0.421 -0.543 -4.871
81 HB3 CYS 15 2HB CYS 15 1.974 -1.257 -5.293
82 H THR 16 H THR 16 0.364 -1.337 -9.218
83 HA THR 16 HA THR 16 2.228 -3.328 -9.979
84 HB THR 16 HB THR 16 0.462 -2.477 -11.494
85 HG1 THR 16 HG1 THR 16 1.735 -2.702 -13.278
86 HG21 THR 16 3HG2 THR 16 0.940 -0.341 -12.715
87 HG22 THR 16 1HG2 THR 16 2.184 0.001 -11.512
88 HG23 THR 16 2HG2 THR 16 0.495 -0.129 -11.022
89 H GLU 17 H GLU 17 2.723 -0.390 -8.508
90 HA GLU 17 HA GLU 17 5.212 0.254 -9.858
91 HB2 GLU 17 1HB GLU 17 3.936 1.508 -7.420
92 HB3 GLU 17 2HB GLU 17 5.329 2.137 -8.289
93 HG2 GLU 17 1HG GLU 17 3.719 3.419 -9.227
94 HG3 GLU 17 2HG GLU 17 3.642 2.041 -10.324
95 H CYS 18 H CYS 18 4.308 -0.375 -6.461
96 HA CYS 18 HA CYS 18 7.030 -1.374 -5.998
97 HB2 CYS 18 1HB CYS 18 6.502 -1.089 -3.593
98 HB3 CYS 18 2HB CYS 18 6.355 0.413 -4.500
99 H GLY 19 H GLY 19 3.624 -2.184 -5.388
100 HA2 GLY 19 1HA GLY 19 3.008 -4.524 -5.934
101 HA3 GLY 19 2HA GLY 19 4.468 -5.000 -5.079
102 H LYS 20 H LYS 20 2.670 -2.389 -3.755
103 HA LYS 20 HA LYS 20 2.161 -3.858 -1.351
104 HB2 LYS 20 1HB LYS 20 2.626 -1.282 -1.763
105 HB3 LYS 20 2HB LYS 20 0.872 -1.217 -1.877
106 HG2 LYS 20 1HG LYS 20 0.569 -1.731 0.329
107 HG3 LYS 20 2HG LYS 20 2.094 -2.612 0.448
108 HD2 LYS 20 1HD LYS 20 3.348 -0.648 0.632
109 HD3 LYS 20 2HD LYS 20 2.043 0.353 -0.010
110 HE2 LYS 20 1HE LYS 20 2.155 0.766 2.328
111 HE3 LYS 20 2HE LYS 20 0.724 -0.223 2.047
112 HZ1 LYS 20 3HZ LYS 20 1.575 -1.451 3.699
113 HZ2 LYS 20 1HZ LYS 20 3.143 -0.847 3.505
114 HZ3 LYS 20 2HZ LYS 20 2.586 -2.090 2.503
115 H ALA 21 H ALA 21 0.267 -4.660 -0.568
116 HA ALA 21 HA ALA 21 -1.955 -4.818 -2.477
117 HB1 ALA 21 3HB ALA 21 -2.715 -6.735 -1.146
118 HB2 ALA 21 1HB ALA 21 -1.067 -6.951 -1.735
119 HB3 ALA 21 2HB ALA 21 -1.351 -6.505 -0.052
120 H PHE 22 H PHE 22 -3.807 -3.782 -2.120
121 HA PHE 22 HA PHE 22 -4.338 -2.769 0.595
122 HB2 PHE 22 1HB PHE 22 -4.958 -1.433 -2.048
123 HB3 PHE 22 2HB PHE 22 -5.459 -0.830 -0.472
124 HD1 PHE 22 HD1 PHE 22 -3.836 0.113 1.075
125 HD2 PHE 22 HD2 PHE 22 -2.685 -1.237 -2.794
126 HE1 PHE 22 HE1 PHE 22 -1.710 1.335 1.284
127 HE2 PHE 22 HE2 PHE 22 -0.557 -0.019 -2.591
128 HZ PHE 22 HZ PHE 22 -0.067 1.269 -0.549
129 H THR 23 H THR 23 -6.283 -3.199 1.456
130 HA THR 23 HA THR 23 -8.023 -5.030 0.101
131 HB THR 23 HB THR 23 -7.661 -5.227 2.513
132 HG1 THR 23 HG1 THR 23 -10.268 -4.692 1.554
133 HG21 THR 23 3HG2 THR 23 -9.133 -2.597 2.713
134 HG22 THR 23 1HG2 THR 23 -7.416 -2.838 3.031
135 HG23 THR 23 2HG2 THR 23 -8.621 -3.605 4.066
136 H ARG 24 H ARG 24 -7.693 -1.777 -0.163
137 HA ARG 24 HA ARG 24 -10.519 -1.449 -0.922
138 HB2 ARG 24 1HB ARG 24 -8.873 0.840 0.117
139 HB3 ARG 24 2HB ARG 24 -10.621 0.715 -0.020
140 HG2 ARG 24 1HG ARG 24 -10.408 0.429 2.219
141 HG3 ARG 24 2HG ARG 24 -10.249 -1.253 1.709
142 HD2 ARG 24 1HD ARG 24 -7.906 -1.210 1.942
143 HD3 ARG 24 2HD ARG 24 -7.869 0.550 2.032
144 HE ARG 24 HE ARG 24 -8.446 -1.296 4.180
145 HH11 ARG 24 1HH1 ARG 24 -8.660 1.983 3.028
146 HH12 ARG 24 2HH1 ARG 24 -8.810 2.668 4.612
147 HH21 ARG 24 1HH2 ARG 24 -8.642 -0.406 6.271
148 HH22 ARG 24 2HH2 ARG 24 -8.798 1.309 6.456
149 H LYS 25 H LYS 25 -10.929 -0.131 -2.724
150 HA LYS 25 HA LYS 25 -8.762 -0.067 -4.639
151 HB2 LYS 25 1HB LYS 25 -11.026 -0.818 -5.289
152 HB3 LYS 25 2HB LYS 25 -11.648 0.789 -4.937
153 HG2 LYS 25 1HG LYS 25 -9.403 0.563 -6.864
154 HG3 LYS 25 2HG LYS 25 -11.006 0.040 -7.385
155 HD2 LYS 25 1HD LYS 25 -11.919 2.226 -6.773
156 HD3 LYS 25 2HD LYS 25 -10.319 2.748 -6.242
157 HE2 LYS 25 1HE LYS 25 -10.332 3.615 -8.355
158 HE3 LYS 25 2HE LYS 25 -9.650 2.024 -8.688
159 HZ1 LYS 25 3HZ LYS 25 -11.467 1.390 -9.815
160 HZ2 LYS 25 1HZ LYS 25 -11.751 3.050 -9.977
161 HZ3 LYS 25 2HZ LYS 25 -12.542 2.170 -8.768
162 H SER 26 H SER 26 -10.535 2.170 -2.649
163 HA SER 26 HA SER 26 -9.607 4.514 -4.048
164 HB2 SER 26 1HB SER 26 -10.937 4.287 -1.337
165 HB3 SER 26 2HB SER 26 -10.722 5.769 -2.268
166 HG SER 26 HG SER 26 -12.242 5.139 -3.662
167 H THR 27 H THR 27 -8.793 2.781 -1.082
168 HA THR 27 HA THR 27 -6.964 4.612 -0.018
169 HB THR 27 HB THR 27 -7.027 1.600 0.228
170 HG1 THR 27 HG1 THR 27 -8.841 2.816 1.076
171 HG21 THR 27 3HG2 THR 27 -5.579 3.545 2.019
172 HG22 THR 27 1HG2 THR 27 -4.789 2.646 0.725
173 HG23 THR 27 2HG2 THR 27 -5.529 1.783 2.073
174 H LEU 28 H LEU 28 -6.560 2.060 -2.415
175 HA LEU 28 HA LEU 28 -3.716 2.278 -2.548
176 HB2 LEU 28 1HB LEU 28 -4.462 0.225 -3.269
177 HB3 LEU 28 2HB LEU 28 -5.833 0.912 -4.138
178 HG LEU 28 HG LEU 28 -4.190 1.775 -5.837
179 HD11 LEU 28 1HD1 LEU 28 -2.072 1.784 -5.076
180 HD12 LEU 28 2HD1 LEU 28 -2.065 0.127 -5.679
181 HD13 LEU 28 3HD1 LEU 28 -2.348 0.441 -3.967
182 HD21 LEU 28 3HD2 LEU 28 -3.643 -0.815 -6.465
183 HD22 LEU 28 1HD2 LEU 28 -5.174 -0.001 -6.789
184 HD23 LEU 28 2HD2 LEU 28 -4.995 -1.001 -5.346
185 H SER 29 H SER 29 -6.360 3.383 -4.659
186 HA SER 29 HA SER 29 -4.994 4.570 -6.687
187 HB2 SER 29 1HB SER 29 -7.447 5.616 -5.258
188 HB3 SER 29 2HB SER 29 -6.867 6.235 -6.804
189 HG SER 29 HG SER 29 -7.201 4.189 -7.697
190 H MET 30 H MET 30 -5.302 5.723 -3.398
191 HA MET 30 HA MET 30 -4.122 8.293 -3.967
192 HB2 MET 30 1HB MET 30 -4.734 6.914 -1.347
193 HB3 MET 30 2HB MET 30 -4.154 8.568 -1.495
194 HG2 MET 30 1HG MET 30 -6.188 9.059 -2.871
195 HG3 MET 30 2HG MET 30 -6.778 7.454 -2.446
196 HE1 MET 30 3HE MET 30 -7.475 6.681 -0.180
197 HE2 MET 30 1HE MET 30 -5.975 7.092 0.652
198 HE3 MET 30 2HE MET 30 -7.520 7.648 1.295
199 H HIS 31 H HIS 31 -3.067 5.169 -2.787
200 HA HIS 31 HA HIS 31 -0.511 6.015 -1.866
201 HB2 HIS 31 1HB HIS 31 -1.102 3.984 -0.943
202 HB3 HIS 31 2HB HIS 31 -1.809 3.387 -2.442
203 HD1 HIS 31 HD1 HIS 31 1.449 3.689 -0.630
204 HD2 HIS 31 HD2 HIS 31 -0.031 2.094 -4.169
205 HE1 HIS 31 HE1 HIS 31 3.293 2.238 -1.537
206 H GLN 32 H GLN 32 -1.708 4.694 -4.917
207 HA GLN 32 HA GLN 32 0.714 4.272 -6.212
208 HB2 GLN 32 1HB GLN 32 -1.921 5.181 -7.378
209 HB3 GLN 32 2HB GLN 32 -0.568 4.566 -8.318
210 HG2 GLN 32 1HG GLN 32 -0.796 2.501 -6.730
211 HG3 GLN 32 2HG GLN 32 -2.431 3.121 -6.503
212 HE21 GLN 32 1HE2 GLN 32 -3.206 1.202 -7.488
213 HE22 GLN 32 2HE2 GLN 32 -3.179 1.017 -9.206
214 H LYS 33 H LYS 33 -0.715 7.196 -5.224
215 HA LYS 33 HA LYS 33 0.368 8.930 -7.199
216 HB2 LYS 33 1HB LYS 33 -0.628 9.401 -4.390
217 HB3 LYS 33 2HB LYS 33 -0.046 10.701 -5.422
218 HG2 LYS 33 1HG LYS 33 -1.794 9.747 -7.113
219 HG3 LYS 33 2HG LYS 33 -2.515 9.051 -5.660
220 HD2 LYS 33 1HD LYS 33 -1.780 11.956 -5.779
221 HD3 LYS 33 2HD LYS 33 -3.309 11.379 -6.445
222 HE2 LYS 33 1HE LYS 33 -3.578 10.223 -4.136
223 HE3 LYS 33 2HE LYS 33 -2.354 11.377 -3.608
224 HZ1 LYS 33 3HZ LYS 33 -3.791 13.078 -3.719
225 HZ2 LYS 33 1HZ LYS 33 -4.976 11.876 -3.612
226 HZ3 LYS 33 2HZ LYS 33 -4.549 12.509 -5.121
227 H ILE 34 H ILE 34 1.763 7.218 -4.628
228 HA ILE 34 HA ILE 34 3.872 9.042 -3.998
229 HB ILE 34 HB ILE 34 4.783 7.359 -2.638
230 HG12 ILE 34 1HG1 ILE 34 3.145 5.321 -4.162
231 HG13 ILE 34 2HG1 ILE 34 4.865 5.609 -4.399
232 HG21 ILE 34 1HG2 ILE 34 2.520 6.184 -1.785
233 HG22 ILE 34 2HG2 ILE 34 2.950 7.854 -1.418
234 HG23 ILE 34 3HG2 ILE 34 1.840 7.500 -2.742
235 HD11 ILE 34 3HD1 ILE 34 5.148 5.036 -1.949
236 HD12 ILE 34 1HD1 ILE 34 3.486 4.450 -2.003
237 HD13 ILE 34 2HD1 ILE 34 4.715 3.713 -3.031
238 H HIS 35 H HIS 35 3.261 7.032 -6.634
239 HA HIS 35 HA HIS 35 6.116 6.914 -7.342
240 HB2 HIS 35 1HB HIS 35 3.858 5.324 -8.569
241 HB3 HIS 35 2HB HIS 35 5.584 5.091 -8.829
242 HD1 HIS 35 HD1 HIS 35 6.941 4.293 -6.612
243 HD2 HIS 35 HD2 HIS 35 2.813 3.826 -6.557
244 HE1 HIS 35 HE1 HIS 35 6.476 2.642 -4.773
245 H THR 36 H THR 36 2.975 8.060 -8.313
246 HA THR 36 HA THR 36 3.483 8.695 -10.988
247 HB THR 36 HB THR 36 1.687 10.433 -10.707
248 HG1 THR 36 HG1 THR 36 2.154 9.762 -8.038
249 HG21 THR 36 3HG2 THR 36 1.482 7.723 -10.841
250 HG22 THR 36 1HG2 THR 36 0.116 8.833 -10.937
251 HG23 THR 36 2HG2 THR 36 0.527 8.070 -9.400
252 H GLY 37 H GLY 37 4.085 10.528 -8.022
253 HA2 GLY 37 1HA GLY 37 5.628 12.458 -9.646
254 HA3 GLY 37 2HA GLY 37 4.709 12.928 -8.223
255 H GLU 38 H GLU 38 7.023 13.818 -7.885
256 HA GLU 38 HA GLU 38 8.945 13.797 -6.668
257 HB2 GLU 38 1HB GLU 38 7.618 11.442 -5.312
258 HB3 GLU 38 2HB GLU 38 9.002 12.330 -4.690
259 HG2 GLU 38 1HG GLU 38 6.246 13.449 -5.147
260 HG3 GLU 38 2HG GLU 38 6.946 13.009 -3.590
261 H LYS 39 H LYS 39 9.021 12.461 -9.144
262 HA LYS 39 HA LYS 39 10.832 10.204 -8.602
263 HB2 LYS 39 1HB LYS 39 8.715 9.921 -10.060
264 HB3 LYS 39 2HB LYS 39 9.614 10.809 -11.283
265 HG2 LYS 39 1HG LYS 39 11.289 9.124 -11.392
266 HG3 LYS 39 2HG LYS 39 10.631 8.298 -9.977
267 HD2 LYS 39 1HD LYS 39 8.530 7.915 -11.275
268 HD3 LYS 39 2HD LYS 39 9.349 8.574 -12.693
269 HE2 LYS 39 1HE LYS 39 9.434 6.145 -12.709
270 HE3 LYS 39 2HE LYS 39 11.051 6.820 -12.517
271 HZ1 LYS 39 3HZ LYS 39 9.602 6.204 -10.069
272 HZ2 LYS 39 1HZ LYS 39 11.242 6.009 -10.436
273 HZ3 LYS 39 2HZ LYS 39 10.112 4.879 -10.990
274 HA PRO 40 HA PRO 40 14.199 12.702 -9.976
275 HB2 PRO 40 1HB PRO 40 15.975 10.712 -10.481
276 HB3 PRO 40 2HB PRO 40 15.548 11.226 -8.844
277 HG2 PRO 40 1HG PRO 40 14.537 8.890 -10.421
278 HG3 PRO 40 2HG PRO 40 15.010 8.967 -8.713
279 HD2 PRO 40 1HD PRO 40 12.424 9.037 -9.513
280 HD3 PRO 40 2HD PRO 40 13.000 9.892 -8.068
281 H SER 41 H SER 41 15.782 12.772 -11.849
282 HA SER 41 HA SER 41 16.197 12.912 -14.082
283 HB2 SER 41 1HB SER 41 14.403 10.482 -14.292
284 HB3 SER 41 2HB SER 41 15.524 11.057 -15.526
285 HG SER 41 HG SER 41 17.127 10.809 -13.679
286 H GLY 42 H GLY 42 14.168 14.513 -13.014
287 HA2 GLY 42 1HA GLY 42 11.696 14.581 -14.137
288 HA3 GLY 42 2HA GLY 42 12.650 16.031 -13.863
289 HA PRO 43 HA PRO 43 13.020 16.787 -18.160
290 HB2 PRO 43 1HB PRO 43 15.634 17.436 -18.502
291 HB3 PRO 43 2HB PRO 43 14.480 18.495 -17.681
292 HG2 PRO 43 1HG PRO 43 16.496 16.619 -16.507
293 HG3 PRO 43 2HG PRO 43 16.083 18.271 -16.011
294 HD2 PRO 43 1HD PRO 43 15.139 16.084 -14.723
295 HD3 PRO 43 2HD PRO 43 14.208 17.590 -14.856
296 H SER 44 H SER 44 12.583 14.558 -18.768
297 HA SER 44 HA SER 44 14.928 13.308 -20.022
298 HB2 SER 44 1HB SER 44 12.876 11.986 -18.259
299 HB3 SER 44 2HB SER 44 13.779 11.064 -19.461
300 HG SER 44 HG SER 44 14.729 12.416 -17.178
301 H SER 45 H SER 45 14.106 14.409 -21.916
302 HA SER 45 HA SER 45 12.555 12.734 -23.566
303 HB2 SER 45 1HB SER 45 10.651 13.549 -22.299
304 HB3 SER 45 2HB SER 45 11.157 15.220 -22.551
305 HG SER 45 HG SER 45 9.476 14.100 -24.008
306 H GLY 46 H GLY 46 12.177 13.699 -25.728
307 HA2 GLY 46 1HA GLY 46 14.420 14.831 -26.821
308 HA3 GLY 46 2HA GLY 46 12.821 14.968 -27.538
Start of MODEL 7
1 H1 GLY 1 H GLY 1 -1.083 -40.278 -0.594
2 HA2 GLY 1 1HA GLY 1 -3.442 -40.063 0.054
3 HA3 GLY 1 2HA GLY 1 -2.962 -40.563 1.669
4 H SER 2 H SER 2 -1.790 -38.118 -0.648
5 HA SER 2 HA SER 2 -1.700 -36.191 1.561
6 HB2 SER 2 1HB SER 2 -0.271 -34.846 0.019
7 HB3 SER 2 2HB SER 2 0.399 -36.438 0.374
8 HG SER 2 HG SER 2 -1.134 -36.711 -1.749
9 H SER 3 H SER 3 -3.444 -34.962 1.766
10 HA SER 3 HA SER 3 -4.533 -33.637 -0.594
11 HB2 SER 3 1HB SER 3 -5.818 -35.837 0.078
12 HB3 SER 3 2HB SER 3 -6.503 -34.807 1.335
13 HG SER 3 HG SER 3 -7.853 -34.438 -0.286
14 H GLY 4 H GLY 4 -4.918 -31.550 -0.206
15 HA2 GLY 4 1HA GLY 4 -5.627 -30.681 2.494
16 HA3 GLY 4 2HA GLY 4 -4.145 -30.033 1.808
17 H SER 5 H SER 5 -7.053 -29.064 2.490
18 HA SER 5 HA SER 5 -7.788 -27.891 -0.071
19 HB2 SER 5 1HB SER 5 -9.088 -27.902 2.652
20 HB3 SER 5 2HB SER 5 -9.689 -26.904 1.328
21 HG SER 5 HG SER 5 -9.866 -28.875 0.101
22 H SER 6 H SER 6 -6.989 -26.014 -0.710
23 HA SER 6 HA SER 6 -6.663 -23.831 1.169
24 HB2 SER 6 1HB SER 6 -4.479 -25.295 0.983
25 HB3 SER 6 2HB SER 6 -4.272 -24.421 -0.535
26 HG SER 6 HG SER 6 -3.667 -22.753 0.574
27 H GLY 7 H GLY 7 -6.244 -21.772 0.096
28 HA2 GLY 7 1HA GLY 7 -6.103 -21.388 -2.657
29 HA3 GLY 7 2HA GLY 7 -7.809 -21.472 -2.245
30 H THR 8 H THR 8 -5.425 -19.369 -2.843
31 HA THR 8 HA THR 8 -6.237 -17.411 -0.817
32 HB THR 8 HB THR 8 -4.016 -17.156 -2.852
33 HG1 THR 8 HG1 THR 8 -3.642 -17.708 -0.102
34 HG21 THR 8 3HG2 THR 8 -3.318 -15.260 -1.687
35 HG22 THR 8 1HG2 THR 8 -4.253 -15.678 -0.252
36 HG23 THR 8 2HG2 THR 8 -5.073 -15.095 -1.701
37 H GLY 9 H GLY 9 -7.978 -16.265 -1.375
38 HA2 GLY 9 1HA GLY 9 -8.025 -15.078 -4.073
39 HA3 GLY 9 2HA GLY 9 -9.462 -15.853 -3.423
40 H GLY 10 H GLY 10 -10.738 -14.022 -3.433
41 HA2 GLY 10 1HA GLY 10 -11.688 -12.408 -1.950
42 HA3 GLY 10 2HA GLY 10 -10.077 -12.081 -1.327
43 H LYS 11 H LYS 11 -10.836 -9.827 -1.669
44 HA LYS 11 HA LYS 11 -10.321 -8.987 -4.447
45 HB2 LYS 11 1HB LYS 11 -12.296 -7.952 -2.433
46 HB3 LYS 11 2HB LYS 11 -11.715 -6.919 -3.733
47 HG2 LYS 11 1HG LYS 11 -12.815 -9.614 -4.382
48 HG3 LYS 11 2HG LYS 11 -13.915 -8.283 -4.014
49 HD2 LYS 11 1HD LYS 11 -13.656 -8.246 -6.354
50 HD3 LYS 11 2HD LYS 11 -12.625 -6.945 -5.754
51 HE2 LYS 11 1HE LYS 11 -10.693 -8.050 -6.279
52 HE3 LYS 11 2HE LYS 11 -11.424 -9.643 -6.088
53 HZ1 LYS 11 3HZ LYS 11 -12.766 -8.599 -8.193
54 HZ2 LYS 11 1HZ LYS 11 -11.459 -9.668 -8.303
55 HZ3 LYS 11 2HZ LYS 11 -11.202 -8.002 -8.435
56 H HIS 12 H HIS 12 -8.087 -8.780 -3.985
57 HA HIS 12 HA HIS 12 -7.432 -6.492 -2.246
58 HB2 HIS 12 1HB HIS 12 -5.440 -7.508 -1.584
59 HB3 HIS 12 2HB HIS 12 -6.566 -8.861 -1.632
60 HD1 HIS 12 HD1 HIS 12 -6.090 -10.723 -3.287
61 HD2 HIS 12 HD2 HIS 12 -3.537 -7.472 -3.707
62 HE1 HIS 12 HE1 HIS 12 -4.284 -11.486 -4.862
63 H PHE 13 H PHE 13 -6.636 -4.766 -3.240
64 HA PHE 13 HA PHE 13 -5.833 -4.992 -6.038
65 HB2 PHE 13 1HB PHE 13 -6.217 -2.490 -4.385
66 HB3 PHE 13 2HB PHE 13 -6.069 -2.587 -6.136
67 HD1 PHE 13 HD2 PHE 13 -8.258 -3.218 -3.264
68 HD2 PHE 13 HD1 PHE 13 -7.920 -3.241 -7.507
69 HE1 PHE 13 HE2 PHE 13 -10.702 -3.420 -3.454
70 HE2 PHE 13 HE1 PHE 13 -10.364 -3.443 -7.704
71 HZ PHE 13 HZ PHE 13 -11.759 -3.534 -5.676
72 H GLU 14 H GLU 14 -3.759 -5.320 -6.463
73 HA GLU 14 HA GLU 14 -1.726 -4.477 -4.551
74 HB2 GLU 14 1HB GLU 14 -1.525 -6.737 -5.366
75 HB3 GLU 14 2HB GLU 14 -1.585 -6.189 -7.035
76 HG2 GLU 14 1HG GLU 14 0.541 -4.862 -6.447
77 HG3 GLU 14 2HG GLU 14 0.635 -5.933 -5.050
78 H CYS 15 H CYS 15 -0.249 -2.906 -4.905
79 HA CYS 15 HA CYS 15 -0.785 -0.911 -6.827
80 HB2 CYS 15 1HB CYS 15 0.324 -0.509 -4.632
81 HB3 CYS 15 2HB CYS 15 1.761 -1.319 -5.247
82 H THR 16 H THR 16 -0.029 -0.564 -8.829
83 HA THR 16 HA THR 16 1.561 -2.649 -10.068
84 HB THR 16 HB THR 16 0.607 -0.171 -11.477
85 HG1 THR 16 HG1 THR 16 -1.117 -1.265 -10.213
86 HG21 THR 16 3HG2 THR 16 2.127 -1.914 -12.548
87 HG22 THR 16 1HG2 THR 16 0.646 -1.515 -13.417
88 HG23 THR 16 2HG2 THR 16 0.744 -3.006 -12.479
89 H GLU 17 H GLU 17 2.751 -0.729 -8.116
90 HA GLU 17 HA GLU 17 4.892 0.296 -9.860
91 HB2 GLU 17 1HB GLU 17 3.837 1.578 -7.333
92 HB3 GLU 17 2HB GLU 17 5.205 2.156 -8.275
93 HG2 GLU 17 1HG GLU 17 2.506 1.847 -9.523
94 HG3 GLU 17 2HG GLU 17 2.916 3.281 -8.584
95 H CYS 18 H CYS 18 4.184 -0.464 -6.446
96 HA CYS 18 HA CYS 18 6.928 -1.489 -6.186
97 HB2 CYS 18 1HB CYS 18 6.537 -1.275 -3.730
98 HB3 CYS 18 2HB CYS 18 6.441 0.256 -4.593
99 H GLY 19 H GLY 19 3.536 -2.272 -5.590
100 HA2 GLY 19 1HA GLY 19 2.844 -4.569 -6.072
101 HA3 GLY 19 2HA GLY 19 4.342 -5.101 -5.323
102 H LYS 20 H LYS 20 2.461 -2.523 -3.935
103 HA LYS 20 HA LYS 20 2.128 -4.056 -1.508
104 HB2 LYS 20 1HB LYS 20 2.728 -1.556 -1.692
105 HB3 LYS 20 2HB LYS 20 1.016 -1.305 -2.007
106 HG2 LYS 20 1HG LYS 20 0.395 -1.996 0.128
107 HG3 LYS 20 2HG LYS 20 1.936 -2.807 0.414
108 HD2 LYS 20 1HD LYS 20 3.074 -0.668 0.524
109 HD3 LYS 20 2HD LYS 20 1.574 0.177 0.136
110 HE2 LYS 20 1HE LYS 20 1.779 -1.624 2.526
111 HE3 LYS 20 2HE LYS 20 2.313 0.054 2.598
112 HZ1 LYS 20 3HZ LYS 20 0.127 0.161 3.295
113 HZ2 LYS 20 1HZ LYS 20 -0.408 -1.004 2.190
114 HZ3 LYS 20 2HZ LYS 20 -0.010 0.550 1.654
115 H ALA 21 H ALA 21 0.377 -5.170 -0.952
116 HA ALA 21 HA ALA 21 -1.989 -5.027 -2.645
117 HB1 ALA 21 3HB ALA 21 -1.137 -7.230 -2.178
118 HB2 ALA 21 1HB ALA 21 -1.225 -6.937 -0.441
119 HB3 ALA 21 2HB ALA 21 -2.706 -7.042 -1.394
120 H PHE 22 H PHE 22 -3.692 -3.837 -2.125
121 HA PHE 22 HA PHE 22 -4.044 -3.032 0.683
122 HB2 PHE 22 1HB PHE 22 -5.060 -1.690 -1.831
123 HB3 PHE 22 2HB PHE 22 -5.313 -1.111 -0.188
124 HD1 PHE 22 HD2 PHE 22 -2.721 -1.786 -2.738
125 HD2 PHE 22 HD1 PHE 22 -3.701 0.202 0.895
126 HE1 PHE 22 HE2 PHE 22 -0.613 -0.525 -2.864
127 HE2 PHE 22 HE1 PHE 22 -1.595 1.468 0.774
128 HZ PHE 22 HZ PHE 22 -0.047 1.105 -1.106
129 H THR 23 H THR 23 -6.413 -2.530 1.216
130 HA THR 23 HA THR 23 -8.037 -4.804 0.296
131 HB THR 23 HB THR 23 -8.438 -3.195 2.821
132 HG1 THR 23 HG1 THR 23 -6.411 -4.376 2.767
133 HG21 THR 23 3HG2 THR 23 -9.748 -5.550 1.580
134 HG22 THR 23 1HG2 THR 23 -10.435 -4.266 2.574
135 HG23 THR 23 2HG2 THR 23 -9.530 -5.578 3.330
136 H ARG 24 H ARG 24 -7.690 -1.674 -0.403
137 HA ARG 24 HA ARG 24 -10.468 -1.415 -1.233
138 HB2 ARG 24 1HB ARG 24 -9.077 0.702 0.419
139 HB3 ARG 24 2HB ARG 24 -10.646 0.881 -0.353
140 HG2 ARG 24 1HG ARG 24 -11.666 -0.640 1.101
141 HG3 ARG 24 2HG ARG 24 -10.117 -1.291 1.643
142 HD2 ARG 24 1HD ARG 24 -10.675 1.597 2.090
143 HD3 ARG 24 2HD ARG 24 -11.498 0.419 3.112
144 HE ARG 24 HE ARG 24 -8.679 1.067 3.116
145 HH11 ARG 24 1HH1 ARG 24 -11.151 -1.190 4.069
146 HH12 ARG 24 2HH1 ARG 24 -10.206 -1.889 5.342
147 HH21 ARG 24 1HH2 ARG 24 -7.424 0.156 4.789
148 HH22 ARG 24 2HH2 ARG 24 -8.086 -1.121 5.751
149 H LYS 25 H LYS 25 -10.340 -1.050 -3.339
150 HA LYS 25 HA LYS 25 -8.131 -0.354 -4.806
151 HB2 LYS 25 1HB LYS 25 -10.082 -1.200 -5.908
152 HB3 LYS 25 2HB LYS 25 -11.051 0.166 -5.370
153 HG2 LYS 25 1HG LYS 25 -10.656 0.834 -7.496
154 HG3 LYS 25 2HG LYS 25 -9.215 1.512 -6.734
155 HD2 LYS 25 1HD LYS 25 -8.214 0.417 -8.460
156 HD3 LYS 25 2HD LYS 25 -8.260 -0.907 -7.294
157 HE2 LYS 25 1HE LYS 25 -10.486 -1.547 -8.318
158 HE3 LYS 25 2HE LYS 25 -10.119 -0.400 -9.605
159 HZ1 LYS 25 3HZ LYS 25 -9.195 -2.207 -10.541
160 HZ2 LYS 25 1HZ LYS 25 -8.973 -3.012 -9.070
161 HZ3 LYS 25 2HZ LYS 25 -7.874 -1.823 -9.557
162 H SER 26 H SER 26 -10.512 1.799 -3.332
163 HA SER 26 HA SER 26 -9.619 4.204 -4.461
164 HB2 SER 26 1HB SER 26 -11.080 3.558 -1.907
165 HB3 SER 26 2HB SER 26 -10.650 5.217 -2.324
166 HG SER 26 HG SER 26 -12.159 3.467 -3.974
167 H THR 27 H THR 27 -8.779 2.683 -1.357
168 HA THR 27 HA THR 27 -7.026 4.592 -0.390
169 HB THR 27 HB THR 27 -6.777 1.593 -0.081
170 HG1 THR 27 HG1 THR 27 -8.460 3.507 1.023
171 HG21 THR 27 3HG2 THR 27 -4.864 3.324 0.591
172 HG22 THR 27 1HG2 THR 27 -5.247 1.916 1.580
173 HG23 THR 27 2HG2 THR 27 -5.890 3.500 2.015
174 H LEU 28 H LEU 28 -6.233 1.739 -2.374
175 HA LEU 28 HA LEU 28 -3.496 2.203 -2.609
176 HB2 LEU 28 1HB LEU 28 -4.159 0.115 -3.322
177 HB3 LEU 28 2HB LEU 28 -5.516 0.749 -4.251
178 HG LEU 28 HG LEU 28 -3.882 1.615 -5.922
179 HD11 LEU 28 1HD1 LEU 28 -1.601 0.694 -5.871
180 HD12 LEU 28 2HD1 LEU 28 -1.920 0.033 -4.268
181 HD13 LEU 28 3HD1 LEU 28 -1.921 1.779 -4.518
182 HD21 LEU 28 3HD2 LEU 28 -4.376 -0.258 -7.002
183 HD22 LEU 28 1HD2 LEU 28 -4.763 -1.040 -5.469
184 HD23 LEU 28 2HD2 LEU 28 -3.121 -1.119 -6.109
185 H SER 29 H SER 29 -6.118 3.161 -4.821
186 HA SER 29 HA SER 29 -4.740 4.394 -6.811
187 HB2 SER 29 1HB SER 29 -7.255 4.198 -6.578
188 HB3 SER 29 2HB SER 29 -7.194 5.633 -5.556
189 HG SER 29 HG SER 29 -7.530 6.429 -7.548
190 H MET 30 H MET 30 -5.317 5.630 -3.572
191 HA MET 30 HA MET 30 -4.207 8.222 -4.129
192 HB2 MET 30 1HB MET 30 -4.811 6.877 -1.489
193 HB3 MET 30 2HB MET 30 -4.395 8.573 -1.696
194 HG2 MET 30 1HG MET 30 -6.444 8.623 -3.279
195 HG3 MET 30 2HG MET 30 -6.898 7.135 -2.451
196 HE1 MET 30 3HE MET 30 -8.762 7.448 -1.439
197 HE2 MET 30 1HE MET 30 -9.078 8.382 0.023
198 HE3 MET 30 2HE MET 30 -9.345 9.108 -1.562
199 H HIS 31 H HIS 31 -3.049 5.173 -2.855
200 HA HIS 31 HA HIS 31 -0.587 6.150 -1.826
201 HB2 HIS 31 1HB HIS 31 -1.066 4.093 -0.924
202 HB3 HIS 31 2HB HIS 31 -1.742 3.471 -2.426
203 HD1 HIS 31 HD1 HIS 31 1.552 4.032 -0.696
204 HD2 HIS 31 HD2 HIS 31 0.031 2.102 -4.046
205 HE1 HIS 31 HE1 HIS 31 3.437 2.614 -1.568
206 H GLN 32 H GLN 32 -1.527 4.680 -4.910
207 HA GLN 32 HA GLN 32 0.947 4.403 -6.097
208 HB2 GLN 32 1HB GLN 32 -1.689 5.193 -7.341
209 HB3 GLN 32 2HB GLN 32 -0.264 4.743 -8.270
210 HG2 GLN 32 1HG GLN 32 -0.282 2.540 -7.138
211 HG3 GLN 32 2HG GLN 32 -1.788 3.002 -6.347
212 HE21 GLN 32 1HE2 GLN 32 -1.924 0.788 -7.741
213 HE22 GLN 32 2HE2 GLN 32 -2.739 1.013 -9.248
214 H LYS 33 H LYS 33 -0.866 7.299 -5.466
215 HA LYS 33 HA LYS 33 0.321 9.063 -7.273
216 HB2 LYS 33 1HB LYS 33 -0.798 9.490 -4.505
217 HB3 LYS 33 2HB LYS 33 -0.222 10.816 -5.507
218 HG2 LYS 33 1HG LYS 33 -1.854 9.937 -7.274
219 HG3 LYS 33 2HG LYS 33 -2.569 9.009 -5.954
220 HD2 LYS 33 1HD LYS 33 -2.172 11.999 -5.917
221 HD3 LYS 33 2HD LYS 33 -3.680 11.199 -6.366
222 HE2 LYS 33 1HE LYS 33 -4.107 11.563 -4.160
223 HE3 LYS 33 2HE LYS 33 -3.301 10.001 -4.032
224 HZ1 LYS 33 3HZ LYS 33 -2.550 11.867 -2.486
225 HZ2 LYS 33 1HZ LYS 33 -1.777 12.523 -3.841
226 HZ3 LYS 33 2HZ LYS 33 -1.349 10.983 -3.285
227 H ILE 34 H ILE 34 1.741 7.362 -4.740
228 HA ILE 34 HA ILE 34 3.754 9.303 -4.053
229 HB ILE 34 HB ILE 34 4.651 7.706 -2.589
230 HG12 ILE 34 1HG1 ILE 34 3.140 5.558 -4.091
231 HG13 ILE 34 2HG1 ILE 34 4.859 5.892 -4.273
232 HG21 ILE 34 1HG2 ILE 34 1.755 7.906 -2.771
233 HG22 ILE 34 2HG2 ILE 34 2.292 6.464 -1.911
234 HG23 ILE 34 3HG2 ILE 34 2.815 8.058 -1.370
235 HD11 ILE 34 3HD1 ILE 34 5.103 5.400 -1.826
236 HD12 ILE 34 1HD1 ILE 34 3.435 4.830 -1.853
237 HD13 ILE 34 2HD1 ILE 34 4.658 4.028 -2.839
238 H HIS 35 H HIS 35 3.350 6.837 -6.433
239 HA HIS 35 HA HIS 35 6.187 6.692 -7.047
240 HB2 HIS 35 1HB HIS 35 3.789 5.403 -8.366
241 HB3 HIS 35 2HB HIS 35 5.463 5.114 -8.829
242 HD1 HIS 35 HD1 HIS 35 6.977 3.922 -6.973
243 HD2 HIS 35 HD2 HIS 35 2.880 3.872 -6.289
244 HE1 HIS 35 HE1 HIS 35 6.608 2.146 -5.231
245 H THR 36 H THR 36 3.241 8.094 -8.354
246 HA THR 36 HA THR 36 4.589 9.073 -10.727
247 HB THR 36 HB THR 36 2.293 8.393 -11.003
248 HG1 THR 36 HG1 THR 36 3.148 10.423 -12.031
249 HG21 THR 36 3HG2 THR 36 0.999 10.522 -9.520
250 HG22 THR 36 1HG2 THR 36 1.917 9.452 -8.461
251 HG23 THR 36 2HG2 THR 36 0.670 8.789 -9.519
252 H GLY 37 H GLY 37 3.603 10.253 -7.591
253 HA2 GLY 37 1HA GLY 37 5.029 12.144 -6.800
254 HA3 GLY 37 2HA GLY 37 4.645 12.920 -8.329
255 H GLU 38 H GLU 38 4.115 14.483 -6.351
256 HA GLU 38 HA GLU 38 1.199 14.419 -6.130
257 HB2 GLU 38 1HB GLU 38 2.005 13.460 -4.037
258 HB3 GLU 38 2HB GLU 38 3.069 14.838 -3.793
259 HG2 GLU 38 1HG GLU 38 1.197 16.309 -3.510
260 HG3 GLU 38 2HG GLU 38 0.070 15.020 -3.929
261 H LYS 39 H LYS 39 0.256 16.373 -6.356
262 HA LYS 39 HA LYS 39 1.555 18.507 -7.501
263 HB2 LYS 39 1HB LYS 39 -0.991 18.409 -5.890
264 HB3 LYS 39 2HB LYS 39 -0.442 19.873 -6.694
265 HG2 LYS 39 1HG LYS 39 -0.424 18.569 -8.839
266 HG3 LYS 39 2HG LYS 39 -1.229 17.265 -7.963
267 HD2 LYS 39 1HD LYS 39 -2.996 18.436 -8.928
268 HD3 LYS 39 2HD LYS 39 -2.938 19.072 -7.282
269 HE2 LYS 39 1HE LYS 39 -2.137 21.110 -7.954
270 HE3 LYS 39 2HE LYS 39 -1.345 20.449 -9.384
271 HZ1 LYS 39 3HZ LYS 39 -4.008 21.494 -9.081
272 HZ2 LYS 39 1HZ LYS 39 -3.963 20.006 -9.885
273 HZ3 LYS 39 2HZ LYS 39 -3.069 21.314 -10.477
274 HA PRO 40 HA PRO 40 3.700 20.699 -4.361
275 HB2 PRO 40 1HB PRO 40 3.395 23.265 -5.193
276 HB3 PRO 40 2HB PRO 40 4.448 22.107 -6.015
277 HG2 PRO 40 1HG PRO 40 1.670 22.970 -6.718
278 HG3 PRO 40 2HG PRO 40 3.067 22.723 -7.781
279 HD2 PRO 40 1HD PRO 40 1.094 20.887 -7.518
280 HD3 PRO 40 2HD PRO 40 2.782 20.436 -7.833
281 H SER 41 H SER 41 2.817 20.682 -2.373
282 HA SER 41 HA SER 41 0.915 22.783 -1.701
283 HB2 SER 41 1HB SER 41 -0.577 21.239 -0.504
284 HB3 SER 41 2HB SER 41 -0.505 20.843 -2.221
285 HG SER 41 HG SER 41 0.891 19.150 -1.735
286 H GLY 42 H GLY 42 1.352 23.687 0.221
287 HA2 GLY 42 1HA GLY 42 3.610 22.677 1.724
288 HA3 GLY 42 2HA GLY 42 2.755 24.185 2.009
289 HA PRO 43 HA PRO 43 0.609 22.469 5.417
290 HB2 PRO 43 1HB PRO 43 -1.911 23.437 5.130
291 HB3 PRO 43 2HB PRO 43 -0.541 24.449 5.600
292 HG2 PRO 43 1HG PRO 43 -1.812 24.112 2.911
293 HG3 PRO 43 2HG PRO 43 -1.263 25.597 3.710
294 HD2 PRO 43 1HD PRO 43 0.192 24.348 1.798
295 HD3 PRO 43 2HD PRO 43 0.941 25.239 3.139
296 H SER 44 H SER 44 0.026 20.422 5.729
297 HA SER 44 HA SER 44 -1.432 18.984 3.670
298 HB2 SER 44 1HB SER 44 -0.979 16.995 5.115
299 HB3 SER 44 2HB SER 44 0.482 17.863 4.643
300 HG SER 44 HG SER 44 0.807 18.432 6.660
301 H SER 45 H SER 45 -3.384 17.884 4.000
302 HA SER 45 HA SER 45 -5.142 19.179 5.917
303 HB2 SER 45 1HB SER 45 -5.671 18.669 3.423
304 HB3 SER 45 2HB SER 45 -6.000 17.033 3.994
305 HG SER 45 HG SER 45 -7.916 18.063 4.147
306 H GLY 46 H GLY 46 -4.692 18.340 7.917
307 HA2 GLY 46 1HA GLY 46 -4.454 16.752 9.586
308 HA3 GLY 46 2HA GLY 46 -5.972 16.180 8.909
Start of MODEL 8
1 H1 GLY 1 H GLY 1 9.498 -26.978 -19.685
2 HA2 GLY 1 1HA GLY 1 7.911 -25.260 -19.877
3 HA3 GLY 1 2HA GLY 1 6.654 -26.399 -19.417
4 H SER 2 H SER 2 7.240 -23.683 -18.425
5 HA SER 2 HA SER 2 7.378 -24.367 -15.573
6 HB2 SER 2 1HB SER 2 9.577 -23.439 -16.333
7 HB3 SER 2 2HB SER 2 8.744 -21.952 -16.783
8 HG SER 2 HG SER 2 8.998 -23.081 -14.195
9 H SER 3 H SER 3 5.357 -23.969 -14.929
10 HA SER 3 HA SER 3 4.002 -21.553 -15.902
11 HB2 SER 3 1HB SER 3 2.744 -23.618 -16.209
12 HB3 SER 3 2HB SER 3 2.900 -23.997 -14.494
13 HG SER 3 HG SER 3 1.138 -22.346 -15.758
14 H GLY 4 H GLY 4 2.770 -20.263 -14.367
15 HA2 GLY 4 1HA GLY 4 3.527 -20.511 -11.560
16 HA3 GLY 4 2HA GLY 4 4.069 -19.062 -12.392
17 H SER 5 H SER 5 1.657 -20.358 -10.523
18 HA SER 5 HA SER 5 -0.415 -18.568 -11.572
19 HB2 SER 5 1HB SER 5 -0.446 -21.006 -9.839
20 HB3 SER 5 2HB SER 5 -1.757 -19.837 -9.682
21 HG SER 5 HG SER 5 -1.039 -21.427 -11.883
22 H SER 6 H SER 6 -1.018 -16.767 -10.538
23 HA SER 6 HA SER 6 -0.302 -16.396 -7.729
24 HB2 SER 6 1HB SER 6 0.749 -14.255 -8.112
25 HB3 SER 6 2HB SER 6 1.555 -15.454 -9.124
26 HG SER 6 HG SER 6 0.667 -14.590 -10.891
27 H GLY 7 H GLY 7 -1.345 -14.441 -6.793
28 HA2 GLY 7 1HA GLY 7 -3.040 -12.747 -6.917
29 HA3 GLY 7 2HA GLY 7 -3.760 -13.620 -8.262
30 H THR 8 H THR 8 -2.724 -14.810 -5.084
31 HA THR 8 HA THR 8 -5.155 -16.284 -4.756
32 HB THR 8 HB THR 8 -4.251 -16.852 -2.510
33 HG1 THR 8 HG1 THR 8 -2.378 -15.953 -1.810
34 HG21 THR 8 3HG2 THR 8 -3.566 -18.400 -4.082
35 HG22 THR 8 1HG2 THR 8 -2.017 -17.829 -3.464
36 HG23 THR 8 2HG2 THR 8 -2.635 -17.215 -4.998
37 H GLY 9 H GLY 9 -6.503 -16.102 -2.771
38 HA2 GLY 9 1HA GLY 9 -7.430 -14.794 -1.010
39 HA3 GLY 9 2HA GLY 9 -6.682 -13.369 -1.716
40 H GLY 10 H GLY 10 -8.216 -11.995 -2.324
41 HA2 GLY 10 1HA GLY 10 -10.527 -13.094 -3.804
42 HA3 GLY 10 2HA GLY 10 -10.701 -11.801 -2.626
43 H LYS 11 H LYS 11 -10.936 -9.869 -3.504
44 HA LYS 11 HA LYS 11 -9.785 -9.380 -6.165
45 HB2 LYS 11 1HB LYS 11 -12.333 -9.110 -5.545
46 HB3 LYS 11 2HB LYS 11 -11.799 -7.560 -4.910
47 HG2 LYS 11 1HG LYS 11 -10.723 -7.206 -7.208
48 HG3 LYS 11 2HG LYS 11 -11.738 -8.551 -7.735
49 HD2 LYS 11 1HD LYS 11 -12.951 -6.259 -6.244
50 HD3 LYS 11 2HD LYS 11 -12.601 -6.102 -7.967
51 HE2 LYS 11 1HE LYS 11 -13.936 -8.140 -8.384
52 HE3 LYS 11 2HE LYS 11 -14.338 -8.200 -6.669
53 HZ1 LYS 11 3HZ LYS 11 -15.929 -7.060 -8.370
54 HZ2 LYS 11 1HZ LYS 11 -14.895 -5.737 -8.160
55 HZ3 LYS 11 2HZ LYS 11 -15.706 -6.396 -6.830
56 H HIS 12 H HIS 12 -8.047 -9.258 -4.002
57 HA HIS 12 HA HIS 12 -7.753 -6.659 -2.925
58 HB2 HIS 12 1HB HIS 12 -6.659 -8.988 -2.276
59 HB3 HIS 12 2HB HIS 12 -5.368 -8.408 -3.324
60 HD1 HIS 12 HD1 HIS 12 -6.215 -8.468 0.086
61 HD2 HIS 12 HD2 HIS 12 -4.693 -5.540 -2.439
62 HE1 HIS 12 HE1 HIS 12 -5.133 -6.773 1.596
63 H PHE 13 H PHE 13 -6.608 -4.904 -3.594
64 HA PHE 13 HA PHE 13 -5.654 -4.971 -6.368
65 HB2 PHE 13 1HB PHE 13 -6.328 -2.576 -4.648
66 HB3 PHE 13 2HB PHE 13 -5.933 -2.549 -6.363
67 HD1 PHE 13 HD2 PHE 13 -8.433 -3.715 -3.901
68 HD2 PHE 13 HD1 PHE 13 -7.581 -2.910 -7.993
69 HE1 PHE 13 HE2 PHE 13 -10.816 -3.992 -4.448
70 HE2 PHE 13 HE1 PHE 13 -9.963 -3.185 -8.546
71 HZ PHE 13 HZ PHE 13 -11.584 -3.728 -6.773
72 H GLU 14 H GLU 14 -3.540 -5.126 -6.663
73 HA GLU 14 HA GLU 14 -1.731 -4.221 -4.539
74 HB2 GLU 14 1HB GLU 14 -1.587 -6.580 -5.416
75 HB3 GLU 14 2HB GLU 14 -1.054 -5.907 -6.950
76 HG2 GLU 14 1HG GLU 14 0.879 -4.904 -5.832
77 HG3 GLU 14 2HG GLU 14 0.349 -5.607 -4.305
78 H CYS 15 H CYS 15 0.033 -2.876 -4.974
79 HA CYS 15 HA CYS 15 -0.436 -0.932 -7.036
80 HB2 CYS 15 1HB CYS 15 0.389 -0.314 -4.778
81 HB3 CYS 15 2HB CYS 15 1.892 -1.167 -5.118
82 H THR 16 H THR 16 0.276 -1.060 -9.049
83 HA THR 16 HA THR 16 2.024 -3.101 -9.943
84 HB THR 16 HB THR 16 1.473 -0.617 -11.540
85 HG1 THR 16 HG1 THR 16 -0.557 -1.399 -12.018
86 HG21 THR 16 3HG2 THR 16 2.251 -1.838 -13.235
87 HG22 THR 16 1HG2 THR 16 1.120 -3.142 -12.874
88 HG23 THR 16 2HG2 THR 16 2.689 -3.089 -12.072
89 H GLU 17 H GLU 17 2.630 -0.124 -8.475
90 HA GLU 17 HA GLU 17 5.141 0.416 -9.787
91 HB2 GLU 17 1HB GLU 17 4.107 1.598 -7.209
92 HB3 GLU 17 2HB GLU 17 5.353 2.259 -8.258
93 HG2 GLU 17 1HG GLU 17 2.535 1.858 -9.196
94 HG3 GLU 17 2HG GLU 17 3.049 3.321 -8.360
95 H CYS 18 H CYS 18 4.336 -0.254 -6.375
96 HA CYS 18 HA CYS 18 6.999 -1.442 -6.052
97 HB2 CYS 18 1HB CYS 18 6.580 -1.206 -3.624
98 HB3 CYS 18 2HB CYS 18 6.473 0.331 -4.475
99 H GLY 19 H GLY 19 3.572 -2.081 -5.373
100 HA2 GLY 19 1HA GLY 19 2.836 -4.380 -5.983
101 HA3 GLY 19 2HA GLY 19 4.267 -4.945 -5.133
102 H LYS 20 H LYS 20 2.704 -2.269 -3.705
103 HA LYS 20 HA LYS 20 2.096 -3.734 -1.345
104 HB2 LYS 20 1HB LYS 20 2.630 -1.162 -1.766
105 HB3 LYS 20 2HB LYS 20 0.876 -1.058 -1.833
106 HG2 LYS 20 1HG LYS 20 0.621 -1.529 0.377
107 HG3 LYS 20 2HG LYS 20 2.083 -2.516 0.450
108 HD2 LYS 20 1HD LYS 20 2.828 -0.692 1.593
109 HD3 LYS 20 2HD LYS 20 3.227 -0.169 -0.046
110 HE2 LYS 20 1HE LYS 20 1.514 1.354 -0.122
111 HE3 LYS 20 2HE LYS 20 0.524 0.461 1.032
112 HZ1 LYS 20 3HZ LYS 20 1.247 2.348 2.175
113 HZ2 LYS 20 1HZ LYS 20 2.828 2.231 1.582
114 HZ3 LYS 20 2HZ LYS 20 2.270 1.118 2.727
115 H ALA 21 H ALA 21 0.310 -4.804 -0.808
116 HA ALA 21 HA ALA 21 -1.974 -4.729 -2.618
117 HB1 ALA 21 3HB ALA 21 -2.704 -6.742 -1.550
118 HB2 ALA 21 1HB ALA 21 -0.978 -6.890 -1.881
119 HB3 ALA 21 2HB ALA 21 -1.536 -6.534 -0.245
120 H PHE 22 H PHE 22 -3.892 -3.836 -2.151
121 HA PHE 22 HA PHE 22 -4.355 -2.909 0.606
122 HB2 PHE 22 1HB PHE 22 -5.224 -1.426 -1.879
123 HB3 PHE 22 2HB PHE 22 -5.321 -0.868 -0.212
124 HD1 PHE 22 HD2 PHE 22 -2.967 -1.719 -2.934
125 HD2 PHE 22 HD1 PHE 22 -3.525 0.251 0.798
126 HE1 PHE 22 HE2 PHE 22 -0.757 -0.662 -3.165
127 HE2 PHE 22 HE1 PHE 22 -1.316 1.311 0.573
128 HZ PHE 22 HZ PHE 22 0.072 0.854 -1.410
129 H THR 23 H THR 23 -6.371 -3.196 1.437
130 HA THR 23 HA THR 23 -8.084 -5.072 0.101
131 HB THR 23 HB THR 23 -8.568 -3.584 2.689
132 HG1 THR 23 HG1 THR 23 -7.033 -4.856 3.392
133 HG21 THR 23 3HG2 THR 23 -10.634 -4.455 2.240
134 HG22 THR 23 1HG2 THR 23 -9.896 -5.861 3.006
135 HG23 THR 23 2HG2 THR 23 -9.990 -5.763 1.248
136 H ARG 24 H ARG 24 -7.771 -1.760 -0.074
137 HA ARG 24 HA ARG 24 -10.541 -1.483 -1.034
138 HB2 ARG 24 1HB ARG 24 -8.983 0.245 0.818
139 HB3 ARG 24 2HB ARG 24 -10.025 1.047 -0.349
140 HG2 ARG 24 1HG ARG 24 -11.942 0.273 0.617
141 HG3 ARG 24 2HG ARG 24 -11.165 -1.178 1.254
142 HD2 ARG 24 1HD ARG 24 -9.864 0.452 2.768
143 HD3 ARG 24 2HD ARG 24 -11.111 1.619 2.331
144 HE ARG 24 HE ARG 24 -12.554 -0.501 3.152
145 HH11 ARG 24 1HH1 ARG 24 -9.879 1.222 4.567
146 HH12 ARG 24 2HH1 ARG 24 -10.372 0.909 6.198
147 HH21 ARG 24 1HH2 ARG 24 -13.212 -0.919 5.295
148 HH22 ARG 24 2HH2 ARG 24 -12.267 -0.310 6.611
149 H LYS 25 H LYS 25 -10.853 -0.268 -2.887
150 HA LYS 25 HA LYS 25 -8.563 -0.064 -4.623
151 HB2 LYS 25 1HB LYS 25 -10.778 -0.861 -5.418
152 HB3 LYS 25 2HB LYS 25 -11.433 0.745 -5.127
153 HG2 LYS 25 1HG LYS 25 -9.499 1.499 -6.715
154 HG3 LYS 25 2HG LYS 25 -9.559 -0.184 -7.246
155 HD2 LYS 25 1HD LYS 25 -12.119 1.319 -7.040
156 HD3 LYS 25 2HD LYS 25 -11.041 1.690 -8.387
157 HE2 LYS 25 1HE LYS 25 -12.422 0.020 -9.238
158 HE3 LYS 25 2HE LYS 25 -10.969 -0.854 -8.756
159 HZ1 LYS 25 3HZ LYS 25 -12.093 -1.451 -6.680
160 HZ2 LYS 25 1HZ LYS 25 -12.926 -2.030 -8.034
161 HZ3 LYS 25 2HZ LYS 25 -13.497 -0.668 -7.208
162 H SER 26 H SER 26 -10.401 2.060 -2.619
163 HA SER 26 HA SER 26 -9.627 4.484 -3.954
164 HB2 SER 26 1HB SER 26 -10.779 4.074 -1.183
165 HB3 SER 26 2HB SER 26 -10.648 5.617 -2.027
166 HG SER 26 HG SER 26 -12.014 4.674 -3.667
167 H THR 27 H THR 27 -8.676 2.852 -0.944
168 HA THR 27 HA THR 27 -6.783 4.690 -0.062
169 HB THR 27 HB THR 27 -6.951 1.703 0.309
170 HG1 THR 27 HG1 THR 27 -8.355 2.410 1.724
171 HG21 THR 27 3HG2 THR 27 -4.739 1.843 0.790
172 HG22 THR 27 1HG2 THR 27 -5.343 2.471 2.323
173 HG23 THR 27 2HG2 THR 27 -4.798 3.583 1.067
174 H LEU 28 H LEU 28 -6.384 1.905 -2.225
175 HA LEU 28 HA LEU 28 -3.594 2.147 -2.547
176 HB2 LEU 28 1HB LEU 28 -4.357 0.105 -3.238
177 HB3 LEU 28 2HB LEU 28 -5.797 0.780 -3.997
178 HG LEU 28 HG LEU 28 -4.340 1.619 -5.844
179 HD11 LEU 28 1HD1 LEU 28 -2.234 1.624 -4.553
180 HD12 LEU 28 2HD1 LEU 28 -2.104 0.753 -6.080
181 HD13 LEU 28 3HD1 LEU 28 -2.251 -0.140 -4.567
182 HD21 LEU 28 3HD2 LEU 28 -5.111 -1.103 -5.248
183 HD22 LEU 28 1HD2 LEU 28 -3.707 -1.046 -6.314
184 HD23 LEU 28 2HD2 LEU 28 -5.195 -0.214 -6.770
185 H SER 29 H SER 29 -6.268 3.224 -4.643
186 HA SER 29 HA SER 29 -4.898 4.390 -6.688
187 HB2 SER 29 1HB SER 29 -7.471 5.091 -5.328
188 HB3 SER 29 2HB SER 29 -6.836 6.177 -6.564
189 HG SER 29 HG SER 29 -8.055 4.755 -7.674
190 H MET 30 H MET 30 -5.295 5.617 -3.430
191 HA MET 30 HA MET 30 -4.149 8.190 -4.032
192 HB2 MET 30 1HB MET 30 -4.881 6.817 -1.448
193 HB3 MET 30 2HB MET 30 -4.145 8.413 -1.503
194 HG2 MET 30 1HG MET 30 -6.066 9.134 -2.951
195 HG3 MET 30 2HG MET 30 -6.821 7.584 -2.585
196 HE1 MET 30 3HE MET 30 -8.131 7.683 0.755
197 HE2 MET 30 1HE MET 30 -9.036 8.210 -0.664
198 HE3 MET 30 2HE MET 30 -7.864 6.900 -0.803
199 H HIS 31 H HIS 31 -3.032 5.099 -2.857
200 HA HIS 31 HA HIS 31 -0.505 6.021 -1.904
201 HB2 HIS 31 1HB HIS 31 -1.035 4.000 -0.938
202 HB3 HIS 31 2HB HIS 31 -1.761 3.364 -2.411
203 HD1 HIS 31 HD1 HIS 31 1.540 3.770 -0.687
204 HD2 HIS 31 HD2 HIS 31 -0.017 2.020 -4.119
205 HE1 HIS 31 HE1 HIS 31 3.377 2.309 -1.590
206 H GLN 32 H GLN 32 -1.647 4.587 -4.928
207 HA GLN 32 HA GLN 32 0.797 4.205 -6.195
208 HB2 GLN 32 1HB GLN 32 -1.922 4.893 -7.300
209 HB3 GLN 32 2HB GLN 32 -0.542 4.538 -8.331
210 HG2 GLN 32 1HG GLN 32 -0.368 2.349 -7.015
211 HG3 GLN 32 2HG GLN 32 -1.998 2.717 -6.454
212 HE21 GLN 32 1HE2 GLN 32 -3.586 3.208 -8.205
213 HE22 GLN 32 2HE2 GLN 32 -3.500 2.255 -9.644
214 H LYS 33 H LYS 33 -0.699 7.105 -5.271
215 HA LYS 33 HA LYS 33 0.337 8.815 -7.301
216 HB2 LYS 33 1HB LYS 33 -0.760 9.306 -4.539
217 HB3 LYS 33 2HB LYS 33 -0.136 10.614 -5.536
218 HG2 LYS 33 1HG LYS 33 -1.786 9.684 -7.317
219 HG3 LYS 33 2HG LYS 33 -2.567 8.930 -5.926
220 HD2 LYS 33 1HD LYS 33 -2.462 11.295 -4.884
221 HD3 LYS 33 2HD LYS 33 -2.200 11.840 -6.543
222 HE2 LYS 33 1HE LYS 33 -4.282 10.714 -7.216
223 HE3 LYS 33 2HE LYS 33 -4.546 10.227 -5.542
224 HZ1 LYS 33 3HZ LYS 33 -4.316 12.782 -5.136
225 HZ2 LYS 33 1HZ LYS 33 -5.789 12.121 -5.643
226 HZ3 LYS 33 2HZ LYS 33 -4.774 12.883 -6.761
227 H ILE 34 H ILE 34 1.771 7.196 -4.709
228 HA ILE 34 HA ILE 34 3.814 9.124 -4.113
229 HB ILE 34 HB ILE 34 4.741 7.537 -2.651
230 HG12 ILE 34 1HG1 ILE 34 3.187 5.404 -4.134
231 HG13 ILE 34 2HG1 ILE 34 4.920 5.685 -4.262
232 HG21 ILE 34 1HG2 ILE 34 2.400 6.339 -1.872
233 HG22 ILE 34 2HG2 ILE 34 2.934 7.952 -1.404
234 HG23 ILE 34 3HG2 ILE 34 1.835 7.749 -2.768
235 HD11 ILE 34 3HD1 ILE 34 4.728 3.878 -2.815
236 HD12 ILE 34 1HD1 ILE 34 4.983 5.256 -1.745
237 HD13 ILE 34 2HD1 ILE 34 3.363 4.590 -1.955
238 H HIS 35 H HIS 35 3.278 6.999 -6.661
239 HA HIS 35 HA HIS 35 6.146 6.846 -7.301
240 HB2 HIS 35 1HB HIS 35 3.878 5.244 -8.501
241 HB3 HIS 35 2HB HIS 35 5.599 5.008 -8.793
242 HD1 HIS 35 HD1 HIS 35 7.007 4.186 -6.644
243 HD2 HIS 35 HD2 HIS 35 2.874 3.843 -6.388
244 HE1 HIS 35 HE1 HIS 35 6.581 2.582 -4.754
245 H THR 36 H THR 36 3.066 8.059 -8.342
246 HA THR 36 HA THR 36 3.698 8.624 -11.033
247 HB THR 36 HB THR 36 1.853 10.370 -10.815
248 HG1 THR 36 HG1 THR 36 0.618 10.145 -8.849
249 HG21 THR 36 3HG2 THR 36 0.432 8.087 -9.857
250 HG22 THR 36 1HG2 THR 36 1.759 7.541 -10.881
251 HG23 THR 36 2HG2 THR 36 0.573 8.685 -11.509
252 H GLY 37 H GLY 37 4.236 10.385 -8.039
253 HA2 GLY 37 1HA GLY 37 4.754 12.929 -8.799
254 HA3 GLY 37 2HA GLY 37 5.744 12.087 -7.617
255 H GLU 38 H GLU 38 7.525 10.726 -8.524
256 HA GLU 38 HA GLU 38 8.764 12.159 -10.769
257 HB2 GLU 38 1HB GLU 38 9.855 11.973 -8.424
258 HB3 GLU 38 2HB GLU 38 10.229 10.322 -8.898
259 HG2 GLU 38 1HG GLU 38 11.741 10.968 -10.486
260 HG3 GLU 38 2HG GLU 38 10.969 12.531 -10.743
261 H LYS 39 H LYS 39 9.990 10.954 -12.335
262 HA LYS 39 HA LYS 39 9.664 8.093 -12.487
263 HB2 LYS 39 1HB LYS 39 8.487 8.137 -14.665
264 HB3 LYS 39 2HB LYS 39 7.504 8.767 -13.350
265 HG2 LYS 39 1HG LYS 39 8.137 11.066 -14.070
266 HG3 LYS 39 2HG LYS 39 8.938 10.349 -15.470
267 HD2 LYS 39 1HD LYS 39 6.886 10.807 -16.376
268 HD3 LYS 39 2HD LYS 39 6.597 9.173 -15.776
269 HE2 LYS 39 1HE LYS 39 5.901 10.496 -13.591
270 HE3 LYS 39 2HE LYS 39 5.603 11.784 -14.757
271 HZ1 LYS 39 3HZ LYS 39 4.532 9.226 -15.538
272 HZ2 LYS 39 1HZ LYS 39 3.803 10.753 -15.545
273 HZ3 LYS 39 2HZ LYS 39 3.847 9.844 -14.120
274 HA PRO 40 HA PRO 40 13.476 8.557 -14.638
275 HB2 PRO 40 1HB PRO 40 13.593 6.123 -15.836
276 HB3 PRO 40 2HB PRO 40 13.871 6.357 -14.106
277 HG2 PRO 40 1HG PRO 40 11.399 5.435 -15.520
278 HG3 PRO 40 2HG PRO 40 12.136 4.810 -14.033
279 HD2 PRO 40 1HD PRO 40 10.001 6.476 -14.012
280 HD3 PRO 40 2HD PRO 40 11.231 6.484 -12.732
281 H SER 41 H SER 41 14.123 9.347 -16.562
282 HA SER 41 HA SER 41 12.413 10.175 -18.527
283 HB2 SER 41 1HB SER 41 14.999 10.591 -18.129
284 HB3 SER 41 2HB SER 41 15.159 9.348 -19.369
285 HG SER 41 HG SER 41 14.882 11.788 -19.892
286 H GLY 42 H GLY 42 12.577 9.475 -20.926
287 HA2 GLY 42 1HA GLY 42 13.075 7.275 -22.179
288 HA3 GLY 42 2HA GLY 42 11.966 6.596 -20.996
289 HA PRO 43 HA PRO 43 9.561 9.502 -24.088
290 HB2 PRO 43 1HB PRO 43 10.681 9.574 -26.560
291 HB3 PRO 43 2HB PRO 43 11.047 10.764 -25.305
292 HG2 PRO 43 1HG PRO 43 12.611 8.352 -26.142
293 HG3 PRO 43 2HG PRO 43 13.190 9.984 -25.761
294 HD2 PRO 43 1HD PRO 43 13.347 7.935 -23.999
295 HD3 PRO 43 2HD PRO 43 13.111 9.618 -23.487
296 H SER 44 H SER 44 10.885 6.429 -24.326
297 HA SER 44 HA SER 44 9.540 5.429 -26.613
298 HB2 SER 44 1HB SER 44 10.799 4.131 -24.206
299 HB3 SER 44 2HB SER 44 9.941 3.175 -25.414
300 HG SER 44 HG SER 44 11.378 3.991 -26.981
301 H SER 45 H SER 45 7.460 5.004 -26.892
302 HA SER 45 HA SER 45 5.741 4.790 -24.514
303 HB2 SER 45 1HB SER 45 3.912 5.559 -25.891
304 HB3 SER 45 2HB SER 45 5.272 6.659 -26.115
305 HG SER 45 HG SER 45 4.001 5.106 -27.932
306 H GLY 46 H GLY 46 4.915 2.868 -24.039
307 HA2 GLY 46 1HA GLY 46 3.490 1.040 -25.018
308 HA3 GLY 46 2HA GLY 46 4.787 0.844 -26.188
Start of MODEL 9
1 H1 GLY 1 H GLY 1 2.568 -28.155 -19.182
2 HA2 GLY 1 1HA GLY 1 2.710 -27.322 -21.658
3 HA3 GLY 1 2HA GLY 1 1.091 -28.004 -21.711
4 H SER 2 H SER 2 -0.348 -27.209 -19.831
5 HA SER 2 HA SER 2 -0.138 -24.288 -19.808
6 HB2 SER 2 1HB SER 2 -2.229 -25.373 -20.664
7 HB3 SER 2 2HB SER 2 -2.510 -26.006 -19.042
8 HG SER 2 HG SER 2 -2.036 -23.274 -19.268
9 H SER 3 H SER 3 1.038 -23.625 -18.112
10 HA SER 3 HA SER 3 0.837 -24.958 -15.544
11 HB2 SER 3 1HB SER 3 2.994 -24.016 -16.587
12 HB3 SER 3 2HB SER 3 2.390 -22.434 -16.095
13 HG SER 3 HG SER 3 3.396 -22.974 -14.307
14 H GLY 4 H GLY 4 -0.129 -24.173 -13.730
15 HA2 GLY 4 1HA GLY 4 -1.268 -21.476 -13.785
16 HA3 GLY 4 2HA GLY 4 -2.378 -22.824 -13.594
17 H SER 5 H SER 5 -1.004 -20.493 -11.899
18 HA SER 5 HA SER 5 -1.075 -22.053 -9.430
19 HB2 SER 5 1HB SER 5 0.997 -20.996 -8.600
20 HB3 SER 5 2HB SER 5 1.299 -21.979 -10.033
21 HG SER 5 HG SER 5 0.864 -19.178 -10.113
22 H SER 6 H SER 6 -1.331 -20.731 -7.512
23 HA SER 6 HA SER 6 -3.312 -18.843 -7.672
24 HB2 SER 6 1HB SER 6 -1.167 -19.094 -5.550
25 HB3 SER 6 2HB SER 6 -2.652 -18.159 -5.370
26 HG SER 6 HG SER 6 -2.308 -20.717 -4.885
27 H GLY 7 H GLY 7 -3.002 -16.508 -6.692
28 HA2 GLY 7 1HA GLY 7 -0.635 -15.096 -7.436
29 HA3 GLY 7 2HA GLY 7 -1.902 -14.891 -8.637
30 H THR 8 H THR 8 -4.165 -14.650 -7.225
31 HA THR 8 HA THR 8 -3.689 -12.534 -5.244
32 HB THR 8 HB THR 8 -4.128 -11.425 -7.395
33 HG1 THR 8 HG1 THR 8 -5.687 -10.062 -6.570
34 HG21 THR 8 3HG2 THR 8 -5.421 -12.866 -8.677
35 HG22 THR 8 1HG2 THR 8 -6.595 -11.644 -8.189
36 HG23 THR 8 2HG2 THR 8 -6.542 -13.198 -7.357
37 H GLY 9 H GLY 9 -5.289 -12.295 -3.673
38 HA2 GLY 9 1HA GLY 9 -7.193 -14.544 -3.551
39 HA3 GLY 9 2HA GLY 9 -6.516 -13.723 -2.152
40 H GLY 10 H GLY 10 -9.181 -13.977 -4.160
41 HA2 GLY 10 1HA GLY 10 -11.230 -12.921 -4.006
42 HA3 GLY 10 2HA GLY 10 -10.558 -11.888 -2.753
43 H LYS 11 H LYS 11 -10.765 -9.830 -3.297
44 HA LYS 11 HA LYS 11 -10.146 -9.053 -6.071
45 HB2 LYS 11 1HB LYS 11 -12.614 -8.937 -5.348
46 HB3 LYS 11 2HB LYS 11 -12.123 -7.578 -4.345
47 HG2 LYS 11 1HG LYS 11 -12.957 -6.657 -6.344
48 HG3 LYS 11 2HG LYS 11 -11.200 -6.519 -6.439
49 HD2 LYS 11 1HD LYS 11 -11.870 -7.290 -8.557
50 HD3 LYS 11 2HD LYS 11 -11.258 -8.720 -7.721
51 HE2 LYS 11 1HE LYS 11 -13.565 -9.339 -7.136
52 HE3 LYS 11 2HE LYS 11 -14.156 -7.930 -8.016
53 HZ1 LYS 11 3HZ LYS 11 -13.686 -10.444 -9.036
54 HZ2 LYS 11 1HZ LYS 11 -12.429 -9.487 -9.642
55 HZ3 LYS 11 2HZ LYS 11 -14.038 -9.042 -9.914
56 H HIS 12 H HIS 12 -8.178 -9.131 -4.155
57 HA HIS 12 HA HIS 12 -7.860 -6.570 -2.894
58 HB2 HIS 12 1HB HIS 12 -6.857 -8.939 -2.268
59 HB3 HIS 12 2HB HIS 12 -5.550 -8.413 -3.324
60 HD1 HIS 12 HD1 HIS 12 -6.196 -8.553 0.072
61 HD2 HIS 12 HD2 HIS 12 -4.913 -5.480 -2.412
62 HE1 HIS 12 HE1 HIS 12 -5.070 -6.891 1.586
63 H PHE 13 H PHE 13 -6.725 -4.830 -3.575
64 HA PHE 13 HA PHE 13 -5.760 -4.897 -6.342
65 HB2 PHE 13 1HB PHE 13 -6.248 -2.470 -4.610
66 HB3 PHE 13 2HB PHE 13 -6.006 -2.504 -6.353
67 HD1 PHE 13 HD1 PHE 13 -7.774 -3.255 -7.841
68 HD2 PHE 13 HD2 PHE 13 -8.362 -3.057 -3.630
69 HE1 PHE 13 HE1 PHE 13 -10.206 -3.428 -8.176
70 HE2 PHE 13 HE2 PHE 13 -10.794 -3.231 -3.958
71 HZ PHE 13 HZ PHE 13 -11.719 -3.418 -6.233
72 H GLU 14 H GLU 14 -3.658 -4.911 -6.763
73 HA GLU 14 HA GLU 14 -1.794 -4.195 -4.603
74 HB2 GLU 14 1HB GLU 14 -1.776 -6.539 -5.625
75 HB3 GLU 14 2HB GLU 14 -1.114 -5.787 -7.070
76 HG2 GLU 14 1HG GLU 14 0.818 -5.035 -5.857
77 HG3 GLU 14 2HG GLU 14 0.137 -5.617 -4.339
78 H CYS 15 H CYS 15 -0.040 -2.848 -5.003
79 HA CYS 15 HA CYS 15 -0.471 -0.870 -7.042
80 HB2 CYS 15 1HB CYS 15 0.381 -0.412 -4.696
81 HB3 CYS 15 2HB CYS 15 1.918 -1.099 -5.211
82 H THR 16 H THR 16 0.210 -1.051 -9.060
83 HA THR 16 HA THR 16 1.967 -3.071 -9.955
84 HB THR 16 HB THR 16 1.148 -0.538 -11.392
85 HG1 THR 16 HG1 THR 16 -0.694 -1.522 -11.733
86 HG21 THR 16 3HG2 THR 16 1.626 -1.870 -13.432
87 HG22 THR 16 1HG2 THR 16 2.292 -3.142 -12.409
88 HG23 THR 16 2HG2 THR 16 3.063 -1.556 -12.459
89 H GLU 17 H GLU 17 2.563 -0.051 -8.525
90 HA GLU 17 HA GLU 17 5.090 0.462 -9.798
91 HB2 GLU 17 1HB GLU 17 3.790 1.640 -7.338
92 HB3 GLU 17 2HB GLU 17 5.329 2.186 -7.990
93 HG2 GLU 17 1HG GLU 17 2.866 2.138 -9.688
94 HG3 GLU 17 2HG GLU 17 3.201 3.482 -8.598
95 H CYS 18 H CYS 18 4.283 -0.201 -6.385
96 HA CYS 18 HA CYS 18 6.944 -1.379 -6.046
97 HB2 CYS 18 1HB CYS 18 6.454 -1.220 -3.617
98 HB3 CYS 18 2HB CYS 18 6.366 0.337 -4.434
99 H GLY 19 H GLY 19 3.521 -2.101 -5.418
100 HA2 GLY 19 1HA GLY 19 2.784 -4.368 -6.070
101 HA3 GLY 19 2HA GLY 19 4.261 -4.961 -5.324
102 H LYS 20 H LYS 20 2.477 -2.394 -3.822
103 HA LYS 20 HA LYS 20 2.057 -4.022 -1.477
104 HB2 LYS 20 1HB LYS 20 2.735 -1.558 -1.501
105 HB3 LYS 20 2HB LYS 20 1.060 -1.210 -1.908
106 HG2 LYS 20 1HG LYS 20 0.289 -1.791 0.164
107 HG3 LYS 20 2HG LYS 20 1.621 -2.909 0.467
108 HD2 LYS 20 1HD LYS 20 3.138 -0.927 0.631
109 HD3 LYS 20 2HD LYS 20 1.709 0.105 0.534
110 HE2 LYS 20 1HE LYS 20 0.987 -0.465 2.626
111 HE3 LYS 20 2HE LYS 20 1.727 -2.064 2.564
112 HZ1 LYS 20 3HZ LYS 20 3.835 -1.164 3.031
113 HZ2 LYS 20 1HZ LYS 20 2.778 -0.424 4.125
114 HZ3 LYS 20 2HZ LYS 20 3.319 0.425 2.767
115 H ALA 21 H ALA 21 0.228 -4.996 -0.860
116 HA ALA 21 HA ALA 21 -2.094 -4.794 -2.619
117 HB1 ALA 21 3HB ALA 21 -1.272 -6.772 -0.514
118 HB2 ALA 21 1HB ALA 21 -2.891 -6.765 -1.216
119 HB3 ALA 21 2HB ALA 21 -1.483 -7.029 -2.246
120 H PHE 22 H PHE 22 -3.788 -3.584 -2.111
121 HA PHE 22 HA PHE 22 -4.161 -2.801 0.703
122 HB2 PHE 22 1HB PHE 22 -5.021 -1.357 -1.813
123 HB3 PHE 22 2HB PHE 22 -5.337 -0.810 -0.170
124 HD1 PHE 22 HD2 PHE 22 -2.748 -1.326 -2.720
125 HD2 PHE 22 HD1 PHE 22 -3.632 0.223 1.144
126 HE1 PHE 22 HE2 PHE 22 -0.593 -0.140 -2.706
127 HE2 PHE 22 HE1 PHE 22 -1.478 1.411 1.164
128 HZ PHE 22 HZ PHE 22 0.045 1.230 -0.762
129 H THR 23 H THR 23 -6.145 -3.008 1.659
130 HA THR 23 HA THR 23 -7.933 -4.931 0.502
131 HB THR 23 HB THR 23 -9.011 -5.024 2.563
132 HG1 THR 23 HG1 THR 23 -8.485 -3.094 4.079
133 HG21 THR 23 3HG2 THR 23 -6.471 -3.954 3.678
134 HG22 THR 23 1HG2 THR 23 -6.370 -5.313 2.560
135 HG23 THR 23 2HG2 THR 23 -7.319 -5.457 4.040
136 H ARG 24 H ARG 24 -7.583 -1.751 -0.097
137 HA ARG 24 HA ARG 24 -10.387 -1.486 -0.902
138 HB2 ARG 24 1HB ARG 24 -8.844 0.722 0.470
139 HB3 ARG 24 2HB ARG 24 -10.502 0.807 -0.109
140 HG2 ARG 24 1HG ARG 24 -11.325 -0.394 1.641
141 HG3 ARG 24 2HG ARG 24 -9.831 -1.306 1.861
142 HD2 ARG 24 1HD ARG 24 -8.874 0.309 3.161
143 HD3 ARG 24 2HD ARG 24 -9.765 1.616 2.381
144 HE ARG 24 HE ARG 24 -11.715 0.327 3.683
145 HH11 ARG 24 1HH1 ARG 24 -8.567 1.402 4.710
146 HH12 ARG 24 2HH1 ARG 24 -9.047 1.656 6.355
147 HH21 ARG 24 1HH2 ARG 24 -12.359 0.657 5.846
148 HH22 ARG 24 2HH2 ARG 24 -11.203 1.231 7.000
149 H LYS 25 H LYS 25 -10.655 -0.631 -2.886
150 HA LYS 25 HA LYS 25 -8.421 -0.319 -4.593
151 HB2 LYS 25 1HB LYS 25 -10.855 -0.985 -5.167
152 HB3 LYS 25 2HB LYS 25 -11.162 0.745 -5.221
153 HG2 LYS 25 1HG LYS 25 -9.062 0.709 -6.821
154 HG3 LYS 25 2HG LYS 25 -9.576 -0.963 -7.057
155 HD2 LYS 25 1HD LYS 25 -11.578 1.251 -7.241
156 HD3 LYS 25 2HD LYS 25 -10.507 0.920 -8.605
157 HE2 LYS 25 1HE LYS 25 -11.265 -1.459 -8.517
158 HE3 LYS 25 2HE LYS 25 -12.446 -0.983 -7.298
159 HZ1 LYS 25 3HZ LYS 25 -13.806 -0.342 -8.903
160 HZ2 LYS 25 1HZ LYS 25 -12.688 -0.837 -10.072
161 HZ3 LYS 25 2HZ LYS 25 -12.659 0.752 -9.494
162 H SER 26 H SER 26 -10.600 1.996 -3.037
163 HA SER 26 HA SER 26 -9.582 4.313 -4.271
164 HB2 SER 26 1HB SER 26 -10.999 3.904 -1.633
165 HB3 SER 26 2HB SER 26 -10.592 5.496 -2.274
166 HG SER 26 HG SER 26 -11.907 5.078 -4.047
167 H THR 27 H THR 27 -8.797 2.777 -1.166
168 HA THR 27 HA THR 27 -6.957 4.608 -0.207
169 HB THR 27 HB THR 27 -6.898 1.599 0.098
170 HG1 THR 27 HG1 THR 27 -7.797 2.394 2.246
171 HG21 THR 27 3HG2 THR 27 -4.838 3.237 0.701
172 HG22 THR 27 1HG2 THR 27 -5.221 1.775 1.608
173 HG23 THR 27 2HG2 THR 27 -5.771 3.345 2.193
174 H LEU 28 H LEU 28 -6.397 1.834 -2.354
175 HA LEU 28 HA LEU 28 -3.605 2.160 -2.567
176 HB2 LEU 28 1HB LEU 28 -4.286 0.091 -3.270
177 HB3 LEU 28 2HB LEU 28 -5.705 0.723 -4.103
178 HG LEU 28 HG LEU 28 -4.205 1.572 -5.895
179 HD11 LEU 28 1HD1 LEU 28 -1.913 0.428 -5.926
180 HD12 LEU 28 2HD1 LEU 28 -2.142 0.222 -4.190
181 HD13 LEU 28 3HD1 LEU 28 -2.118 1.841 -4.889
182 HD21 LEU 28 3HD2 LEU 28 -4.909 -1.149 -5.294
183 HD22 LEU 28 1HD2 LEU 28 -3.413 -1.091 -6.227
184 HD23 LEU 28 2HD2 LEU 28 -4.870 -0.318 -6.850
185 H SER 29 H SER 29 -6.204 3.093 -4.825
186 HA SER 29 HA SER 29 -4.817 4.297 -6.812
187 HB2 SER 29 1HB SER 29 -7.402 5.111 -5.499
188 HB3 SER 29 2HB SER 29 -6.761 5.993 -6.885
189 HG SER 29 HG SER 29 -6.875 3.225 -7.104
190 H MET 30 H MET 30 -5.321 5.550 -3.577
191 HA MET 30 HA MET 30 -4.209 8.137 -4.168
192 HB2 MET 30 1HB MET 30 -4.811 6.802 -1.524
193 HB3 MET 30 2HB MET 30 -4.339 8.484 -1.720
194 HG2 MET 30 1HG MET 30 -6.415 8.529 -3.335
195 HG3 MET 30 2HG MET 30 -6.909 7.145 -2.362
196 HE1 MET 30 3HE MET 30 -9.105 8.279 -0.884
197 HE2 MET 30 1HE MET 30 -7.884 7.118 -0.360
198 HE3 MET 30 2HE MET 30 -8.324 8.468 0.687
199 H HIS 31 H HIS 31 -3.060 5.089 -2.882
200 HA HIS 31 HA HIS 31 -0.564 6.069 -1.924
201 HB2 HIS 31 1HB HIS 31 -1.074 4.051 -0.941
202 HB3 HIS 31 2HB HIS 31 -1.757 3.380 -2.420
203 HD1 HIS 31 HD1 HIS 31 1.465 3.802 -0.584
204 HD2 HIS 31 HD2 HIS 31 0.084 2.127 -4.126
205 HE1 HIS 31 HE1 HIS 31 3.359 2.389 -1.442
206 H GLN 32 H GLN 32 -1.636 4.608 -4.956
207 HA GLN 32 HA GLN 32 0.826 4.225 -6.182
208 HB2 GLN 32 1HB GLN 32 -1.800 5.031 -7.444
209 HB3 GLN 32 2HB GLN 32 -0.409 4.412 -8.324
210 HG2 GLN 32 1HG GLN 32 -0.673 2.424 -6.594
211 HG3 GLN 32 2HG GLN 32 -2.340 2.997 -6.581
212 HE21 GLN 32 1HE2 GLN 32 -3.440 1.583 -7.754
213 HE22 GLN 32 2HE2 GLN 32 -3.033 1.067 -9.351
214 H LYS 33 H LYS 33 -0.669 7.129 -5.275
215 HA LYS 33 HA LYS 33 0.389 8.844 -7.284
216 HB2 LYS 33 1HB LYS 33 -0.684 9.339 -4.511
217 HB3 LYS 33 2HB LYS 33 -0.083 10.640 -5.531
218 HG2 LYS 33 1HG LYS 33 -1.765 9.616 -7.270
219 HG3 LYS 33 2HG LYS 33 -2.536 8.984 -5.813
220 HD2 LYS 33 1HD LYS 33 -1.795 11.884 -6.101
221 HD3 LYS 33 2HD LYS 33 -3.340 11.249 -6.673
222 HE2 LYS 33 1HE LYS 33 -3.483 10.249 -4.262
223 HE3 LYS 33 2HE LYS 33 -2.303 11.504 -3.884
224 HZ1 LYS 33 3HZ LYS 33 -3.978 13.038 -5.070
225 HZ2 LYS 33 1HZ LYS 33 -4.304 12.544 -3.485
226 HZ3 LYS 33 2HZ LYS 33 -5.092 11.797 -4.782
227 H ILE 34 H ILE 34 1.735 7.309 -4.540
228 HA ILE 34 HA ILE 34 3.815 9.184 -4.000
229 HB ILE 34 HB ILE 34 4.705 7.614 -2.506
230 HG12 ILE 34 1HG1 ILE 34 3.180 5.455 -3.980
231 HG13 ILE 34 2HG1 ILE 34 4.909 5.755 -4.121
232 HG21 ILE 34 1HG2 ILE 34 1.785 7.758 -2.695
233 HG22 ILE 34 2HG2 ILE 34 2.389 6.418 -1.722
234 HG23 ILE 34 3HG2 ILE 34 2.852 8.073 -1.327
235 HD11 ILE 34 3HD1 ILE 34 5.009 5.346 -1.611
236 HD12 ILE 34 1HD1 ILE 34 3.382 4.687 -1.778
237 HD13 ILE 34 2HD1 ILE 34 4.725 3.953 -2.654
238 H HIS 35 H HIS 35 3.279 7.131 -6.576
239 HA HIS 35 HA HIS 35 6.153 6.878 -7.159
240 HB2 HIS 35 1HB HIS 35 3.822 5.372 -8.365
241 HB3 HIS 35 2HB HIS 35 5.521 5.121 -8.757
242 HD1 HIS 35 HD1 HIS 35 7.021 4.361 -6.572
243 HD2 HIS 35 HD2 HIS 35 2.915 3.750 -6.398
244 HE1 HIS 35 HE1 HIS 35 6.671 2.657 -4.756
245 H THR 36 H THR 36 3.102 8.125 -8.313
246 HA THR 36 HA THR 36 3.847 8.757 -10.947
247 HB THR 36 HB THR 36 2.018 10.498 -10.798
248 HG1 THR 36 HG1 THR 36 0.708 10.147 -8.794
249 HG21 THR 36 3HG2 THR 36 1.630 7.600 -10.172
250 HG22 THR 36 1HG2 THR 36 1.265 8.485 -11.653
251 HG23 THR 36 2HG2 THR 36 0.232 8.674 -10.236
252 H GLY 37 H GLY 37 4.147 10.566 -7.921
253 HA2 GLY 37 1HA GLY 37 6.347 11.900 -8.023
254 HA3 GLY 37 2HA GLY 37 5.564 12.696 -9.380
255 H GLU 38 H GLU 38 6.168 12.886 -6.127
256 HA GLU 38 HA GLU 38 3.803 13.919 -5.050
257 HB2 GLU 38 1HB GLU 38 5.582 13.317 -3.575
258 HB3 GLU 38 2HB GLU 38 6.697 14.424 -4.364
259 HG2 GLU 38 1HG GLU 38 5.440 16.323 -3.531
260 HG3 GLU 38 2HG GLU 38 4.265 15.238 -2.788
261 H LYS 39 H LYS 39 2.678 15.529 -5.926
262 HA LYS 39 HA LYS 39 3.917 18.126 -6.218
263 HB2 LYS 39 1HB LYS 39 2.626 16.755 -8.585
264 HB3 LYS 39 2HB LYS 39 3.106 18.446 -8.537
265 HG2 LYS 39 1HG LYS 39 5.454 17.627 -8.070
266 HG3 LYS 39 2HG LYS 39 4.868 16.016 -8.490
267 HD2 LYS 39 1HD LYS 39 4.129 16.914 -10.684
268 HD3 LYS 39 2HD LYS 39 4.860 18.463 -10.256
269 HE2 LYS 39 1HE LYS 39 6.406 17.256 -11.630
270 HE3 LYS 39 2HE LYS 39 7.037 17.285 -9.984
271 HZ1 LYS 39 3HZ LYS 39 6.006 15.035 -11.541
272 HZ2 LYS 39 1HZ LYS 39 5.737 15.018 -9.871
273 HZ3 LYS 39 2HZ LYS 39 7.316 15.099 -10.473
274 HA PRO 40 HA PRO 40 -0.040 19.476 -4.872
275 HB2 PRO 40 1HB PRO 40 -0.094 21.987 -5.902
276 HB3 PRO 40 2HB PRO 40 0.920 21.534 -4.527
277 HG2 PRO 40 1HG PRO 40 1.660 21.819 -7.414
278 HG3 PRO 40 2HG PRO 40 2.543 22.358 -5.975
279 HD2 PRO 40 1HD PRO 40 3.189 20.098 -7.318
280 HD3 PRO 40 2HD PRO 40 3.406 20.260 -5.564
281 H SER 41 H SER 41 0.643 18.844 -8.079
282 HA SER 41 HA SER 41 -1.798 19.857 -9.229
283 HB2 SER 41 1HB SER 41 0.174 17.882 -10.401
284 HB3 SER 41 2HB SER 41 -1.054 18.792 -11.281
285 HG SER 41 HG SER 41 0.149 20.690 -10.281
286 H GLY 42 H GLY 42 -3.277 18.349 -10.428
287 HA2 GLY 42 1HA GLY 42 -4.285 16.393 -8.589
288 HA3 GLY 42 2HA GLY 42 -4.957 16.787 -10.165
289 HA PRO 43 HA PRO 43 -2.693 12.614 -10.126
290 HB2 PRO 43 1HB PRO 43 -4.877 11.007 -10.277
291 HB3 PRO 43 2HB PRO 43 -4.157 11.508 -8.742
292 HG2 PRO 43 1HG PRO 43 -6.546 12.618 -10.165
293 HG3 PRO 43 2HG PRO 43 -6.332 12.274 -8.439
294 HD2 PRO 43 1HD PRO 43 -6.115 14.770 -9.465
295 HD3 PRO 43 2HD PRO 43 -5.167 14.228 -8.065
296 H SER 44 H SER 44 -5.576 13.740 -11.848
297 HA SER 44 HA SER 44 -4.687 12.334 -14.262
298 HB2 SER 44 1HB SER 44 -7.064 12.092 -13.489
299 HB3 SER 44 2HB SER 44 -7.290 13.811 -13.813
300 HG SER 44 HG SER 44 -7.465 13.371 -15.856
301 H SER 45 H SER 45 -2.999 13.663 -14.916
302 HA SER 45 HA SER 45 -3.810 16.038 -16.341
303 HB2 SER 45 1HB SER 45 -3.273 16.758 -13.943
304 HB3 SER 45 2HB SER 45 -1.598 16.349 -14.311
305 HG SER 45 HG SER 45 -2.010 18.547 -14.718
306 H GLY 46 H GLY 46 -2.148 16.838 -17.780
307 HA2 GLY 46 1HA GLY 46 -0.242 16.655 -19.089
308 HA3 GLY 46 2HA GLY 46 0.314 15.357 -18.043
Start of MODEL 10
1 H1 GLY 1 H GLY 1 1.646 -21.867 -19.873
2 HA2 GLY 1 1HA GLY 1 3.189 -20.971 -18.051
3 HA3 GLY 1 2HA GLY 1 3.334 -19.573 -19.105
4 H SER 2 H SER 2 1.963 -20.480 -16.363
5 HA SER 2 HA SER 2 0.051 -18.384 -16.362
6 HB2 SER 2 1HB SER 2 -1.051 -20.438 -17.602
7 HB3 SER 2 2HB SER 2 -1.283 -21.032 -15.957
8 HG SER 2 HG SER 2 -1.986 -18.394 -16.368
9 H SER 3 H SER 3 -0.184 -17.674 -14.335
10 HA SER 3 HA SER 3 0.452 -19.526 -12.133
11 HB2 SER 3 1HB SER 3 1.424 -17.532 -10.940
12 HB3 SER 3 2HB SER 3 2.334 -18.047 -12.361
13 HG SER 3 HG SER 3 2.089 -15.825 -12.433
14 H GLY 4 H GLY 4 -0.650 -19.198 -10.165
15 HA2 GLY 4 1HA GLY 4 -2.815 -17.225 -10.158
16 HA3 GLY 4 2HA GLY 4 -3.253 -18.921 -10.017
17 H SER 5 H SER 5 -1.612 -16.240 -8.462
18 HA SER 5 HA SER 5 -0.697 -17.467 -6.153
19 HB2 SER 5 1HB SER 5 -1.700 -14.683 -6.704
20 HB3 SER 5 2HB SER 5 -1.165 -15.153 -5.091
21 HG SER 5 HG SER 5 0.376 -15.338 -7.470
22 H SER 6 H SER 6 -1.567 -17.913 -4.151
23 HA SER 6 HA SER 6 -4.414 -17.458 -3.711
24 HB2 SER 6 1HB SER 6 -4.242 -19.669 -4.840
25 HB3 SER 6 2HB SER 6 -3.198 -20.226 -3.533
26 HG SER 6 HG SER 6 -5.888 -19.351 -3.289
27 H GLY 7 H GLY 7 -5.030 -17.486 -1.538
28 HA2 GLY 7 1HA GLY 7 -3.868 -18.417 0.689
29 HA3 GLY 7 2HA GLY 7 -2.831 -17.049 0.310
30 H THR 8 H THR 8 -4.611 -15.179 -0.581
31 HA THR 8 HA THR 8 -6.815 -14.918 1.256
32 HB THR 8 HB THR 8 -4.517 -12.968 1.502
33 HG1 THR 8 HG1 THR 8 -5.382 -14.548 3.644
34 HG21 THR 8 3HG2 THR 8 -6.115 -12.559 3.651
35 HG22 THR 8 1HG2 THR 8 -7.313 -12.991 2.432
36 HG23 THR 8 2HG2 THR 8 -6.221 -11.634 2.154
37 H GLY 9 H GLY 9 -8.378 -14.022 0.092
38 HA2 GLY 9 1HA GLY 9 -7.662 -12.343 -2.201
39 HA3 GLY 9 2HA GLY 9 -9.222 -13.102 -1.924
40 H GLY 10 H GLY 10 -10.784 -11.700 -1.502
41 HA2 GLY 10 1HA GLY 10 -11.887 -10.012 -0.337
42 HA3 GLY 10 2HA GLY 10 -10.369 -9.590 0.439
43 H LYS 11 H LYS 11 -11.092 -9.816 -3.021
44 HA LYS 11 HA LYS 11 -10.560 -8.331 -4.696
45 HB2 LYS 11 1HB LYS 11 -12.475 -6.979 -2.843
46 HB3 LYS 11 2HB LYS 11 -11.813 -6.058 -4.188
47 HG2 LYS 11 1HG LYS 11 -12.594 -7.956 -5.680
48 HG3 LYS 11 2HG LYS 11 -13.504 -8.536 -4.283
49 HD2 LYS 11 1HD LYS 11 -14.884 -6.654 -4.251
50 HD3 LYS 11 2HD LYS 11 -13.763 -5.700 -5.225
51 HE2 LYS 11 1HE LYS 11 -15.068 -8.156 -6.340
52 HE3 LYS 11 2HE LYS 11 -15.916 -6.610 -6.326
53 HZ1 LYS 11 3HZ LYS 11 -13.568 -5.893 -7.363
54 HZ2 LYS 11 1HZ LYS 11 -14.898 -6.363 -8.297
55 HZ3 LYS 11 2HZ LYS 11 -13.674 -7.477 -7.948
56 H HIS 12 H HIS 12 -8.398 -8.492 -3.032
57 HA HIS 12 HA HIS 12 -7.563 -5.872 -2.179
58 HB2 HIS 12 1HB HIS 12 -5.629 -6.905 -1.351
59 HB3 HIS 12 2HB HIS 12 -6.866 -8.147 -1.175
60 HD1 HIS 12 HD1 HIS 12 -6.523 -10.313 -2.424
61 HD2 HIS 12 HD2 HIS 12 -3.782 -7.379 -3.493
62 HE1 HIS 12 HE1 HIS 12 -4.809 -11.481 -3.846
63 H PHE 13 H PHE 13 -6.530 -4.384 -3.341
64 HA PHE 13 HA PHE 13 -5.698 -5.086 -6.061
65 HB2 PHE 13 1HB PHE 13 -6.125 -2.362 -4.816
66 HB3 PHE 13 2HB PHE 13 -5.761 -2.676 -6.510
67 HD1 PHE 13 HD2 PHE 13 -8.310 -2.937 -3.884
68 HD2 PHE 13 HD1 PHE 13 -7.446 -3.445 -8.020
69 HE1 PHE 13 HE2 PHE 13 -10.717 -3.125 -4.360
70 HE2 PHE 13 HE1 PHE 13 -9.851 -3.633 -8.503
71 HZ PHE 13 HZ PHE 13 -11.490 -3.475 -6.672
72 H GLU 14 H GLU 14 -3.622 -5.188 -6.615
73 HA GLU 14 HA GLU 14 -1.617 -4.382 -4.642
74 HB2 GLU 14 1HB GLU 14 -1.565 -6.692 -5.558
75 HB3 GLU 14 2HB GLU 14 -1.275 -6.023 -7.158
76 HG2 GLU 14 1HG GLU 14 0.767 -4.890 -6.063
77 HG3 GLU 14 2HG GLU 14 0.536 -6.078 -4.782
78 H CYS 15 H CYS 15 0.049 -2.973 -5.090
79 HA CYS 15 HA CYS 15 -0.489 -1.002 -7.109
80 HB2 CYS 15 1HB CYS 15 0.383 -0.415 -4.859
81 HB3 CYS 15 2HB CYS 15 1.888 -1.240 -5.252
82 H THR 16 H THR 16 0.256 -0.979 -9.118
83 HA THR 16 HA THR 16 1.982 -3.023 -10.097
84 HB THR 16 HB THR 16 1.848 -1.844 -12.256
85 HG1 THR 16 HG1 THR 16 0.157 0.031 -11.982
86 HG21 THR 16 3HG2 THR 16 0.047 -3.262 -12.074
87 HG22 THR 16 1HG2 THR 16 -0.783 -1.719 -12.268
88 HG23 THR 16 2HG2 THR 16 -0.606 -2.429 -10.664
89 H GLU 17 H GLU 17 2.625 -0.187 -8.467
90 HA GLU 17 HA GLU 17 5.097 0.444 -9.849
91 HB2 GLU 17 1HB GLU 17 4.043 1.589 -7.259
92 HB3 GLU 17 2HB GLU 17 5.317 2.259 -8.269
93 HG2 GLU 17 1HG GLU 17 2.536 1.882 -9.313
94 HG3 GLU 17 2HG GLU 17 2.992 3.313 -8.390
95 H CYS 18 H CYS 18 4.306 -0.305 -6.450
96 HA CYS 18 HA CYS 18 6.986 -1.466 -6.157
97 HB2 CYS 18 1HB CYS 18 6.554 -1.285 -3.714
98 HB3 CYS 18 2HB CYS 18 6.486 0.267 -4.544
99 H GLY 19 H GLY 19 3.566 -2.143 -5.490
100 HA2 GLY 19 1HA GLY 19 2.846 -4.436 -6.123
101 HA3 GLY 19 2HA GLY 19 4.285 -5.003 -5.288
102 H LYS 20 H LYS 20 2.785 -2.367 -3.767
103 HA LYS 20 HA LYS 20 2.171 -3.873 -1.445
104 HB2 LYS 20 1HB LYS 20 2.699 -1.296 -1.818
105 HB3 LYS 20 2HB LYS 20 0.945 -1.190 -1.881
106 HG2 LYS 20 1HG LYS 20 0.693 -1.700 0.321
107 HG3 LYS 20 2HG LYS 20 2.153 -2.690 0.374
108 HD2 LYS 20 1HD LYS 20 2.900 -0.886 1.550
109 HD3 LYS 20 2HD LYS 20 3.303 -0.338 -0.079
110 HE2 LYS 20 1HE LYS 20 1.627 1.213 -0.119
111 HE3 LYS 20 2HE LYS 20 0.592 0.282 0.962
112 HZ1 LYS 20 3HZ LYS 20 1.225 1.742 2.502
113 HZ2 LYS 20 1HZ LYS 20 2.524 2.314 1.581
114 HZ3 LYS 20 2HZ LYS 20 2.706 0.924 2.528
115 H ALA 21 H ALA 21 0.329 -4.806 -0.778
116 HA ALA 21 HA ALA 21 -1.941 -4.787 -2.621
117 HB1 ALA 21 3HB ALA 21 -0.797 -6.715 -0.766
118 HB2 ALA 21 1HB ALA 21 -2.551 -6.588 -0.632
119 HB3 ALA 21 2HB ALA 21 -1.811 -6.971 -2.186
120 H PHE 22 H PHE 22 -3.879 -3.922 -2.147
121 HA PHE 22 HA PHE 22 -4.321 -2.935 0.591
122 HB2 PHE 22 1HB PHE 22 -5.159 -1.473 -1.918
123 HB3 PHE 22 2HB PHE 22 -5.282 -0.897 -0.259
124 HD1 PHE 22 HD2 PHE 22 -2.909 -1.740 -2.959
125 HD2 PHE 22 HD1 PHE 22 -3.474 0.180 0.798
126 HE1 PHE 22 HE2 PHE 22 -0.691 -0.695 -3.164
127 HE2 PHE 22 HE1 PHE 22 -1.257 1.229 0.598
128 HZ PHE 22 HZ PHE 22 0.138 0.791 -1.383
129 H THR 23 H THR 23 -6.333 -3.213 1.427
130 HA THR 23 HA THR 23 -8.084 -5.038 0.044
131 HB THR 23 HB THR 23 -7.670 -5.258 2.473
132 HG1 THR 23 HG1 THR 23 -10.034 -5.308 3.008
133 HG21 THR 23 3HG2 THR 23 -8.033 -3.620 3.972
134 HG22 THR 23 1HG2 THR 23 -9.535 -3.114 3.200
135 HG23 THR 23 2HG2 THR 23 -7.987 -2.547 2.573
136 H ARG 24 H ARG 24 -7.678 -1.928 -0.459
137 HA ARG 24 HA ARG 24 -10.494 -1.500 -1.125
138 HB2 ARG 24 1HB ARG 24 -8.833 0.184 0.689
139 HB3 ARG 24 2HB ARG 24 -9.950 0.997 -0.398
140 HG2 ARG 24 1HG ARG 24 -11.819 -0.134 0.553
141 HG3 ARG 24 2HG ARG 24 -10.766 -1.192 1.495
142 HD2 ARG 24 1HD ARG 24 -11.545 0.438 3.007
143 HD3 ARG 24 2HD ARG 24 -9.891 0.905 2.613
144 HE ARG 24 HE ARG 24 -11.309 2.330 0.841
145 HH11 ARG 24 1HH1 ARG 24 -11.654 1.887 4.276
146 HH12 ARG 24 2HH1 ARG 24 -12.341 3.456 4.541
147 HH21 ARG 24 1HH2 ARG 24 -12.212 4.398 1.176
148 HH22 ARG 24 2HH2 ARG 24 -12.658 4.883 2.777
149 H LYS 25 H LYS 25 -10.800 -0.541 -3.059
150 HA LYS 25 HA LYS 25 -8.593 -0.257 -4.824
151 HB2 LYS 25 1HB LYS 25 -10.884 -0.949 -5.522
152 HB3 LYS 25 2HB LYS 25 -11.436 0.693 -5.217
153 HG2 LYS 25 1HG LYS 25 -10.279 1.557 -7.027
154 HG3 LYS 25 2HG LYS 25 -9.170 0.185 -7.100
155 HD2 LYS 25 1HD LYS 25 -11.008 -1.250 -7.858
156 HD3 LYS 25 2HD LYS 25 -12.109 0.128 -7.792
157 HE2 LYS 25 1HE LYS 25 -11.129 1.162 -9.616
158 HE3 LYS 25 2HE LYS 25 -9.606 0.296 -9.417
159 HZ1 LYS 25 3HZ LYS 25 -11.553 -0.326 -11.197
160 HZ2 LYS 25 1HZ LYS 25 -11.830 -1.437 -9.951
161 HZ3 LYS 25 2HZ LYS 25 -10.314 -1.365 -10.698
162 H SER 26 H SER 26 -10.634 2.026 -3.075
163 HA SER 26 HA SER 26 -9.589 4.363 -4.304
164 HB2 SER 26 1HB SER 26 -10.821 5.587 -2.684
165 HB3 SER 26 2HB SER 26 -11.780 4.143 -3.010
166 HG SER 26 HG SER 26 -11.076 4.943 -0.687
167 H THR 27 H THR 27 -8.849 2.668 -1.281
168 HA THR 27 HA THR 27 -7.024 4.437 -0.184
169 HB THR 27 HB THR 27 -6.909 1.416 -0.078
170 HG1 THR 27 HG1 THR 27 -8.463 3.345 1.204
171 HG21 THR 27 3HG2 THR 27 -5.982 2.805 2.273
172 HG22 THR 27 1HG2 THR 27 -5.057 3.297 0.855
173 HG23 THR 27 2HG2 THR 27 -5.159 1.592 1.294
174 H LEU 28 H LEU 28 -6.389 1.748 -2.428
175 HA LEU 28 HA LEU 28 -3.611 2.146 -2.614
176 HB2 LEU 28 1HB LEU 28 -4.355 0.081 -3.364
177 HB3 LEU 28 2HB LEU 28 -5.652 0.788 -4.325
178 HG LEU 28 HG LEU 28 -3.911 1.641 -5.903
179 HD11 LEU 28 1HD1 LEU 28 -1.683 1.017 -5.760
180 HD12 LEU 28 2HD1 LEU 28 -2.014 -0.279 -4.611
181 HD13 LEU 28 3HD1 LEU 28 -2.092 1.404 -4.089
182 HD21 LEU 28 3HD2 LEU 28 -3.330 -1.173 -6.064
183 HD22 LEU 28 1HD2 LEU 28 -4.349 -0.176 -7.103
184 HD23 LEU 28 2HD2 LEU 28 -5.024 -0.909 -5.648
185 H SER 29 H SER 29 -6.235 3.176 -4.792
186 HA SER 29 HA SER 29 -4.888 4.449 -6.762
187 HB2 SER 29 1HB SER 29 -7.456 4.323 -6.235
188 HB3 SER 29 2HB SER 29 -7.190 5.909 -5.513
189 HG SER 29 HG SER 29 -7.744 6.164 -7.673
190 H MET 30 H MET 30 -5.275 5.559 -3.462
191 HA MET 30 HA MET 30 -4.130 8.152 -3.981
192 HB2 MET 30 1HB MET 30 -4.807 6.714 -1.412
193 HB3 MET 30 2HB MET 30 -4.170 8.352 -1.479
194 HG2 MET 30 1HG MET 30 -6.204 8.757 -3.068
195 HG3 MET 30 2HG MET 30 -6.848 7.325 -2.269
196 HE1 MET 30 3HE MET 30 -8.757 8.931 0.376
197 HE2 MET 30 1HE MET 30 -8.717 7.969 -1.102
198 HE3 MET 30 2HE MET 30 -7.853 7.416 0.332
199 H HIS 31 H HIS 31 -3.030 5.033 -2.836
200 HA HIS 31 HA HIS 31 -0.504 5.918 -1.866
201 HB2 HIS 31 1HB HIS 31 -1.042 3.868 -0.967
202 HB3 HIS 31 2HB HIS 31 -1.761 3.280 -2.463
203 HD1 HIS 31 HD1 HIS 31 1.505 3.568 -0.673
204 HD2 HIS 31 HD2 HIS 31 0.017 2.045 -4.240
205 HE1 HIS 31 HE1 HIS 31 3.352 2.148 -1.620
206 H GLN 32 H GLN 32 -1.635 4.598 -4.944
207 HA GLN 32 HA GLN 32 0.807 4.231 -6.213
208 HB2 GLN 32 1HB GLN 32 -1.808 5.142 -7.426
209 HB3 GLN 32 2HB GLN 32 -0.441 4.502 -8.328
210 HG2 GLN 32 1HG GLN 32 -0.711 2.440 -6.783
211 HG3 GLN 32 2HG GLN 32 -2.325 3.088 -6.497
212 HE21 GLN 32 1HE2 GLN 32 -2.459 0.755 -7.527
213 HE22 GLN 32 2HE2 GLN 32 -2.765 0.761 -9.228
214 H LYS 33 H LYS 33 -0.688 7.127 -5.224
215 HA LYS 33 HA LYS 33 0.393 8.901 -7.157
216 HB2 LYS 33 1HB LYS 33 -0.641 9.304 -4.354
217 HB3 LYS 33 2HB LYS 33 -0.037 10.634 -5.332
218 HG2 LYS 33 1HG LYS 33 -1.747 9.750 -7.089
219 HG3 LYS 33 2HG LYS 33 -2.496 8.987 -5.684
220 HD2 LYS 33 1HD LYS 33 -1.788 11.907 -5.716
221 HD3 LYS 33 2HD LYS 33 -3.325 11.314 -6.350
222 HE2 LYS 33 1HE LYS 33 -3.760 10.246 -4.155
223 HE3 LYS 33 2HE LYS 33 -2.275 10.973 -3.543
224 HZ1 LYS 33 3HZ LYS 33 -3.179 13.140 -3.860
225 HZ2 LYS 33 1HZ LYS 33 -4.322 12.233 -3.003
226 HZ3 LYS 33 2HZ LYS 33 -4.543 12.531 -4.653
227 H ILE 34 H ILE 34 1.762 7.225 -4.517
228 HA ILE 34 HA ILE 34 3.860 9.052 -3.897
229 HB ILE 34 HB ILE 34 4.768 7.383 -2.522
230 HG12 ILE 34 1HG1 ILE 34 3.197 5.331 -4.097
231 HG13 ILE 34 2HG1 ILE 34 4.924 5.630 -4.259
232 HG21 ILE 34 1HG2 ILE 34 2.448 6.155 -1.783
233 HG22 ILE 34 2HG2 ILE 34 2.948 7.767 -1.275
234 HG23 ILE 34 3HG2 ILE 34 1.852 7.575 -2.642
235 HD11 ILE 34 3HD1 ILE 34 4.749 3.736 -2.907
236 HD12 ILE 34 1HD1 ILE 34 5.087 5.057 -1.789
237 HD13 ILE 34 2HD1 ILE 34 3.445 4.433 -1.946
238 H HIS 35 H HIS 35 3.287 7.065 -6.550
239 HA HIS 35 HA HIS 35 6.150 6.925 -7.216
240 HB2 HIS 35 1HB HIS 35 3.860 5.396 -8.468
241 HB3 HIS 35 2HB HIS 35 5.574 5.170 -8.800
242 HD1 HIS 35 HD1 HIS 35 7.013 4.268 -6.689
243 HD2 HIS 35 HD2 HIS 35 2.886 3.857 -6.445
244 HE1 HIS 35 HE1 HIS 35 6.613 2.563 -4.885
245 H THR 36 H THR 36 3.045 8.143 -8.224
246 HA THR 36 HA THR 36 3.617 8.835 -10.871
247 HB THR 36 HB THR 36 1.866 10.651 -10.521
248 HG1 THR 36 HG1 THR 36 1.627 11.125 -8.463
249 HG21 THR 36 3HG2 THR 36 0.028 8.979 -10.173
250 HG22 THR 36 1HG2 THR 36 1.270 7.777 -9.823
251 HG23 THR 36 2HG2 THR 36 1.199 8.534 -11.414
252 H GLY 37 H GLY 37 4.164 10.611 -7.854
253 HA2 GLY 37 1HA GLY 37 6.087 12.024 -7.602
254 HA3 GLY 37 2HA GLY 37 6.026 12.350 -9.328
255 H GLU 38 H GLU 38 5.652 13.798 -6.484
256 HA GLU 38 HA GLU 38 3.296 15.374 -7.212
257 HB2 GLU 38 1HB GLU 38 4.913 15.146 -4.680
258 HB3 GLU 38 2HB GLU 38 3.713 16.409 -4.912
259 HG2 GLU 38 1HG GLU 38 2.191 14.332 -5.527
260 HG3 GLU 38 2HG GLU 38 3.354 13.499 -4.496
261 H LYS 39 H LYS 39 6.734 15.764 -6.449
262 HA LYS 39 HA LYS 39 8.242 17.372 -7.009
263 HB2 LYS 39 1HB LYS 39 7.167 17.024 -9.281
264 HB3 LYS 39 2HB LYS 39 6.177 18.437 -8.935
265 HG2 LYS 39 1HG LYS 39 7.951 19.234 -10.233
266 HG3 LYS 39 2HG LYS 39 8.359 19.688 -8.576
267 HD2 LYS 39 1HD LYS 39 10.354 18.831 -9.452
268 HD3 LYS 39 2HD LYS 39 9.689 17.501 -8.501
269 HE2 LYS 39 1HE LYS 39 8.838 16.444 -10.493
270 HE3 LYS 39 2HE LYS 39 9.328 17.821 -11.478
271 HZ1 LYS 39 3HZ LYS 39 11.370 16.425 -9.904
272 HZ2 LYS 39 1HZ LYS 39 11.516 17.232 -11.384
273 HZ3 LYS 39 2HZ LYS 39 10.810 15.696 -11.323
274 HA PRO 40 HA PRO 40 5.557 20.370 -4.504
275 HB2 PRO 40 1HB PRO 40 6.609 19.816 -2.063
276 HB3 PRO 40 2HB PRO 40 5.205 18.966 -2.720
277 HG2 PRO 40 1HG PRO 40 8.074 18.116 -2.654
278 HG3 PRO 40 2HG PRO 40 6.617 17.164 -2.315
279 HD2 PRO 40 1HD PRO 40 7.926 17.030 -4.681
280 HD3 PRO 40 2HD PRO 40 6.168 16.821 -4.549
281 H SER 41 H SER 41 6.417 22.316 -4.862
282 HA SER 41 HA SER 41 7.910 24.031 -5.023
283 HB2 SER 41 1HB SER 41 8.506 22.737 -2.397
284 HB3 SER 41 2HB SER 41 9.590 24.004 -2.971
285 HG SER 41 HG SER 41 6.797 24.385 -2.955
286 H GLY 42 H GLY 42 8.604 22.217 -6.810
287 HA2 GLY 42 1HA GLY 42 11.493 21.744 -6.446
288 HA3 GLY 42 2HA GLY 42 10.457 20.835 -7.536
289 HA PRO 43 HA PRO 43 12.749 24.179 -9.880
290 HB2 PRO 43 1HB PRO 43 13.915 22.509 -11.675
291 HB3 PRO 43 2HB PRO 43 14.656 22.920 -10.124
292 HG2 PRO 43 1HG PRO 43 13.103 20.480 -10.894
293 HG3 PRO 43 2HG PRO 43 14.594 20.602 -9.943
294 HD2 PRO 43 1HD PRO 43 12.161 20.269 -8.802
295 HD3 PRO 43 2HD PRO 43 13.466 21.181 -8.017
296 H SER 44 H SER 44 10.238 22.073 -10.274
297 HA SER 44 HA SER 44 9.811 22.653 -13.108
298 HB2 SER 44 1HB SER 44 9.441 20.339 -11.981
299 HB3 SER 44 2HB SER 44 7.935 21.045 -11.395
300 HG SER 44 HG SER 44 8.637 21.171 -14.123
301 H SER 45 H SER 45 8.801 24.472 -13.609
302 HA SER 45 HA SER 45 7.665 26.353 -12.102
303 HB2 SER 45 1HB SER 45 6.275 27.022 -13.997
304 HB3 SER 45 2HB SER 45 7.857 26.491 -14.566
305 HG SER 45 HG SER 45 6.271 24.371 -14.491
306 H GLY 46 H GLY 46 5.706 26.855 -11.146
307 HA2 GLY 46 1HA GLY 46 4.270 24.768 -9.958
308 HA3 GLY 46 2HA GLY 46 3.749 26.445 -10.021
Start of MODEL 11
1 H1 GLY 1 H GLY 1 13.012 -19.670 6.249
2 HA2 GLY 1 1HA GLY 1 11.241 -20.110 8.377
3 HA3 GLY 1 2HA GLY 1 12.072 -18.589 8.670
4 H SER 2 H SER 2 9.248 -19.033 8.159
5 HA SER 2 HA SER 2 8.950 -17.124 5.982
6 HB2 SER 2 1HB SER 2 7.302 -18.408 4.785
7 HB3 SER 2 2HB SER 2 8.736 -19.417 4.972
8 HG SER 2 HG SER 2 7.338 -20.789 5.752
9 H SER 3 H SER 3 7.040 -15.912 6.079
10 HA SER 3 HA SER 3 5.697 -16.040 8.685
11 HB2 SER 3 1HB SER 3 4.915 -13.694 8.007
12 HB3 SER 3 2HB SER 3 6.633 -13.890 8.354
13 HG SER 3 HG SER 3 5.885 -14.318 5.726
14 H GLY 4 H GLY 4 5.164 -16.367 5.280
15 HA2 GLY 4 1HA GLY 4 2.828 -17.752 5.365
16 HA3 GLY 4 2HA GLY 4 2.299 -16.077 5.422
17 H SER 5 H SER 5 4.166 -18.402 3.523
18 HA SER 5 HA SER 5 4.084 -16.666 1.192
19 HB2 SER 5 1HB SER 5 5.454 -18.382 0.113
20 HB3 SER 5 2HB SER 5 6.131 -17.962 1.686
21 HG SER 5 HG SER 5 5.613 -20.340 0.886
22 H SER 6 H SER 6 3.051 -17.175 -0.750
23 HA SER 6 HA SER 6 1.368 -17.939 -2.077
24 HB2 SER 6 1HB SER 6 2.654 -20.148 -1.468
25 HB3 SER 6 2HB SER 6 1.209 -20.494 -0.518
26 HG SER 6 HG SER 6 1.443 -21.056 -2.965
27 H GLY 7 H GLY 7 0.613 -16.326 0.027
28 HA2 GLY 7 1HA GLY 7 -1.958 -17.529 0.853
29 HA3 GLY 7 2HA GLY 7 -1.063 -16.394 1.852
30 H THR 8 H THR 8 -3.620 -16.693 -0.205
31 HA THR 8 HA THR 8 -3.593 -13.806 -0.792
32 HB THR 8 HB THR 8 -4.739 -15.964 -2.574
33 HG1 THR 8 HG1 THR 8 -3.036 -15.329 -3.973
34 HG21 THR 8 3HG2 THR 8 -5.748 -14.369 -3.796
35 HG22 THR 8 1HG2 THR 8 -4.396 -13.250 -3.625
36 HG23 THR 8 2HG2 THR 8 -5.601 -13.379 -2.344
37 H GLY 9 H GLY 9 -5.459 -12.689 -0.403
38 HA2 GLY 9 1HA GLY 9 -7.472 -14.085 1.172
39 HA3 GLY 9 2HA GLY 9 -7.317 -12.345 0.984
40 H GLY 10 H GLY 10 -8.560 -11.309 -0.485
41 HA2 GLY 10 1HA GLY 10 -9.986 -12.923 -2.484
42 HA3 GLY 10 2HA GLY 10 -10.918 -11.932 -1.373
43 H LYS 11 H LYS 11 -11.651 -10.191 -2.380
44 HA LYS 11 HA LYS 11 -10.501 -9.130 -4.739
45 HB2 LYS 11 1HB LYS 11 -12.119 -7.255 -4.385
46 HB3 LYS 11 2HB LYS 11 -12.853 -8.854 -4.365
47 HG2 LYS 11 1HG LYS 11 -12.753 -8.770 -1.865
48 HG3 LYS 11 2HG LYS 11 -12.251 -7.084 -2.009
49 HD2 LYS 11 1HD LYS 11 -14.777 -8.166 -3.242
50 HD3 LYS 11 2HD LYS 11 -14.716 -7.464 -1.624
51 HE2 LYS 11 1HE LYS 11 -13.961 -5.356 -2.520
52 HE3 LYS 11 2HE LYS 11 -13.846 -6.045 -4.139
53 HZ1 LYS 11 3HZ LYS 11 -16.405 -5.999 -2.662
54 HZ2 LYS 11 1HZ LYS 11 -16.150 -6.177 -4.325
55 HZ3 LYS 11 2HZ LYS 11 -15.898 -4.677 -3.587
56 H HIS 12 H HIS 12 -8.286 -8.837 -4.024
57 HA HIS 12 HA HIS 12 -7.905 -6.389 -2.430
58 HB2 HIS 12 1HB HIS 12 -5.870 -7.222 -1.631
59 HB3 HIS 12 2HB HIS 12 -6.911 -8.642 -1.637
60 HD1 HIS 12 HD1 HIS 12 -5.756 -10.630 -2.515
61 HD2 HIS 12 HD2 HIS 12 -4.380 -7.143 -4.307
62 HE1 HIS 12 HE1 HIS 12 -3.968 -11.362 -4.124
63 H PHE 13 H PHE 13 -6.677 -4.738 -3.231
64 HA PHE 13 HA PHE 13 -5.923 -4.967 -6.063
65 HB2 PHE 13 1HB PHE 13 -6.345 -2.427 -4.483
66 HB3 PHE 13 2HB PHE 13 -6.198 -2.586 -6.230
67 HD1 PHE 13 HD2 PHE 13 -8.374 -3.243 -3.333
68 HD2 PHE 13 HD1 PHE 13 -8.061 -3.160 -7.578
69 HE1 PHE 13 HE2 PHE 13 -10.819 -3.453 -3.515
70 HE2 PHE 13 HE1 PHE 13 -10.505 -3.369 -7.765
71 HZ PHE 13 HZ PHE 13 -11.888 -3.517 -5.733
72 H GLU 14 H GLU 14 -3.834 -5.173 -6.482
73 HA GLU 14 HA GLU 14 -1.880 -4.294 -4.485
74 HB2 GLU 14 1HB GLU 14 -1.680 -6.605 -5.215
75 HB3 GLU 14 2HB GLU 14 -1.587 -6.095 -6.895
76 HG2 GLU 14 1HG GLU 14 0.522 -4.941 -6.417
77 HG3 GLU 14 2HG GLU 14 0.433 -5.494 -4.746
78 H CYS 15 H CYS 15 -0.033 -3.073 -5.085
79 HA CYS 15 HA CYS 15 -0.612 -1.083 -7.102
80 HB2 CYS 15 1HB CYS 15 0.348 -0.559 -4.823
81 HB3 CYS 15 2HB CYS 15 1.853 -1.291 -5.369
82 H THR 16 H THR 16 0.265 -0.932 -9.073
83 HA THR 16 HA THR 16 1.913 -3.096 -10.031
84 HB THR 16 HB THR 16 0.075 -2.127 -11.404
85 HG1 THR 16 HG1 THR 16 1.784 -3.239 -12.434
86 HG21 THR 16 3HG2 THR 16 1.941 0.239 -11.618
87 HG22 THR 16 1HG2 THR 16 0.366 0.226 -10.826
88 HG23 THR 16 2HG2 THR 16 0.477 -0.000 -12.572
89 H GLU 17 H GLU 17 2.589 -0.280 -8.447
90 HA GLU 17 HA GLU 17 5.017 0.354 -9.926
91 HB2 GLU 17 1HB GLU 17 3.671 1.613 -7.540
92 HB3 GLU 17 2HB GLU 17 5.254 2.121 -8.110
93 HG2 GLU 17 1HG GLU 17 2.680 2.219 -9.664
94 HG3 GLU 17 2HG GLU 17 3.541 3.589 -8.964
95 H CYS 18 H CYS 18 4.196 -0.398 -6.535
96 HA CYS 18 HA CYS 18 6.922 -1.444 -6.189
97 HB2 CYS 18 1HB CYS 18 6.450 -1.227 -3.745
98 HB3 CYS 18 2HB CYS 18 6.403 0.304 -4.614
99 H GLY 19 H GLY 19 3.511 -2.188 -5.574
100 HA2 GLY 19 1HA GLY 19 2.811 -4.488 -6.107
101 HA3 GLY 19 2HA GLY 19 4.290 -5.029 -5.328
102 H LYS 20 H LYS 20 2.596 -2.410 -3.873
103 HA LYS 20 HA LYS 20 2.158 -3.924 -1.483
104 HB2 LYS 20 1HB LYS 20 2.673 -1.362 -1.825
105 HB3 LYS 20 2HB LYS 20 0.922 -1.237 -1.927
106 HG2 LYS 20 1HG LYS 20 0.650 -2.094 0.273
107 HG3 LYS 20 2HG LYS 20 2.356 -2.539 0.374
108 HD2 LYS 20 1HD LYS 20 2.891 -0.090 0.108
109 HD3 LYS 20 2HD LYS 20 1.168 0.229 0.314
110 HE2 LYS 20 1HE LYS 20 2.738 -1.371 2.313
111 HE3 LYS 20 2HE LYS 20 2.665 0.389 2.383
112 HZ1 LYS 20 3HZ LYS 20 0.834 -1.397 3.417
113 HZ2 LYS 20 1HZ LYS 20 0.069 -0.703 2.078
114 HZ3 LYS 20 2HZ LYS 20 0.671 0.283 3.313
115 H ALA 21 H ALA 21 0.351 -4.890 -0.775
116 HA ALA 21 HA ALA 21 -1.973 -4.887 -2.549
117 HB1 ALA 21 3HB ALA 21 -1.002 -7.046 -1.873
118 HB2 ALA 21 1HB ALA 21 -1.375 -6.668 -0.190
119 HB3 ALA 21 2HB ALA 21 -2.681 -6.873 -1.359
120 H PHE 22 H PHE 22 -3.762 -3.793 -2.088
121 HA PHE 22 HA PHE 22 -4.156 -2.862 0.681
122 HB2 PHE 22 1HB PHE 22 -5.048 -1.528 -1.885
123 HB3 PHE 22 2HB PHE 22 -5.337 -0.922 -0.258
124 HD1 PHE 22 HD2 PHE 22 -2.820 -1.463 -2.863
125 HD2 PHE 22 HD1 PHE 22 -3.592 0.132 1.007
126 HE1 PHE 22 HE2 PHE 22 -0.678 -0.256 -2.938
127 HE2 PHE 22 HE1 PHE 22 -1.451 1.344 0.938
128 HZ PHE 22 HZ PHE 22 0.010 1.150 -1.036
129 H THR 23 H THR 23 -6.324 -2.724 1.456
130 HA THR 23 HA THR 23 -8.032 -4.808 0.331
131 HB THR 23 HB THR 23 -7.538 -4.878 2.748
132 HG1 THR 23 HG1 THR 23 -9.468 -5.814 2.226
133 HG21 THR 23 3HG2 THR 23 -8.451 -3.227 4.259
134 HG22 THR 23 1HG2 THR 23 -9.161 -2.336 2.913
135 HG23 THR 23 2HG2 THR 23 -7.408 -2.422 3.088
136 H ARG 24 H ARG 24 -7.677 -1.830 -0.538
137 HA ARG 24 HA ARG 24 -10.462 -1.468 -1.222
138 HB2 ARG 24 1HB ARG 24 -9.013 0.375 0.652
139 HB3 ARG 24 2HB ARG 24 -10.269 0.998 -0.409
140 HG2 ARG 24 1HG ARG 24 -11.854 -0.618 0.558
141 HG3 ARG 24 2HG ARG 24 -10.590 -1.163 1.662
142 HD2 ARG 24 1HD ARG 24 -11.733 0.362 2.963
143 HD3 ARG 24 2HD ARG 24 -10.432 1.351 2.300
144 HE ARG 24 HE ARG 24 -12.686 1.489 0.614
145 HH11 ARG 24 1HH1 ARG 24 -11.562 2.559 3.730
146 HH12 ARG 24 2HH1 ARG 24 -12.553 3.980 3.745
147 HH21 ARG 24 1HH2 ARG 24 -13.996 3.356 0.621
148 HH22 ARG 24 2HH2 ARG 24 -13.938 4.432 1.976
149 H LYS 25 H LYS 25 -10.421 -1.037 -3.317
150 HA LYS 25 HA LYS 25 -8.234 -0.433 -4.858
151 HB2 LYS 25 1HB LYS 25 -10.240 -1.164 -5.919
152 HB3 LYS 25 2HB LYS 25 -11.149 0.206 -5.294
153 HG2 LYS 25 1HG LYS 25 -10.800 0.747 -7.522
154 HG3 LYS 25 2HG LYS 25 -9.541 1.650 -6.677
155 HD2 LYS 25 1HD LYS 25 -8.267 0.719 -8.320
156 HD3 LYS 25 2HD LYS 25 -8.175 -0.585 -7.134
157 HE2 LYS 25 1HE LYS 25 -8.727 -1.729 -9.062
158 HE3 LYS 25 2HE LYS 25 -10.309 -1.464 -8.331
159 HZ1 LYS 25 3HZ LYS 25 -10.875 0.086 -9.893
160 HZ2 LYS 25 1HZ LYS 25 -9.899 -0.928 -10.832
161 HZ3 LYS 25 2HZ LYS 25 -9.276 0.523 -10.227
162 H SER 26 H SER 26 -10.413 1.799 -3.215
163 HA SER 26 HA SER 26 -9.418 4.176 -4.365
164 HB2 SER 26 1HB SER 26 -10.720 3.772 -1.661
165 HB3 SER 26 2HB SER 26 -10.523 5.318 -2.487
166 HG SER 26 HG SER 26 -11.782 4.329 -4.229
167 H THR 27 H THR 27 -8.730 2.671 -1.208
168 HA THR 27 HA THR 27 -6.870 4.426 -0.226
169 HB THR 27 HB THR 27 -6.798 1.411 0.004
170 HG1 THR 27 HG1 THR 27 -8.657 2.901 0.800
171 HG21 THR 27 3HG2 THR 27 -5.204 1.571 1.632
172 HG22 THR 27 1HG2 THR 27 -5.690 3.199 2.103
173 HG23 THR 27 2HG2 THR 27 -4.727 2.953 0.646
174 H LEU 28 H LEU 28 -6.321 1.775 -2.511
175 HA LEU 28 HA LEU 28 -3.514 2.077 -2.662
176 HB2 LEU 28 1HB LEU 28 -4.228 0.038 -3.442
177 HB3 LEU 28 2HB LEU 28 -5.601 0.730 -4.305
178 HG LEU 28 HG LEU 28 -4.008 1.617 -6.001
179 HD11 LEU 28 1HD1 LEU 28 -1.981 1.745 -4.762
180 HD12 LEU 28 2HD1 LEU 28 -1.744 0.550 -6.036
181 HD13 LEU 28 3HD1 LEU 28 -2.035 0.024 -4.378
182 HD21 LEU 28 3HD2 LEU 28 -3.357 -1.208 -6.124
183 HD22 LEU 28 1HD2 LEU 28 -4.376 -0.234 -7.184
184 HD23 LEU 28 2HD2 LEU 28 -5.049 -0.928 -5.709
185 H SER 29 H SER 29 -6.102 3.145 -4.869
186 HA SER 29 HA SER 29 -4.666 4.421 -6.795
187 HB2 SER 29 1HB SER 29 -7.147 4.239 -6.748
188 HB3 SER 29 2HB SER 29 -7.192 5.522 -5.539
189 HG SER 29 HG SER 29 -5.719 6.407 -7.533
190 H MET 30 H MET 30 -5.345 5.581 -3.545
191 HA MET 30 HA MET 30 -4.236 8.187 -3.989
192 HB2 MET 30 1HB MET 30 -4.793 6.764 -1.381
193 HB3 MET 30 2HB MET 30 -4.487 8.484 -1.578
194 HG2 MET 30 1HG MET 30 -6.550 8.325 -3.200
195 HG3 MET 30 2HG MET 30 -6.911 6.898 -2.231
196 HE1 MET 30 3HE MET 30 -6.581 7.381 0.792
197 HE2 MET 30 1HE MET 30 -8.164 8.122 1.025
198 HE3 MET 30 2HE MET 30 -7.962 6.830 -0.158
199 H HIS 31 H HIS 31 -3.031 5.091 -2.945
200 HA HIS 31 HA HIS 31 -0.584 6.076 -1.837
201 HB2 HIS 31 1HB HIS 31 -1.039 4.003 -0.963
202 HB3 HIS 31 2HB HIS 31 -1.732 3.402 -2.467
203 HD1 HIS 31 HD1 HIS 31 1.604 4.005 -0.813
204 HD2 HIS 31 HD2 HIS 31 0.002 2.001 -4.081
205 HE1 HIS 31 HE1 HIS 31 3.475 2.589 -1.717
206 H GLN 32 H GLN 32 -1.505 4.595 -4.927
207 HA GLN 32 HA GLN 32 0.982 4.400 -6.114
208 HB2 GLN 32 1HB GLN 32 -1.594 5.184 -7.488
209 HB3 GLN 32 2HB GLN 32 -0.176 4.484 -8.258
210 HG2 GLN 32 1HG GLN 32 -0.484 2.435 -6.967
211 HG3 GLN 32 2HG GLN 32 -1.907 3.136 -6.197
212 HE21 GLN 32 1HE2 GLN 32 -1.276 0.842 -8.172
213 HE22 GLN 32 2HE2 GLN 32 -2.511 1.014 -9.368
214 H LYS 33 H LYS 33 -0.870 7.220 -5.393
215 HA LYS 33 HA LYS 33 0.210 9.023 -7.256
216 HB2 LYS 33 1HB LYS 33 -0.947 9.396 -4.499
217 HB3 LYS 33 2HB LYS 33 -0.383 10.753 -5.464
218 HG2 LYS 33 1HG LYS 33 -1.961 9.799 -7.281
219 HG3 LYS 33 2HG LYS 33 -2.708 8.939 -5.933
220 HD2 LYS 33 1HD LYS 33 -2.279 11.923 -6.026
221 HD3 LYS 33 2HD LYS 33 -3.788 11.118 -6.462
222 HE2 LYS 33 1HE LYS 33 -3.867 10.143 -4.184
223 HE3 LYS 33 2HE LYS 33 -2.426 11.071 -3.771
224 HZ1 LYS 33 3HZ LYS 33 -5.166 12.010 -4.246
225 HZ2 LYS 33 1HZ LYS 33 -3.878 13.050 -4.596
226 HZ3 LYS 33 2HZ LYS 33 -4.076 12.446 -3.028
227 H ILE 34 H ILE 34 1.701 7.386 -4.724
228 HA ILE 34 HA ILE 34 3.654 9.417 -4.087
229 HB ILE 34 HB ILE 34 4.570 7.918 -2.544
230 HG12 ILE 34 1HG1 ILE 34 3.160 5.653 -3.971
231 HG13 ILE 34 2HG1 ILE 34 4.867 6.045 -4.149
232 HG21 ILE 34 1HG2 ILE 34 2.256 6.618 -1.834
233 HG22 ILE 34 2HG2 ILE 34 2.703 8.258 -1.368
234 HG23 ILE 34 3HG2 ILE 34 1.668 7.992 -2.771
235 HD11 ILE 34 3HD1 ILE 34 3.457 5.038 -1.697
236 HD12 ILE 34 1HD1 ILE 34 4.709 4.231 -2.640
237 HD13 ILE 34 2HD1 ILE 34 5.107 5.660 -1.685
238 H HIS 35 H HIS 35 3.261 7.006 -6.469
239 HA HIS 35 HA HIS 35 6.111 6.782 -7.023
240 HB2 HIS 35 1HB HIS 35 3.695 5.526 -8.336
241 HB3 HIS 35 2HB HIS 35 5.356 5.242 -8.849
242 HD1 HIS 35 HD1 HIS 35 6.935 4.253 -6.798
243 HD2 HIS 35 HD2 HIS 35 2.823 3.735 -6.511
244 HE1 HIS 35 HE1 HIS 35 6.606 2.395 -5.136
245 H THR 36 H THR 36 3.197 8.187 -8.418
246 HA THR 36 HA THR 36 4.544 9.119 -10.785
247 HB THR 36 HB THR 36 2.158 8.577 -10.875
248 HG1 THR 36 HG1 THR 36 2.178 11.358 -11.228
249 HG21 THR 36 3HG2 THR 36 0.502 9.689 -9.668
250 HG22 THR 36 1HG2 THR 36 1.563 11.037 -9.265
251 HG23 THR 36 2HG2 THR 36 1.785 9.474 -8.478
252 H GLY 37 H GLY 37 3.649 10.438 -7.657
253 HA2 GLY 37 1HA GLY 37 3.858 13.146 -8.056
254 HA3 GLY 37 2HA GLY 37 4.376 12.338 -6.583
255 H GLU 38 H GLU 38 6.592 11.495 -6.534
256 HA GLU 38 HA GLU 38 8.401 13.411 -7.744
257 HB2 GLU 38 1HB GLU 38 9.010 11.132 -5.854
258 HB3 GLU 38 2HB GLU 38 10.093 12.448 -6.283
259 HG2 GLU 38 1HG GLU 38 7.446 12.921 -4.955
260 HG3 GLU 38 2HG GLU 38 8.919 12.598 -4.044
261 H LYS 39 H LYS 39 10.042 12.950 -9.170
262 HA LYS 39 HA LYS 39 10.140 10.219 -10.258
263 HB2 LYS 39 1HB LYS 39 10.450 11.261 -12.529
264 HB3 LYS 39 2HB LYS 39 8.839 11.434 -11.844
265 HG2 LYS 39 1HG LYS 39 10.827 13.611 -11.424
266 HG3 LYS 39 2HG LYS 39 10.035 13.455 -12.994
267 HD2 LYS 39 1HD LYS 39 7.865 13.662 -11.980
268 HD3 LYS 39 2HD LYS 39 8.570 13.621 -10.362
269 HE2 LYS 39 1HE LYS 39 8.187 15.885 -10.712
270 HE3 LYS 39 2HE LYS 39 9.889 15.700 -11.131
271 HZ1 LYS 39 3HZ LYS 39 8.057 16.887 -12.692
272 HZ2 LYS 39 1HZ LYS 39 8.061 15.322 -13.335
273 HZ3 LYS 39 2HZ LYS 39 9.499 16.209 -13.261
274 HA PRO 40 HA PRO 40 14.373 11.755 -9.134
275 HB2 PRO 40 1HB PRO 40 15.135 9.454 -7.911
276 HB3 PRO 40 2HB PRO 40 14.267 10.746 -7.073
277 HG2 PRO 40 1HG PRO 40 13.211 8.195 -8.230
278 HG3 PRO 40 2HG PRO 40 12.823 8.966 -6.681
279 HD2 PRO 40 1HD PRO 40 11.212 9.161 -8.849
280 HD3 PRO 40 2HD PRO 40 11.358 10.460 -7.648
281 H SER 41 H SER 41 13.465 8.475 -10.196
282 HA SER 41 HA SER 41 15.251 8.702 -12.469
283 HB2 SER 41 1HB SER 41 16.492 7.734 -10.366
284 HB3 SER 41 2HB SER 41 15.616 6.259 -10.771
285 HG SER 41 HG SER 41 17.397 7.706 -12.441
286 H GLY 42 H GLY 42 15.174 6.509 -13.734
287 HA2 GLY 42 1HA GLY 42 13.694 4.504 -14.004
288 HA3 GLY 42 2HA GLY 42 12.360 5.608 -13.704
289 HA PRO 43 HA PRO 43 12.975 5.211 -18.294
290 HB2 PRO 43 1HB PRO 43 10.358 4.750 -18.851
291 HB3 PRO 43 2HB PRO 43 11.494 3.460 -18.436
292 HG2 PRO 43 1HG PRO 43 9.486 4.846 -16.701
293 HG3 PRO 43 2HG PRO 43 9.879 3.119 -16.799
294 HD2 PRO 43 1HD PRO 43 10.832 4.722 -14.835
295 HD3 PRO 43 2HD PRO 43 11.750 3.341 -15.471
296 H SER 44 H SER 44 11.558 6.379 -20.016
297 HA SER 44 HA SER 44 10.945 8.397 -20.876
298 HB2 SER 44 1HB SER 44 8.912 7.649 -19.423
299 HB3 SER 44 2HB SER 44 9.422 8.949 -18.346
300 HG SER 44 HG SER 44 7.845 9.374 -20.183
301 H SER 45 H SER 45 13.419 8.438 -19.632
302 HA SER 45 HA SER 45 13.898 10.339 -17.695
303 HB2 SER 45 1HB SER 45 15.620 9.841 -20.134
304 HB3 SER 45 2HB SER 45 16.150 10.522 -18.596
305 HG SER 45 HG SER 45 16.242 8.584 -17.777
306 H GLY 46 H GLY 46 13.572 10.823 -21.198
307 HA2 GLY 46 1HA GLY 46 13.584 13.732 -20.745
308 HA3 GLY 46 2HA GLY 46 13.873 12.941 -22.288
Start of MODEL 12
1 H1 GLY 1 H GLY 1 4.922 -32.938 5.639
2 HA2 GLY 1 1HA GLY 1 2.459 -31.752 4.792
3 HA3 GLY 1 2HA GLY 1 2.820 -32.367 6.398
4 H SER 2 H SER 2 3.863 -29.675 4.301
5 HA SER 2 HA SER 2 3.436 -27.869 6.585
6 HB2 SER 2 1HB SER 2 5.449 -26.575 5.789
7 HB3 SER 2 2HB SER 2 5.816 -28.163 6.463
8 HG SER 2 HG SER 2 6.516 -28.794 4.579
9 H SER 3 H SER 3 1.554 -28.320 4.602
10 HA SER 3 HA SER 3 1.676 -25.815 3.052
11 HB2 SER 3 1HB SER 3 1.767 -27.930 1.680
12 HB3 SER 3 2HB SER 3 0.146 -28.303 2.266
13 HG SER 3 HG SER 3 0.494 -25.769 1.207
14 H GLY 4 H GLY 4 -0.248 -24.616 2.832
15 HA2 GLY 4 1HA GLY 4 -2.790 -25.098 3.537
16 HA3 GLY 4 2HA GLY 4 -2.029 -24.893 5.108
17 H SER 5 H SER 5 -2.231 -23.274 1.941
18 HA SER 5 HA SER 5 -2.246 -20.701 3.379
19 HB2 SER 5 1HB SER 5 -1.083 -21.510 0.734
20 HB3 SER 5 2HB SER 5 -1.558 -19.833 1.006
21 HG SER 5 HG SER 5 0.140 -21.261 2.767
22 H SER 6 H SER 6 -3.993 -19.451 3.207
23 HA SER 6 HA SER 6 -5.836 -19.854 0.963
24 HB2 SER 6 1HB SER 6 -6.470 -20.145 3.880
25 HB3 SER 6 2HB SER 6 -7.707 -19.544 2.775
26 HG SER 6 HG SER 6 -6.403 -22.047 2.783
27 H GLY 7 H GLY 7 -5.826 -17.932 -0.011
28 HA2 GLY 7 1HA GLY 7 -5.150 -15.486 1.156
29 HA3 GLY 7 2HA GLY 7 -6.041 -15.673 -0.347
30 H THR 8 H THR 8 -6.168 -14.413 2.704
31 HA THR 8 HA THR 8 -8.902 -14.859 3.366
32 HB THR 8 HB THR 8 -8.609 -13.019 4.989
33 HG1 THR 8 HG1 THR 8 -5.897 -12.811 4.294
34 HG21 THR 8 3HG2 THR 8 -7.947 -15.181 5.743
35 HG22 THR 8 1HG2 THR 8 -6.693 -14.055 6.257
36 HG23 THR 8 2HG2 THR 8 -6.425 -15.093 4.857
37 H GLY 9 H GLY 9 -7.158 -12.229 1.750
38 HA2 GLY 9 1HA GLY 9 -9.676 -10.821 1.270
39 HA3 GLY 9 2HA GLY 9 -8.063 -10.206 0.937
40 H GLY 10 H GLY 10 -10.570 -10.455 -0.722
41 HA2 GLY 10 1HA GLY 10 -9.412 -12.035 -2.934
42 HA3 GLY 10 2HA GLY 10 -11.137 -11.804 -2.694
43 H LYS 11 H LYS 11 -11.256 -9.090 -2.201
44 HA LYS 11 HA LYS 11 -10.743 -8.059 -4.873
45 HB2 LYS 11 1HB LYS 11 -12.401 -7.131 -2.545
46 HB3 LYS 11 2HB LYS 11 -12.041 -6.045 -3.881
47 HG2 LYS 11 1HG LYS 11 -13.318 -8.739 -4.257
48 HG3 LYS 11 2HG LYS 11 -14.239 -7.254 -4.009
49 HD2 LYS 11 1HD LYS 11 -13.565 -6.350 -6.041
50 HD3 LYS 11 2HD LYS 11 -12.158 -7.409 -6.157
51 HE2 LYS 11 1HE LYS 11 -14.977 -8.449 -6.261
52 HE3 LYS 11 2HE LYS 11 -14.116 -7.913 -7.702
53 HZ1 LYS 11 3HZ LYS 11 -14.054 -10.402 -6.923
54 HZ2 LYS 11 1HZ LYS 11 -12.791 -9.843 -5.946
55 HZ3 LYS 11 2HZ LYS 11 -12.699 -9.673 -7.626
56 H HIS 12 H HIS 12 -8.406 -8.444 -3.445
57 HA HIS 12 HA HIS 12 -7.608 -5.840 -2.402
58 HB2 HIS 12 1HB HIS 12 -5.719 -6.893 -1.502
59 HB3 HIS 12 2HB HIS 12 -6.979 -8.115 -1.355
60 HD1 HIS 12 HD1 HIS 12 -6.650 -10.289 -2.608
61 HD2 HIS 12 HD2 HIS 12 -3.789 -7.425 -3.542
62 HE1 HIS 12 HE1 HIS 12 -4.903 -11.498 -3.954
63 H PHE 13 H PHE 13 -6.523 -4.378 -3.549
64 HA PHE 13 HA PHE 13 -5.637 -5.109 -6.242
65 HB2 PHE 13 1HB PHE 13 -6.101 -2.410 -4.959
66 HB3 PHE 13 2HB PHE 13 -5.529 -2.642 -6.607
67 HD1 PHE 13 HD2 PHE 13 -8.325 -3.730 -4.392
68 HD2 PHE 13 HD1 PHE 13 -7.074 -2.602 -8.301
69 HE1 PHE 13 HE2 PHE 13 -10.653 -3.874 -5.174
70 HE2 PHE 13 HE1 PHE 13 -9.401 -2.744 -9.090
71 HZ PHE 13 HZ PHE 13 -11.194 -3.381 -7.526
72 H GLU 14 H GLU 14 -3.553 -5.131 -6.837
73 HA GLU 14 HA GLU 14 -1.560 -4.467 -4.790
74 HB2 GLU 14 1HB GLU 14 -1.280 -6.695 -5.518
75 HB3 GLU 14 2HB GLU 14 -1.508 -6.260 -7.206
76 HG2 GLU 14 1HG GLU 14 0.794 -5.076 -5.755
77 HG3 GLU 14 2HG GLU 14 0.874 -6.778 -6.207
78 H CYS 15 H CYS 15 0.046 -3.001 -5.123
79 HA CYS 15 HA CYS 15 -0.366 -1.059 -7.199
80 HB2 CYS 15 1HB CYS 15 0.330 -0.447 -4.890
81 HB3 CYS 15 2HB CYS 15 1.876 -1.239 -5.177
82 H THR 16 H THR 16 0.334 -1.357 -9.201
83 HA THR 16 HA THR 16 2.213 -3.281 -9.994
84 HB THR 16 HB THR 16 1.647 -0.809 -11.612
85 HG1 THR 16 HG1 THR 16 -0.053 -2.985 -11.906
86 HG21 THR 16 3HG2 THR 16 1.711 -3.602 -12.657
87 HG22 THR 16 1HG2 THR 16 3.233 -2.813 -12.244
88 HG23 THR 16 2HG2 THR 16 2.165 -2.093 -13.449
89 H GLU 17 H GLU 17 2.658 -0.207 -8.608
90 HA GLU 17 HA GLU 17 5.217 0.361 -9.780
91 HB2 GLU 17 1HB GLU 17 4.062 1.522 -7.244
92 HB3 GLU 17 2HB GLU 17 5.316 2.217 -8.261
93 HG2 GLU 17 1HG GLU 17 2.548 1.718 -9.294
94 HG3 GLU 17 2HG GLU 17 2.969 3.193 -8.427
95 H CYS 18 H CYS 18 4.339 -0.240 -6.375
96 HA CYS 18 HA CYS 18 7.007 -1.365 -5.945
97 HB2 CYS 18 1HB CYS 18 6.511 -1.126 -3.552
98 HB3 CYS 18 2HB CYS 18 6.280 0.398 -4.403
99 H GLY 19 H GLY 19 3.580 -2.158 -5.497
100 HA2 GLY 19 1HA GLY 19 2.913 -4.447 -6.086
101 HA3 GLY 19 2HA GLY 19 4.379 -4.995 -5.287
102 H LYS 20 H LYS 20 2.586 -2.432 -3.830
103 HA LYS 20 HA LYS 20 2.120 -4.013 -1.481
104 HB2 LYS 20 1HB LYS 20 2.700 -1.538 -1.537
105 HB3 LYS 20 2HB LYS 20 1.039 -1.253 -2.041
106 HG2 LYS 20 1HG LYS 20 0.169 -1.950 0.003
107 HG3 LYS 20 2HG LYS 20 1.656 -2.788 0.455
108 HD2 LYS 20 1HD LYS 20 2.777 -0.778 0.918
109 HD3 LYS 20 2HD LYS 20 1.579 0.188 0.053
110 HE2 LYS 20 1HE LYS 20 1.026 0.585 2.262
111 HE3 LYS 20 2HE LYS 20 -0.069 -0.730 1.836
112 HZ1 LYS 20 3HZ LYS 20 2.446 -1.668 2.830
113 HZ2 LYS 20 1HZ LYS 20 0.877 -2.067 3.320
114 HZ3 LYS 20 2HZ LYS 20 1.638 -0.696 3.954
115 H ALA 21 H ALA 21 0.310 -5.026 -0.859
116 HA ALA 21 HA ALA 21 -1.975 -4.973 -2.683
117 HB1 ALA 21 3HB ALA 21 -1.640 -6.825 -0.344
118 HB2 ALA 21 1HB ALA 21 -2.613 -7.048 -1.798
119 HB3 ALA 21 2HB ALA 21 -0.853 -7.123 -1.893
120 H PHE 22 H PHE 22 -3.651 -3.715 -2.243
121 HA PHE 22 HA PHE 22 -4.156 -2.962 0.557
122 HB2 PHE 22 1HB PHE 22 -4.993 -1.532 -1.976
123 HB3 PHE 22 2HB PHE 22 -5.304 -0.982 -0.332
124 HD1 PHE 22 HD2 PHE 22 -2.696 -1.544 -2.865
125 HD2 PHE 22 HD1 PHE 22 -3.625 0.112 0.944
126 HE1 PHE 22 HE2 PHE 22 -0.545 -0.350 -2.864
127 HE2 PHE 22 HE1 PHE 22 -1.476 1.310 0.951
128 HZ PHE 22 HZ PHE 22 0.067 1.079 -0.953
129 H THR 23 H THR 23 -6.316 -2.895 1.318
130 HA THR 23 HA THR 23 -8.025 -4.888 0.038
131 HB THR 23 HB THR 23 -7.562 -5.165 2.433
132 HG1 THR 23 HG1 THR 23 -9.673 -5.596 2.970
133 HG21 THR 23 3HG2 THR 23 -8.537 -3.593 4.059
134 HG22 THR 23 1HG2 THR 23 -9.003 -2.527 2.735
135 HG23 THR 23 2HG2 THR 23 -7.297 -2.828 3.065
136 H ARG 24 H ARG 24 -7.643 -1.765 -0.436
137 HA ARG 24 HA ARG 24 -10.478 -1.343 -1.019
138 HB2 ARG 24 1HB ARG 24 -8.758 0.366 0.730
139 HB3 ARG 24 2HB ARG 24 -9.980 1.135 -0.273
140 HG2 ARG 24 1HG ARG 24 -11.693 -0.308 0.762
141 HG3 ARG 24 2HG ARG 24 -10.448 -0.979 1.818
142 HD2 ARG 24 1HD ARG 24 -11.256 0.652 3.189
143 HD3 ARG 24 2HD ARG 24 -10.024 1.581 2.335
144 HE ARG 24 HE ARG 24 -12.184 1.993 0.806
145 HH11 ARG 24 1HH1 ARG 24 -11.708 2.193 4.249
146 HH12 ARG 24 2HH1 ARG 24 -12.903 3.427 4.474
147 HH21 ARG 24 1HH2 ARG 24 -13.759 3.618 1.090
148 HH22 ARG 24 2HH2 ARG 24 -14.070 4.237 2.677
149 H LYS 25 H LYS 25 -10.778 -0.588 -3.013
150 HA LYS 25 HA LYS 25 -8.645 -0.203 -4.802
151 HB2 LYS 25 1HB LYS 25 -10.991 -0.884 -5.400
152 HB3 LYS 25 2HB LYS 25 -11.479 0.787 -5.150
153 HG2 LYS 25 1HG LYS 25 -9.708 1.385 -6.884
154 HG3 LYS 25 2HG LYS 25 -9.678 -0.338 -7.267
155 HD2 LYS 25 1HD LYS 25 -12.117 -0.246 -7.682
156 HD3 LYS 25 2HD LYS 25 -12.071 1.496 -7.398
157 HE2 LYS 25 1HE LYS 25 -10.894 1.912 -9.345
158 HE3 LYS 25 2HE LYS 25 -10.253 0.272 -9.430
159 HZ1 LYS 25 3HZ LYS 25 -12.851 -0.211 -9.677
160 HZ2 LYS 25 1HZ LYS 25 -11.833 0.067 -10.999
161 HZ3 LYS 25 2HZ LYS 25 -12.785 1.323 -10.388
162 H SER 26 H SER 26 -10.692 2.093 -3.059
163 HA SER 26 HA SER 26 -9.624 4.417 -4.292
164 HB2 SER 26 1HB SER 26 -11.302 3.883 -1.870
165 HB3 SER 26 2HB SER 26 -10.593 5.483 -2.088
166 HG SER 26 HG SER 26 -12.236 5.821 -3.347
167 H THR 27 H THR 27 -8.888 2.687 -1.297
168 HA THR 27 HA THR 27 -7.089 4.475 -0.162
169 HB THR 27 HB THR 27 -7.032 1.453 -0.060
170 HG1 THR 27 HG1 THR 27 -8.843 3.016 0.832
171 HG21 THR 27 3HG2 THR 27 -5.257 1.547 1.293
172 HG22 THR 27 1HG2 THR 27 -5.973 2.843 2.250
173 HG23 THR 27 2HG2 THR 27 -5.061 3.225 0.790
174 H LEU 28 H LEU 28 -6.423 1.781 -2.393
175 HA LEU 28 HA LEU 28 -3.651 2.148 -2.552
176 HB2 LEU 28 1HB LEU 28 -4.402 0.124 -3.382
177 HB3 LEU 28 2HB LEU 28 -5.697 0.872 -4.314
178 HG LEU 28 HG LEU 28 -3.964 1.758 -5.877
179 HD11 LEU 28 1HD1 LEU 28 -1.750 0.558 -5.792
180 HD12 LEU 28 2HD1 LEU 28 -2.172 0.066 -4.152
181 HD13 LEU 28 3HD1 LEU 28 -2.009 1.778 -4.544
182 HD21 LEU 28 3HD2 LEU 28 -3.308 -0.817 -6.494
183 HD22 LEU 28 1HD2 LEU 28 -4.818 -0.021 -6.935
184 HD23 LEU 28 2HD2 LEU 28 -4.745 -1.036 -5.495
185 H SER 29 H SER 29 -6.228 3.316 -4.715
186 HA SER 29 HA SER 29 -4.818 4.616 -6.631
187 HB2 SER 29 1HB SER 29 -7.256 5.752 -5.241
188 HB3 SER 29 2HB SER 29 -6.693 6.166 -6.860
189 HG SER 29 HG SER 29 -6.895 3.633 -6.991
190 H MET 30 H MET 30 -5.362 5.716 -3.330
191 HA MET 30 HA MET 30 -4.172 8.285 -3.718
192 HB2 MET 30 1HB MET 30 -4.829 6.703 -1.232
193 HB3 MET 30 2HB MET 30 -4.153 8.326 -1.192
194 HG2 MET 30 1HG MET 30 -6.189 8.888 -2.731
195 HG3 MET 30 2HG MET 30 -6.860 7.419 -2.028
196 HE1 MET 30 3HE MET 30 -7.175 7.289 0.970
197 HE2 MET 30 1HE MET 30 -8.443 8.515 1.014
198 HE3 MET 30 2HE MET 30 -8.301 7.443 -0.380
199 H HIS 31 H HIS 31 -3.020 5.125 -2.746
200 HA HIS 31 HA HIS 31 -0.471 6.025 -1.815
201 HB2 HIS 31 1HB HIS 31 -0.993 3.975 -0.896
202 HB3 HIS 31 2HB HIS 31 -1.729 3.377 -2.381
203 HD1 HIS 31 HD1 HIS 31 1.609 3.816 -0.716
204 HD2 HIS 31 HD2 HIS 31 -0.013 2.040 -4.103
205 HE1 HIS 31 HE1 HIS 31 3.443 2.383 -1.667
206 H GLN 32 H GLN 32 -1.691 4.678 -4.849
207 HA GLN 32 HA GLN 32 0.712 4.328 -6.193
208 HB2 GLN 32 1HB GLN 32 -1.938 5.217 -7.345
209 HB3 GLN 32 2HB GLN 32 -0.598 4.546 -8.265
210 HG2 GLN 32 1HG GLN 32 -0.806 2.446 -7.021
211 HG3 GLN 32 2HG GLN 32 -2.169 3.121 -6.130
212 HE21 GLN 32 1HE2 GLN 32 -2.412 0.789 -7.553
213 HE22 GLN 32 2HE2 GLN 32 -3.443 1.047 -8.914
214 H LYS 33 H LYS 33 -0.788 7.216 -5.183
215 HA LYS 33 HA LYS 33 0.215 8.986 -7.161
216 HB2 LYS 33 1HB LYS 33 -0.749 9.394 -4.335
217 HB3 LYS 33 2HB LYS 33 -0.175 10.726 -5.328
218 HG2 LYS 33 1HG LYS 33 -1.912 9.897 -7.046
219 HG3 LYS 33 2HG LYS 33 -2.611 9.028 -5.677
220 HD2 LYS 33 1HD LYS 33 -1.986 11.954 -5.486
221 HD3 LYS 33 2HD LYS 33 -3.487 11.395 -6.228
222 HE2 LYS 33 1HE LYS 33 -4.327 10.599 -4.251
223 HE3 LYS 33 2HE LYS 33 -2.729 10.292 -3.572
224 HZ1 LYS 33 3HZ LYS 33 -2.947 13.037 -3.968
225 HZ2 LYS 33 1HZ LYS 33 -2.891 12.203 -2.497
226 HZ3 LYS 33 2HZ LYS 33 -4.381 12.541 -3.221
227 H ILE 34 H ILE 34 1.728 7.273 -4.667
228 HA ILE 34 HA ILE 34 3.843 9.174 -4.176
229 HB ILE 34 HB ILE 34 4.740 7.640 -2.658
230 HG12 ILE 34 1HG1 ILE 34 3.164 5.481 -4.076
231 HG13 ILE 34 2HG1 ILE 34 4.906 5.719 -4.159
232 HG21 ILE 34 1HG2 ILE 34 2.580 6.578 -1.591
233 HG22 ILE 34 2HG2 ILE 34 2.844 8.321 -1.577
234 HG23 ILE 34 3HG2 ILE 34 1.769 7.601 -2.776
235 HD11 ILE 34 3HD1 ILE 34 4.863 5.385 -1.617
236 HD12 ILE 34 1HD1 ILE 34 3.251 4.719 -1.880
237 HD13 ILE 34 2HD1 ILE 34 4.650 3.975 -2.655
238 H HIS 35 H HIS 35 3.137 6.985 -6.619
239 HA HIS 35 HA HIS 35 5.971 6.640 -7.325
240 HB2 HIS 35 1HB HIS 35 3.534 5.179 -8.367
241 HB3 HIS 35 2HB HIS 35 5.198 4.861 -8.846
242 HD1 HIS 35 HD1 HIS 35 6.798 4.073 -6.765
243 HD2 HIS 35 HD2 HIS 35 2.691 3.690 -6.265
244 HE1 HIS 35 HE1 HIS 35 6.500 2.445 -4.872
245 H THR 36 H THR 36 3.051 8.213 -8.222
246 HA THR 36 HA THR 36 3.955 8.788 -10.928
247 HB THR 36 HB THR 36 1.797 10.235 -10.902
248 HG1 THR 36 HG1 THR 36 0.348 8.998 -9.265
249 HG21 THR 36 3HG2 THR 36 1.685 8.347 -12.235
250 HG22 THR 36 1HG2 THR 36 0.413 8.025 -11.058
251 HG23 THR 36 2HG2 THR 36 1.989 7.250 -10.889
252 H GLY 37 H GLY 37 5.166 9.842 -8.282
253 HA2 GLY 37 1HA GLY 37 5.141 12.690 -9.074
254 HA3 GLY 37 2HA GLY 37 5.254 12.165 -7.400
255 H GLU 38 H GLU 38 6.926 11.455 -10.473
256 HA GLU 38 HA GLU 38 9.442 12.326 -9.348
257 HB2 GLU 38 1HB GLU 38 8.999 9.856 -8.675
258 HB3 GLU 38 2HB GLU 38 9.355 9.501 -10.360
259 HG2 GLU 38 1HG GLU 38 11.279 9.270 -8.777
260 HG3 GLU 38 2HG GLU 38 11.562 10.316 -10.168
261 H LYS 39 H LYS 39 11.145 12.445 -10.928
262 HA LYS 39 HA LYS 39 10.202 13.220 -13.496
263 HB2 LYS 39 1HB LYS 39 12.591 13.590 -14.013
264 HB3 LYS 39 2HB LYS 39 12.108 14.339 -12.497
265 HG2 LYS 39 1HG LYS 39 14.073 13.399 -11.852
266 HG3 LYS 39 2HG LYS 39 12.979 12.060 -11.494
267 HD2 LYS 39 1HD LYS 39 14.757 11.069 -12.653
268 HD3 LYS 39 2HD LYS 39 13.490 11.251 -13.869
269 HE2 LYS 39 1HE LYS 39 15.377 12.014 -14.978
270 HE3 LYS 39 2HE LYS 39 14.645 13.506 -14.388
271 HZ1 LYS 39 3HZ LYS 39 16.213 13.007 -12.356
272 HZ2 LYS 39 1HZ LYS 39 16.780 13.823 -13.725
273 HZ3 LYS 39 2HZ LYS 39 17.103 12.175 -13.529
274 HA PRO 40 HA PRO 40 10.448 9.448 -15.738
275 HB2 PRO 40 1HB PRO 40 10.976 10.407 -18.223
276 HB3 PRO 40 2HB PRO 40 9.393 10.557 -17.451
277 HG2 PRO 40 1HG PRO 40 11.591 12.577 -17.674
278 HG3 PRO 40 2HG PRO 40 9.844 12.796 -17.889
279 HD2 PRO 40 1HD PRO 40 11.129 13.487 -15.608
280 HD3 PRO 40 2HD PRO 40 9.451 12.907 -15.620
281 H SER 41 H SER 41 11.896 8.075 -16.926
282 HA SER 41 HA SER 41 14.626 8.928 -17.341
283 HB2 SER 41 1HB SER 41 13.844 7.093 -15.096
284 HB3 SER 41 2HB SER 41 15.407 6.899 -15.891
285 HG SER 41 HG SER 41 14.878 8.538 -13.969
286 H GLY 42 H GLY 42 15.761 7.594 -18.732
287 HA2 GLY 42 1HA GLY 42 15.137 4.952 -19.388
288 HA3 GLY 42 2HA GLY 42 14.233 5.988 -20.483
289 HA PRO 43 HA PRO 43 17.792 5.922 -23.079
290 HB2 PRO 43 1HB PRO 43 17.112 7.983 -24.711
291 HB3 PRO 43 2HB PRO 43 16.347 6.392 -24.803
292 HG2 PRO 43 1HG PRO 43 15.369 8.890 -23.476
293 HG3 PRO 43 2HG PRO 43 14.472 7.725 -24.466
294 HD2 PRO 43 1HD PRO 43 14.358 7.729 -21.761
295 HD3 PRO 43 2HD PRO 43 14.223 6.241 -22.720
296 H SER 44 H SER 44 19.773 6.809 -22.988
297 HA SER 44 HA SER 44 20.191 9.610 -22.510
298 HB2 SER 44 1HB SER 44 20.884 7.598 -20.361
299 HB3 SER 44 2HB SER 44 21.560 9.226 -20.427
300 HG SER 44 HG SER 44 19.739 10.001 -19.708
301 H SER 45 H SER 45 22.188 10.274 -23.171
302 HA SER 45 HA SER 45 23.901 8.198 -24.339
303 HB2 SER 45 1HB SER 45 23.561 11.139 -24.916
304 HB3 SER 45 2HB SER 45 24.931 10.220 -25.540
305 HG SER 45 HG SER 45 22.825 10.424 -26.815
306 H GLY 46 H GLY 46 24.866 7.647 -22.300
307 HA2 GLY 46 1HA GLY 46 26.527 7.754 -20.719
308 HA3 GLY 46 2HA GLY 46 27.349 8.824 -21.845
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -4.996 -35.368 -15.102
2 HA2 GLY 1 1HA GLY 1 -6.351 -33.630 -14.278
3 HA3 GLY 1 2HA GLY 1 -5.792 -34.395 -12.798
4 H SER 2 H SER 2 -6.566 -31.701 -12.964
5 HA SER 2 HA SER 2 -4.007 -30.401 -12.329
6 HB2 SER 2 1HB SER 2 -6.289 -29.042 -13.780
7 HB3 SER 2 2HB SER 2 -4.719 -28.341 -13.386
8 HG SER 2 HG SER 2 -5.236 -29.397 -15.603
9 H SER 3 H SER 3 -4.014 -29.063 -10.569
10 HA SER 3 HA SER 3 -6.512 -28.324 -9.295
11 HB2 SER 3 1HB SER 3 -6.043 -30.610 -8.433
12 HB3 SER 3 2HB SER 3 -4.494 -30.033 -7.819
13 HG SER 3 HG SER 3 -5.541 -29.392 -6.128
14 H GLY 4 H GLY 4 -6.259 -26.732 -7.646
15 HA2 GLY 4 1HA GLY 4 -3.733 -25.740 -6.825
16 HA3 GLY 4 2HA GLY 4 -4.345 -24.783 -8.165
17 H SER 5 H SER 5 -3.877 -24.110 -5.307
18 HA SER 5 HA SER 5 -6.517 -22.943 -4.810
19 HB2 SER 5 1HB SER 5 -6.365 -24.939 -3.376
20 HB3 SER 5 2HB SER 5 -4.857 -24.333 -2.692
21 HG SER 5 HG SER 5 -7.268 -23.844 -1.833
22 H SER 6 H SER 6 -6.145 -20.833 -4.981
23 HA SER 6 HA SER 6 -4.056 -19.643 -3.323
24 HB2 SER 6 1HB SER 6 -3.350 -20.039 -5.831
25 HB3 SER 6 2HB SER 6 -4.339 -18.608 -6.119
26 HG SER 6 HG SER 6 -2.317 -17.860 -5.709
27 H GLY 7 H GLY 7 -4.340 -17.321 -3.015
28 HA2 GLY 7 1HA GLY 7 -5.836 -15.389 -3.555
29 HA3 GLY 7 2HA GLY 7 -7.164 -16.526 -3.378
30 H THR 8 H THR 8 -6.663 -14.033 -1.943
31 HA THR 8 HA THR 8 -6.477 -15.119 0.792
32 HB THR 8 HB THR 8 -4.578 -13.610 0.211
33 HG1 THR 8 HG1 THR 8 -5.376 -12.027 2.069
34 HG21 THR 8 3HG2 THR 8 -6.266 -11.205 0.404
35 HG22 THR 8 1HG2 THR 8 -6.410 -12.105 -1.105
36 HG23 THR 8 2HG2 THR 8 -4.835 -11.511 -0.580
37 H GLY 9 H GLY 9 -8.882 -15.047 -0.681
38 HA2 GLY 9 1HA GLY 9 -11.075 -14.419 -0.425
39 HA3 GLY 9 2HA GLY 9 -10.607 -13.816 1.158
40 H GLY 10 H GLY 10 -12.518 -12.682 -0.721
41 HA2 GLY 10 1HA GLY 10 -13.115 -10.636 -1.574
42 HA3 GLY 10 2HA GLY 10 -11.946 -9.977 -0.440
43 H LYS 11 H LYS 11 -12.274 -8.624 -2.715
44 HA LYS 11 HA LYS 11 -10.187 -9.480 -4.579
45 HB2 LYS 11 1HB LYS 11 -12.236 -7.264 -4.752
46 HB3 LYS 11 2HB LYS 11 -11.032 -7.599 -5.989
47 HG2 LYS 11 1HG LYS 11 -12.808 -9.818 -5.128
48 HG3 LYS 11 2HG LYS 11 -13.485 -8.545 -6.146
49 HD2 LYS 11 1HD LYS 11 -10.893 -9.836 -6.894
50 HD3 LYS 11 2HD LYS 11 -12.418 -10.654 -7.243
51 HE2 LYS 11 1HE LYS 11 -13.161 -8.865 -8.614
52 HE3 LYS 11 2HE LYS 11 -11.854 -7.815 -8.068
53 HZ1 LYS 11 3HZ LYS 11 -11.409 -10.322 -9.588
54 HZ2 LYS 11 1HZ LYS 11 -10.273 -9.119 -9.234
55 HZ3 LYS 11 2HZ LYS 11 -11.533 -8.800 -10.315
56 H HIS 12 H HIS 12 -8.221 -8.937 -3.835
57 HA HIS 12 HA HIS 12 -7.825 -6.292 -2.641
58 HB2 HIS 12 1HB HIS 12 -5.928 -7.122 -1.598
59 HB3 HIS 12 2HB HIS 12 -6.953 -8.553 -1.652
60 HD1 HIS 12 HD1 HIS 12 -6.294 -10.413 -3.369
61 HD2 HIS 12 HD2 HIS 12 -3.594 -7.267 -3.089
62 HE1 HIS 12 HE1 HIS 12 -4.203 -11.218 -4.510
63 H PHE 13 H PHE 13 -6.548 -4.743 -3.536
64 HA PHE 13 HA PHE 13 -5.673 -5.227 -6.293
65 HB2 PHE 13 1HB PHE 13 -6.225 -2.666 -4.786
66 HB3 PHE 13 2HB PHE 13 -5.573 -2.719 -6.421
67 HD1 PHE 13 HD2 PHE 13 -8.475 -3.848 -4.391
68 HD2 PHE 13 HD1 PHE 13 -7.004 -2.778 -8.239
69 HE1 PHE 13 HE2 PHE 13 -10.761 -3.963 -5.293
70 HE2 PHE 13 HE1 PHE 13 -9.288 -2.890 -9.147
71 HZ PHE 13 HZ PHE 13 -11.170 -3.484 -7.674
72 H GLU 14 H GLU 14 -3.587 -5.014 -6.925
73 HA GLU 14 HA GLU 14 -1.620 -4.464 -4.805
74 HB2 GLU 14 1HB GLU 14 -1.668 -6.764 -5.883
75 HB3 GLU 14 2HB GLU 14 -1.113 -5.986 -7.359
76 HG2 GLU 14 1HG GLU 14 0.960 -5.477 -6.470
77 HG3 GLU 14 2HG GLU 14 0.393 -5.620 -4.807
78 H CYS 15 H CYS 15 -0.147 -2.884 -5.062
79 HA CYS 15 HA CYS 15 -0.539 -0.895 -7.022
80 HB2 CYS 15 1HB CYS 15 0.434 -0.504 -4.757
81 HB3 CYS 15 2HB CYS 15 1.904 -1.313 -5.290
82 H THR 16 H THR 16 0.265 -0.640 -9.006
83 HA THR 16 HA THR 16 1.947 -2.713 -10.117
84 HB THR 16 HB THR 16 0.993 -0.237 -11.550
85 HG1 THR 16 HG1 THR 16 -0.628 -1.801 -10.408
86 HG21 THR 16 3HG2 THR 16 2.085 -2.900 -12.343
87 HG22 THR 16 1HG2 THR 16 2.454 -1.299 -12.982
88 HG23 THR 16 2HG2 THR 16 0.938 -2.092 -13.412
89 H GLU 17 H GLU 17 2.986 -0.700 -8.128
90 HA GLU 17 HA GLU 17 5.242 0.273 -9.754
91 HB2 GLU 17 1HB GLU 17 4.110 1.597 -7.283
92 HB3 GLU 17 2HB GLU 17 5.448 2.184 -8.260
93 HG2 GLU 17 1HG GLU 17 2.793 1.744 -9.536
94 HG3 GLU 17 2HG GLU 17 3.057 3.178 -8.544
95 H CYS 18 H CYS 18 4.332 -0.429 -6.376
96 HA CYS 18 HA CYS 18 7.056 -1.443 -5.933
97 HB2 CYS 18 1HB CYS 18 6.590 -1.148 -3.533
98 HB3 CYS 18 2HB CYS 18 6.386 0.358 -4.423
99 H GLY 19 H GLY 19 3.637 -2.234 -5.565
100 HA2 GLY 19 1HA GLY 19 2.955 -4.524 -6.026
101 HA3 GLY 19 2HA GLY 19 4.429 -5.058 -5.231
102 H LYS 20 H LYS 20 2.609 -2.461 -3.845
103 HA LYS 20 HA LYS 20 2.170 -3.997 -1.449
104 HB2 LYS 20 1HB LYS 20 2.752 -1.466 -1.689
105 HB3 LYS 20 2HB LYS 20 1.021 -1.267 -1.926
106 HG2 LYS 20 1HG LYS 20 0.517 -1.962 0.232
107 HG3 LYS 20 2HG LYS 20 2.079 -2.755 0.444
108 HD2 LYS 20 1HD LYS 20 3.205 -0.679 0.657
109 HD3 LYS 20 2HD LYS 20 1.793 0.222 0.099
110 HE2 LYS 20 1HE LYS 20 1.743 0.544 2.397
111 HE3 LYS 20 2HE LYS 20 0.617 -0.792 2.161
112 HZ1 LYS 20 3HZ LYS 20 3.463 -1.272 2.796
113 HZ2 LYS 20 1HZ LYS 20 2.149 -2.322 2.977
114 HZ3 LYS 20 2HZ LYS 20 2.324 -0.999 4.016
115 H ALA 21 H ALA 21 0.286 -4.812 -0.680
116 HA ALA 21 HA ALA 21 -1.971 -4.865 -2.541
117 HB1 ALA 21 3HB ALA 21 -2.778 -6.754 -1.234
118 HB2 ALA 21 1HB ALA 21 -1.106 -7.009 -1.737
119 HB3 ALA 21 2HB ALA 21 -1.465 -6.530 -0.078
120 H PHE 22 H PHE 22 -3.815 -3.811 -2.175
121 HA PHE 22 HA PHE 22 -4.275 -2.708 0.518
122 HB2 PHE 22 1HB PHE 22 -4.984 -1.430 -2.131
123 HB3 PHE 22 2HB PHE 22 -5.331 -0.759 -0.541
124 HD1 PHE 22 HD2 PHE 22 -2.676 -1.544 -2.955
125 HD2 PHE 22 HD1 PHE 22 -3.646 0.339 0.736
126 HE1 PHE 22 HE2 PHE 22 -0.488 -0.418 -2.958
127 HE2 PHE 22 HE1 PHE 22 -1.461 1.469 0.739
128 HZ PHE 22 HZ PHE 22 0.122 1.090 -1.110
129 H THR 23 H THR 23 -6.222 -3.052 1.421
130 HA THR 23 HA THR 23 -8.033 -4.868 0.112
131 HB THR 23 HB THR 23 -8.315 -3.499 2.794
132 HG1 THR 23 HG1 THR 23 -7.691 -5.819 3.383
133 HG21 THR 23 3HG2 THR 23 -10.037 -5.277 1.273
134 HG22 THR 23 1HG2 THR 23 -10.382 -4.352 2.734
135 HG23 THR 23 2HG2 THR 23 -9.624 -5.940 2.853
136 H ARG 24 H ARG 24 -7.628 -1.660 -0.216
137 HA ARG 24 HA ARG 24 -10.455 -1.259 -0.896
138 HB2 ARG 24 1HB ARG 24 -8.732 0.457 0.848
139 HB3 ARG 24 2HB ARG 24 -9.966 1.213 -0.151
140 HG2 ARG 24 1HG ARG 24 -11.684 0.336 1.058
141 HG3 ARG 24 2HG ARG 24 -10.766 -1.097 1.529
142 HD2 ARG 24 1HD ARG 24 -10.166 1.666 2.562
143 HD3 ARG 24 2HD ARG 24 -11.259 0.547 3.375
144 HE ARG 24 HE ARG 24 -8.380 0.414 3.287
145 HH11 ARG 24 1HH1 ARG 24 -11.339 -1.338 3.827
146 HH12 ARG 24 2HH1 ARG 24 -10.589 -2.567 4.791
147 HH21 ARG 24 1HH2 ARG 24 -7.380 -1.198 4.554
148 HH22 ARG 24 2HH2 ARG 24 -8.337 -2.486 5.204
149 H LYS 25 H LYS 25 -10.558 -0.898 -3.003
150 HA LYS 25 HA LYS 25 -8.428 -0.355 -4.690
151 HB2 LYS 25 1HB LYS 25 -10.608 -1.219 -5.447
152 HB3 LYS 25 2HB LYS 25 -11.338 0.348 -5.122
153 HG2 LYS 25 1HG LYS 25 -9.567 1.254 -6.769
154 HG3 LYS 25 2HG LYS 25 -9.419 -0.430 -7.279
155 HD2 LYS 25 1HD LYS 25 -11.941 -0.413 -7.567
156 HD3 LYS 25 2HD LYS 25 -11.852 1.340 -7.381
157 HE2 LYS 25 1HE LYS 25 -11.697 1.202 -9.650
158 HE3 LYS 25 2HE LYS 25 -9.987 1.072 -9.241
159 HZ1 LYS 25 3HZ LYS 25 -11.628 -1.360 -9.470
160 HZ2 LYS 25 1HZ LYS 25 -9.961 -1.171 -9.685
161 HZ3 LYS 25 2HZ LYS 25 -11.034 -0.614 -10.867
162 H SER 26 H SER 26 -10.618 1.871 -3.054
163 HA SER 26 HA SER 26 -9.719 4.218 -4.368
164 HB2 SER 26 1HB SER 26 -11.160 3.774 -1.751
165 HB3 SER 26 2HB SER 26 -10.780 5.380 -2.371
166 HG SER 26 HG SER 26 -12.732 3.631 -3.135
167 H THR 27 H THR 27 -8.884 2.731 -1.255
168 HA THR 27 HA THR 27 -7.128 4.654 -0.301
169 HB THR 27 HB THR 27 -7.024 1.654 0.053
170 HG1 THR 27 HG1 THR 27 -8.889 2.884 0.857
171 HG21 THR 27 3HG2 THR 27 -5.134 3.681 0.834
172 HG22 THR 27 1HG2 THR 27 -5.049 1.934 1.051
173 HG23 THR 27 2HG2 THR 27 -5.858 2.933 2.258
174 H LEU 28 H LEU 28 -6.377 1.790 -2.283
175 HA LEU 28 HA LEU 28 -3.633 2.185 -2.509
176 HB2 LEU 28 1HB LEU 28 -4.242 0.143 -3.308
177 HB3 LEU 28 2HB LEU 28 -5.701 0.760 -4.080
178 HG LEU 28 HG LEU 28 -4.205 1.760 -5.848
179 HD11 LEU 28 1HD1 LEU 28 -1.967 0.722 -6.069
180 HD12 LEU 28 2HD1 LEU 28 -2.165 0.031 -4.459
181 HD13 LEU 28 3HD1 LEU 28 -2.112 1.781 -4.666
182 HD21 LEU 28 3HD2 LEU 28 -4.876 -1.050 -5.395
183 HD22 LEU 28 1HD2 LEU 28 -3.570 -0.802 -6.554
184 HD23 LEU 28 2HD2 LEU 28 -5.136 -0.033 -6.813
185 H SER 29 H SER 29 -6.261 3.386 -4.569
186 HA SER 29 HA SER 29 -4.864 4.568 -6.601
187 HB2 SER 29 1HB SER 29 -7.345 4.519 -6.411
188 HB3 SER 29 2HB SER 29 -7.251 5.798 -5.201
189 HG SER 29 HG SER 29 -5.923 6.292 -7.577
190 H MET 30 H MET 30 -5.298 5.755 -3.318
191 HA MET 30 HA MET 30 -4.081 8.299 -3.821
192 HB2 MET 30 1HB MET 30 -4.763 6.827 -1.277
193 HB3 MET 30 2HB MET 30 -4.032 8.426 -1.293
194 HG2 MET 30 1HG MET 30 -5.993 9.177 -2.686
195 HG3 MET 30 2HG MET 30 -6.736 7.622 -2.318
196 HE1 MET 30 3HE MET 30 -5.650 7.188 0.714
197 HE2 MET 30 1HE MET 30 -7.060 7.793 1.585
198 HE3 MET 30 2HE MET 30 -7.274 6.804 0.141
199 H HIS 31 H HIS 31 -2.984 5.149 -2.779
200 HA HIS 31 HA HIS 31 -0.427 5.996 -1.843
201 HB2 HIS 31 1HB HIS 31 -1.032 3.935 -0.971
202 HB3 HIS 31 2HB HIS 31 -1.685 3.361 -2.502
203 HD1 HIS 31 HD1 HIS 31 1.581 3.837 -0.694
204 HD2 HIS 31 HD2 HIS 31 0.101 2.005 -4.116
205 HE1 HIS 31 HE1 HIS 31 3.464 2.414 -1.563
206 H GLN 32 H GLN 32 -1.629 4.690 -4.905
207 HA GLN 32 HA GLN 32 0.788 4.353 -6.231
208 HB2 GLN 32 1HB GLN 32 -1.982 5.014 -7.186
209 HB3 GLN 32 2HB GLN 32 -0.645 4.895 -8.321
210 HG2 GLN 32 1HG GLN 32 -0.223 2.590 -7.318
211 HG3 GLN 32 2HG GLN 32 -1.820 2.753 -6.587
212 HE21 GLN 32 1HE2 GLN 32 -3.638 2.710 -7.886
213 HE22 GLN 32 2HE2 GLN 32 -3.593 2.180 -9.530
214 H LYS 33 H LYS 33 -0.712 7.227 -5.196
215 HA LYS 33 HA LYS 33 0.302 9.016 -7.155
216 HB2 LYS 33 1HB LYS 33 -0.678 9.410 -4.330
217 HB3 LYS 33 2HB LYS 33 -0.120 10.746 -5.329
218 HG2 LYS 33 1HG LYS 33 -1.859 9.787 -7.039
219 HG3 LYS 33 2HG LYS 33 -2.569 9.075 -5.588
220 HD2 LYS 33 1HD LYS 33 -1.919 12.004 -5.884
221 HD3 LYS 33 2HD LYS 33 -3.506 11.308 -6.216
222 HE2 LYS 33 1HE LYS 33 -3.292 10.337 -3.817
223 HE3 LYS 33 2HE LYS 33 -2.063 11.583 -3.609
224 HZ1 LYS 33 3HZ LYS 33 -4.194 12.867 -4.763
225 HZ2 LYS 33 1HZ LYS 33 -3.725 12.954 -3.140
226 HZ3 LYS 33 2HZ LYS 33 -4.898 11.836 -3.622
227 H ILE 34 H ILE 34 1.796 7.278 -4.672
228 HA ILE 34 HA ILE 34 3.905 9.183 -4.151
229 HB ILE 34 HB ILE 34 4.779 7.654 -2.614
230 HG12 ILE 34 1HG1 ILE 34 3.221 5.495 -4.053
231 HG13 ILE 34 2HG1 ILE 34 4.966 5.723 -4.094
232 HG21 ILE 34 1HG2 ILE 34 2.859 8.359 -1.578
233 HG22 ILE 34 2HG2 ILE 34 1.806 7.598 -2.769
234 HG23 ILE 34 3HG2 ILE 34 2.618 6.612 -1.553
235 HD11 ILE 34 3HD1 ILE 34 3.248 4.742 -1.853
236 HD12 ILE 34 1HD1 ILE 34 4.658 3.983 -2.593
237 HD13 ILE 34 2HD1 ILE 34 4.859 5.394 -1.554
238 H HIS 35 H HIS 35 3.225 6.919 -6.557
239 HA HIS 35 HA HIS 35 6.067 6.622 -7.255
240 HB2 HIS 35 1HB HIS 35 3.693 5.076 -8.316
241 HB3 HIS 35 2HB HIS 35 5.389 4.752 -8.664
242 HD1 HIS 35 HD1 HIS 35 6.842 4.127 -6.407
243 HD2 HIS 35 HD2 HIS 35 2.720 3.640 -6.239
244 HE1 HIS 35 HE1 HIS 35 6.426 2.581 -4.468
245 H THR 36 H THR 36 3.042 7.969 -8.271
246 HA THR 36 HA THR 36 3.977 8.534 -10.961
247 HB THR 36 HB THR 36 1.734 9.888 -10.971
248 HG1 THR 36 HG1 THR 36 0.444 8.347 -9.324
249 HG21 THR 36 3HG2 THR 36 2.028 6.897 -10.936
250 HG22 THR 36 1HG2 THR 36 1.882 7.974 -12.324
251 HG23 THR 36 2HG2 THR 36 0.484 7.672 -11.291
252 H GLY 37 H GLY 37 5.031 9.748 -8.293
253 HA2 GLY 37 1HA GLY 37 4.486 12.462 -8.160
254 HA3 GLY 37 2HA GLY 37 6.022 11.735 -7.710
255 H GLU 38 H GLU 38 4.991 14.216 -9.317
256 HA GLU 38 HA GLU 38 6.501 13.824 -11.785
257 HB2 GLU 38 1HB GLU 38 4.723 16.058 -10.810
258 HB3 GLU 38 2HB GLU 38 5.652 16.155 -12.299
259 HG2 GLU 38 1HG GLU 38 3.673 15.428 -13.134
260 HG3 GLU 38 2HG GLU 38 4.435 13.873 -12.802
261 H LYS 39 H LYS 39 6.339 16.300 -9.219
262 HA LYS 39 HA LYS 39 9.171 16.902 -9.740
263 HB2 LYS 39 1HB LYS 39 7.513 18.762 -9.999
264 HB3 LYS 39 2HB LYS 39 7.146 18.611 -8.286
265 HG2 LYS 39 1HG LYS 39 9.407 19.223 -7.706
266 HG3 LYS 39 2HG LYS 39 9.862 19.264 -9.411
267 HD2 LYS 39 1HD LYS 39 9.498 21.506 -8.891
268 HD3 LYS 39 2HD LYS 39 7.982 21.011 -9.648
269 HE2 LYS 39 1HE LYS 39 7.254 22.164 -7.777
270 HE3 LYS 39 2HE LYS 39 7.231 20.490 -7.224
271 HZ1 LYS 39 3HZ LYS 39 9.162 20.800 -5.981
272 HZ2 LYS 39 1HZ LYS 39 8.278 22.216 -5.704
273 HZ3 LYS 39 2HZ LYS 39 9.580 22.229 -6.784
274 HA PRO 40 HA PRO 40 9.256 14.692 -5.705
275 HB2 PRO 40 1HB PRO 40 11.670 13.533 -6.153
276 HB3 PRO 40 2HB PRO 40 10.150 12.840 -6.730
277 HG2 PRO 40 1HG PRO 40 12.171 14.475 -8.215
278 HG3 PRO 40 2HG PRO 40 11.302 13.021 -8.741
279 HD2 PRO 40 1HD PRO 40 10.565 15.514 -9.501
280 HD3 PRO 40 2HD PRO 40 9.393 14.201 -9.270
281 H SER 41 H SER 41 11.228 17.012 -7.286
282 HA SER 41 HA SER 41 13.358 17.400 -5.596
283 HB2 SER 41 1HB SER 41 13.172 18.702 -7.608
284 HB3 SER 41 2HB SER 41 11.677 19.451 -7.050
285 HG SER 41 HG SER 41 14.060 20.401 -6.742
286 H GLY 42 H GLY 42 13.713 19.041 -3.918
287 HA2 GLY 42 1HA GLY 42 11.916 20.487 -2.496
288 HA3 GLY 42 2HA GLY 42 11.656 18.854 -1.900
289 HA PRO 43 HA PRO 43 14.886 19.436 1.007
290 HB2 PRO 43 1HB PRO 43 15.750 16.881 1.317
291 HB3 PRO 43 2HB PRO 43 14.209 17.459 1.962
292 HG2 PRO 43 1HG PRO 43 14.753 15.911 -0.542
293 HG3 PRO 43 2HG PRO 43 13.462 15.688 0.654
294 HD2 PRO 43 1HD PRO 43 13.062 16.960 -1.703
295 HD3 PRO 43 2HD PRO 43 12.185 17.395 -0.222
296 H SER 44 H SER 44 17.250 18.433 1.391
297 HA SER 44 HA SER 44 18.770 19.271 -0.917
298 HB2 SER 44 1HB SER 44 19.754 18.284 1.770
299 HB3 SER 44 2HB SER 44 20.711 19.123 0.550
300 HG SER 44 HG SER 44 20.001 20.927 1.332
301 H SER 45 H SER 45 18.187 17.532 -2.344
302 HA SER 45 HA SER 45 18.269 15.378 -3.184
303 HB2 SER 45 1HB SER 45 20.653 14.697 -3.560
304 HB3 SER 45 2HB SER 45 20.309 16.364 -4.020
305 HG SER 45 HG SER 45 21.370 15.638 -1.496
306 H GLY 46 H GLY 46 17.434 15.218 -0.544
307 HA2 GLY 46 1HA GLY 46 19.010 13.440 1.017
308 HA3 GLY 46 2HA GLY 46 17.306 13.794 1.257
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -2.292 -37.503 -1.656
2 HA2 GLY 1 1HA GLY 1 -1.140 -35.240 -1.628
3 HA3 GLY 1 2HA GLY 1 -0.808 -35.570 -3.322
4 H SER 2 H SER 2 -2.345 -33.395 -2.036
5 HA SER 2 HA SER 2 -4.699 -33.601 -3.735
6 HB2 SER 2 1HB SER 2 -5.407 -34.433 -1.491
7 HB3 SER 2 2HB SER 2 -4.948 -32.874 -0.807
8 HG SER 2 HG SER 2 -6.797 -33.120 -2.935
9 H SER 3 H SER 3 -4.756 -31.819 -4.914
10 HA SER 3 HA SER 3 -3.644 -29.339 -3.779
11 HB2 SER 3 1HB SER 3 -2.482 -30.253 -5.794
12 HB3 SER 3 2HB SER 3 -3.978 -30.044 -6.704
13 HG SER 3 HG SER 3 -3.560 -27.748 -5.557
14 H GLY 4 H GLY 4 -5.406 -28.384 -2.868
15 HA2 GLY 4 1HA GLY 4 -7.741 -27.950 -4.625
16 HA3 GLY 4 2HA GLY 4 -7.825 -28.017 -2.871
17 H SER 5 H SER 5 -9.012 -25.941 -3.371
18 HA SER 5 HA SER 5 -7.080 -23.722 -3.300
19 HB2 SER 5 1HB SER 5 -8.531 -22.345 -4.649
20 HB3 SER 5 2HB SER 5 -8.253 -23.857 -5.514
21 HG SER 5 HG SER 5 -10.331 -24.078 -5.527
22 H SER 6 H SER 6 -7.791 -21.840 -2.140
23 HA SER 6 HA SER 6 -9.872 -22.451 -0.143
24 HB2 SER 6 1HB SER 6 -7.579 -22.386 0.800
25 HB3 SER 6 2HB SER 6 -7.409 -20.727 0.227
26 HG SER 6 HG SER 6 -8.688 -21.684 2.436
27 H GLY 7 H GLY 7 -8.177 -19.697 -1.657
28 HA2 GLY 7 1HA GLY 7 -9.554 -18.108 -2.933
29 HA3 GLY 7 2HA GLY 7 -10.767 -18.274 -1.672
30 H THR 8 H THR 8 -9.342 -15.893 -2.723
31 HA THR 8 HA THR 8 -7.562 -15.025 -0.644
32 HB THR 8 HB THR 8 -7.191 -14.117 -2.828
33 HG1 THR 8 HG1 THR 8 -7.449 -11.824 -2.322
34 HG21 THR 8 3HG2 THR 8 -9.384 -12.379 -3.242
35 HG22 THR 8 1HG2 THR 8 -10.043 -13.981 -2.917
36 HG23 THR 8 2HG2 THR 8 -8.884 -13.753 -4.227
37 H GLY 9 H GLY 9 -10.908 -15.253 -0.905
38 HA2 GLY 9 1HA GLY 9 -12.643 -14.458 0.370
39 HA3 GLY 9 2HA GLY 9 -11.433 -14.174 1.612
40 H GLY 10 H GLY 10 -12.494 -12.737 -1.479
41 HA2 GLY 10 1HA GLY 10 -13.537 -10.474 -1.232
42 HA3 GLY 10 2HA GLY 10 -12.164 -10.090 -0.205
43 H LYS 11 H LYS 11 -12.044 -8.285 -1.813
44 HA LYS 11 HA LYS 11 -10.466 -9.131 -4.154
45 HB2 LYS 11 1HB LYS 11 -12.617 -7.086 -3.875
46 HB3 LYS 11 2HB LYS 11 -11.294 -6.745 -4.982
47 HG2 LYS 11 1HG LYS 11 -12.666 -9.379 -5.164
48 HG3 LYS 11 2HG LYS 11 -13.476 -7.945 -5.800
49 HD2 LYS 11 1HD LYS 11 -10.648 -8.655 -6.538
50 HD3 LYS 11 2HD LYS 11 -12.040 -9.277 -7.428
51 HE2 LYS 11 1HE LYS 11 -12.748 -6.796 -7.584
52 HE3 LYS 11 2HE LYS 11 -11.072 -6.453 -7.161
53 HZ1 LYS 11 3HZ LYS 11 -10.590 -6.705 -9.295
54 HZ2 LYS 11 1HZ LYS 11 -12.156 -7.235 -9.659
55 HZ3 LYS 11 2HZ LYS 11 -10.980 -8.346 -9.166
56 H HIS 12 H HIS 12 -8.409 -8.547 -4.040
57 HA HIS 12 HA HIS 12 -7.714 -6.145 -2.480
58 HB2 HIS 12 1HB HIS 12 -5.852 -7.186 -1.606
59 HB3 HIS 12 2HB HIS 12 -6.951 -8.557 -1.734
60 HD1 HIS 12 HD1 HIS 12 -6.252 -10.463 -3.223
61 HD2 HIS 12 HD2 HIS 12 -3.829 -7.116 -3.652
62 HE1 HIS 12 HE1 HIS 12 -4.322 -11.209 -4.652
63 H PHE 13 H PHE 13 -6.561 -4.588 -3.458
64 HA PHE 13 HA PHE 13 -5.733 -5.073 -6.236
65 HB2 PHE 13 1HB PHE 13 -6.357 -2.480 -4.809
66 HB3 PHE 13 2HB PHE 13 -5.827 -2.604 -6.483
67 HD1 PHE 13 HD2 PHE 13 -8.434 -4.132 -4.288
68 HD2 PHE 13 HD1 PHE 13 -7.467 -2.427 -8.066
69 HE1 PHE 13 HE2 PHE 13 -10.774 -4.396 -5.002
70 HE2 PHE 13 HE1 PHE 13 -9.805 -2.687 -8.786
71 HZ PHE 13 HZ PHE 13 -11.462 -3.674 -7.254
72 H GLU 14 H GLU 14 -3.639 -5.188 -6.681
73 HA GLU 14 HA GLU 14 -1.712 -4.345 -4.651
74 HB2 GLU 14 1HB GLU 14 -1.540 -6.632 -5.558
75 HB3 GLU 14 2HB GLU 14 -1.303 -5.969 -7.169
76 HG2 GLU 14 1HG GLU 14 0.695 -4.722 -6.038
77 HG3 GLU 14 2HG GLU 14 0.555 -6.012 -4.845
78 H CYS 15 H CYS 15 -0.027 -2.927 -5.061
79 HA CYS 15 HA CYS 15 -0.579 -0.869 -6.963
80 HB2 CYS 15 1HB CYS 15 0.438 -0.439 -4.736
81 HB3 CYS 15 2HB CYS 15 1.894 -1.274 -5.268
82 H THR 16 H THR 16 0.200 -0.581 -8.956
83 HA THR 16 HA THR 16 1.858 -2.651 -10.114
84 HB THR 16 HB THR 16 0.974 -0.189 -11.589
85 HG1 THR 16 HG1 THR 16 -0.695 -2.443 -11.515
86 HG21 THR 16 3HG2 THR 16 0.636 -2.111 -13.334
87 HG22 THR 16 1HG2 THR 16 1.717 -3.005 -12.266
88 HG23 THR 16 2HG2 THR 16 2.254 -1.495 -13.002
89 H GLU 17 H GLU 17 3.001 -0.762 -8.132
90 HA GLU 17 HA GLU 17 5.208 0.240 -9.802
91 HB2 GLU 17 1HB GLU 17 4.141 1.615 -7.331
92 HB3 GLU 17 2HB GLU 17 5.432 2.187 -8.378
93 HG2 GLU 17 1HG GLU 17 2.607 1.778 -9.315
94 HG3 GLU 17 2HG GLU 17 3.211 3.306 -8.679
95 H CYS 18 H CYS 18 4.343 -0.356 -6.390
96 HA CYS 18 HA CYS 18 7.061 -1.383 -5.956
97 HB2 CYS 18 1HB CYS 18 6.580 -1.071 -3.548
98 HB3 CYS 18 2HB CYS 18 6.429 0.427 -4.461
99 H GLY 19 H GLY 19 3.653 -2.194 -5.665
100 HA2 GLY 19 1HA GLY 19 2.969 -4.480 -6.049
101 HA3 GLY 19 2HA GLY 19 4.450 -5.004 -5.261
102 H LYS 20 H LYS 20 2.595 -2.403 -3.909
103 HA LYS 20 HA LYS 20 2.173 -3.933 -1.495
104 HB2 LYS 20 1HB LYS 20 2.826 -1.445 -1.664
105 HB3 LYS 20 2HB LYS 20 1.126 -1.159 -2.014
106 HG2 LYS 20 1HG LYS 20 0.452 -1.890 0.108
107 HG3 LYS 20 2HG LYS 20 2.009 -2.654 0.432
108 HD2 LYS 20 1HD LYS 20 3.087 -0.552 0.678
109 HD3 LYS 20 2HD LYS 20 1.689 0.314 0.035
110 HE2 LYS 20 1HE LYS 20 1.556 0.645 2.344
111 HE3 LYS 20 2HE LYS 20 0.408 -0.655 2.028
112 HZ1 LYS 20 3HZ LYS 20 3.055 -1.607 2.589
113 HZ2 LYS 20 1HZ LYS 20 1.575 -2.066 3.269
114 HZ3 LYS 20 2HZ LYS 20 2.399 -0.717 3.869
115 H ALA 21 H ALA 21 0.369 -4.961 -0.925
116 HA ALA 21 HA ALA 21 -1.941 -4.822 -2.693
117 HB1 ALA 21 3HB ALA 21 -1.023 -7.013 -2.013
118 HB2 ALA 21 1HB ALA 21 -1.457 -6.647 -0.342
119 HB3 ALA 21 2HB ALA 21 -2.717 -6.809 -1.566
120 H PHE 22 H PHE 22 -3.798 -3.828 -2.214
121 HA PHE 22 HA PHE 22 -4.192 -2.886 0.550
122 HB2 PHE 22 1HB PHE 22 -5.024 -1.465 -1.988
123 HB3 PHE 22 2HB PHE 22 -5.270 -0.884 -0.345
124 HD1 PHE 22 HD2 PHE 22 -2.737 -1.599 -2.922
125 HD2 PHE 22 HD1 PHE 22 -3.540 0.206 0.848
126 HE1 PHE 22 HE2 PHE 22 -0.550 -0.475 -2.998
127 HE2 PHE 22 HE1 PHE 22 -1.354 1.334 0.778
128 HZ PHE 22 HZ PHE 22 0.145 0.993 -1.147
129 H THR 23 H THR 23 -6.234 -3.025 1.418
130 HA THR 23 HA THR 23 -8.018 -4.902 0.114
131 HB THR 23 HB THR 23 -7.499 -5.124 2.530
132 HG1 THR 23 HG1 THR 23 -10.205 -4.640 1.786
133 HG21 THR 23 3HG2 THR 23 -8.026 -3.552 4.111
134 HG22 THR 23 1HG2 THR 23 -9.344 -2.874 3.157
135 HG23 THR 23 2HG2 THR 23 -7.672 -2.489 2.749
136 H ARG 24 H ARG 24 -7.613 -1.710 -0.207
137 HA ARG 24 HA ARG 24 -10.436 -1.295 -0.871
138 HB2 ARG 24 1HB ARG 24 -8.755 0.721 0.630
139 HB3 ARG 24 2HB ARG 24 -10.413 0.949 0.092
140 HG2 ARG 24 1HG ARG 24 -11.246 -0.597 1.653
141 HG3 ARG 24 2HG ARG 24 -9.638 -1.242 1.989
142 HD2 ARG 24 1HD ARG 24 -10.274 1.634 2.527
143 HD3 ARG 24 2HD ARG 24 -10.733 0.384 3.683
144 HE ARG 24 HE ARG 24 -8.044 0.013 3.055
145 HH11 ARG 24 1HH1 ARG 24 -10.072 2.373 4.616
146 HH12 ARG 24 2HH1 ARG 24 -8.823 2.937 5.677
147 HH21 ARG 24 1HH2 ARG 24 -6.391 0.747 4.446
148 HH22 ARG 24 2HH2 ARG 24 -6.730 2.012 5.578
149 H LYS 25 H LYS 25 -10.291 -1.150 -3.026
150 HA LYS 25 HA LYS 25 -8.172 -0.371 -4.580
151 HB2 LYS 25 1HB LYS 25 -10.357 -1.374 -5.353
152 HB3 LYS 25 2HB LYS 25 -11.051 0.239 -5.259
153 HG2 LYS 25 1HG LYS 25 -8.571 -0.122 -6.851
154 HG3 LYS 25 2HG LYS 25 -10.088 -0.736 -7.512
155 HD2 LYS 25 1HD LYS 25 -10.061 2.022 -6.401
156 HD3 LYS 25 2HD LYS 25 -9.272 1.746 -7.956
157 HE2 LYS 25 1HE LYS 25 -11.419 2.263 -8.611
158 HE3 LYS 25 2HE LYS 25 -11.485 0.503 -8.543
159 HZ1 LYS 25 3HZ LYS 25 -12.122 1.613 -6.018
160 HZ2 LYS 25 1HZ LYS 25 -13.059 0.610 -7.008
161 HZ3 LYS 25 2HZ LYS 25 -13.116 2.288 -7.210
162 H SER 26 H SER 26 -10.657 1.684 -3.134
163 HA SER 26 HA SER 26 -9.952 4.093 -4.376
164 HB2 SER 26 1HB SER 26 -12.003 3.526 -2.894
165 HB3 SER 26 2HB SER 26 -10.962 3.978 -1.544
166 HG SER 26 HG SER 26 -10.790 5.831 -3.471
167 H THR 27 H THR 27 -8.840 2.653 -1.332
168 HA THR 27 HA THR 27 -7.186 4.764 -0.512
169 HB THR 27 HB THR 27 -6.833 1.812 0.046
170 HG1 THR 27 HG1 THR 27 -8.430 3.837 1.195
171 HG21 THR 27 3HG2 THR 27 -5.471 2.419 1.879
172 HG22 THR 27 1HG2 THR 27 -5.899 4.123 1.734
173 HG23 THR 27 2HG2 THR 27 -4.873 3.365 0.517
174 H LEU 28 H LEU 28 -6.364 1.781 -2.279
175 HA LEU 28 HA LEU 28 -3.658 2.163 -2.598
176 HB2 LEU 28 1HB LEU 28 -4.426 0.121 -3.344
177 HB3 LEU 28 2HB LEU 28 -5.751 0.838 -4.258
178 HG LEU 28 HG LEU 28 -4.119 1.625 -5.940
179 HD11 LEU 28 1HD1 LEU 28 -1.843 0.672 -5.892
180 HD12 LEU 28 2HD1 LEU 28 -2.160 0.059 -4.269
181 HD13 LEU 28 3HD1 LEU 28 -2.144 1.797 -4.567
182 HD21 LEU 28 3HD2 LEU 28 -3.355 -1.048 -6.232
183 HD22 LEU 28 1HD2 LEU 28 -4.762 -0.251 -6.937
184 HD23 LEU 28 2HD2 LEU 28 -4.905 -1.087 -5.390
185 H SER 29 H SER 29 -6.248 3.305 -4.756
186 HA SER 29 HA SER 29 -4.781 4.515 -6.722
187 HB2 SER 29 1HB SER 29 -7.282 4.368 -6.625
188 HB3 SER 29 2HB SER 29 -7.270 5.716 -5.488
189 HG SER 29 HG SER 29 -7.597 6.343 -7.702
190 H MET 30 H MET 30 -5.204 5.551 -3.431
191 HA MET 30 HA MET 30 -4.136 8.197 -3.904
192 HB2 MET 30 1HB MET 30 -4.753 6.748 -1.323
193 HB3 MET 30 2HB MET 30 -4.292 8.440 -1.449
194 HG2 MET 30 1HG MET 30 -6.367 8.493 -3.093
195 HG3 MET 30 2HG MET 30 -6.854 7.112 -2.113
196 HE1 MET 30 3HE MET 30 -5.940 7.661 0.787
197 HE2 MET 30 1HE MET 30 -7.330 8.553 1.406
198 HE3 MET 30 2HE MET 30 -7.573 7.189 0.314
199 H HIS 31 H HIS 31 -3.001 5.085 -2.777
200 HA HIS 31 HA HIS 31 -0.493 6.046 -1.788
201 HB2 HIS 31 1HB HIS 31 -1.044 4.039 -0.791
202 HB3 HIS 31 2HB HIS 31 -1.714 3.364 -2.274
203 HD1 HIS 31 HD1 HIS 31 1.535 3.878 -0.474
204 HD2 HIS 31 HD2 HIS 31 0.093 1.992 -3.884
205 HE1 HIS 31 HE1 HIS 31 3.420 2.425 -1.287
206 H GLN 32 H GLN 32 -1.603 4.558 -4.797
207 HA GLN 32 HA GLN 32 0.846 4.150 -6.039
208 HB2 GLN 32 1HB GLN 32 -1.838 4.883 -7.209
209 HB3 GLN 32 2HB GLN 32 -0.449 4.428 -8.187
210 HG2 GLN 32 1HG GLN 32 -0.444 2.314 -6.643
211 HG3 GLN 32 2HG GLN 32 -2.130 2.762 -6.386
212 HE21 GLN 32 1HE2 GLN 32 -3.348 3.233 -8.454
213 HE22 GLN 32 2HE2 GLN 32 -3.079 2.148 -9.771
214 H LYS 33 H LYS 33 -0.736 7.083 -5.264
215 HA LYS 33 HA LYS 33 0.357 8.757 -7.267
216 HB2 LYS 33 1HB LYS 33 -0.769 9.263 -4.524
217 HB3 LYS 33 2HB LYS 33 -0.083 10.570 -5.481
218 HG2 LYS 33 1HG LYS 33 -1.694 9.819 -7.321
219 HG3 LYS 33 2HG LYS 33 -2.507 8.903 -6.050
220 HD2 LYS 33 1HD LYS 33 -1.891 11.761 -5.520
221 HD3 LYS 33 2HD LYS 33 -3.194 11.397 -6.654
222 HE2 LYS 33 1HE LYS 33 -3.150 9.927 -4.074
223 HE3 LYS 33 2HE LYS 33 -3.608 11.629 -4.039
224 HZ1 LYS 33 3HZ LYS 33 -5.042 9.351 -5.104
225 HZ2 LYS 33 1HZ LYS 33 -5.075 10.731 -6.083
226 HZ3 LYS 33 2HZ LYS 33 -5.632 10.812 -4.488
227 H ILE 34 H ILE 34 1.756 7.204 -4.593
228 HA ILE 34 HA ILE 34 3.817 9.112 -4.043
229 HB ILE 34 HB ILE 34 4.726 7.550 -2.553
230 HG12 ILE 34 1HG1 ILE 34 3.217 5.382 -4.031
231 HG13 ILE 34 2HG1 ILE 34 4.945 5.692 -4.160
232 HG21 ILE 34 1HG2 ILE 34 2.296 6.316 -1.922
233 HG22 ILE 34 2HG2 ILE 34 2.941 7.816 -1.259
234 HG23 ILE 34 3HG2 ILE 34 1.871 7.860 -2.660
235 HD11 ILE 34 3HD1 ILE 34 4.687 3.857 -2.706
236 HD12 ILE 34 1HD1 ILE 34 5.091 5.241 -1.691
237 HD13 ILE 34 2HD1 ILE 34 3.424 4.671 -1.783
238 H HIS 35 H HIS 35 3.281 6.950 -6.564
239 HA HIS 35 HA HIS 35 6.149 6.799 -7.205
240 HB2 HIS 35 1HB HIS 35 3.886 5.164 -8.367
241 HB3 HIS 35 2HB HIS 35 5.606 4.935 -8.669
242 HD1 HIS 35 HD1 HIS 35 7.025 4.286 -6.413
243 HD2 HIS 35 HD2 HIS 35 2.919 3.661 -6.331
244 HE1 HIS 35 HE1 HIS 35 6.628 2.677 -4.521
245 H THR 36 H THR 36 3.090 8.049 -8.213
246 HA THR 36 HA THR 36 3.694 8.547 -10.932
247 HB THR 36 HB THR 36 1.854 10.286 -10.748
248 HG1 THR 36 HG1 THR 36 2.243 10.530 -8.390
249 HG21 THR 36 3HG2 THR 36 1.735 7.431 -10.598
250 HG22 THR 36 1HG2 THR 36 0.630 8.544 -11.404
251 HG23 THR 36 2HG2 THR 36 0.373 8.115 -9.713
252 H GLY 37 H GLY 37 4.298 10.328 -7.970
253 HA2 GLY 37 1HA GLY 37 5.032 12.779 -9.232
254 HA3 GLY 37 2HA GLY 37 5.376 12.323 -7.570
255 H GLU 38 H GLU 38 7.070 10.405 -7.514
256 HA GLU 38 HA GLU 38 9.540 11.347 -8.033
257 HB2 GLU 38 1HB GLU 38 10.359 9.021 -8.051
258 HB3 GLU 38 2HB GLU 38 9.180 9.300 -6.777
259 HG2 GLU 38 1HG GLU 38 7.520 8.088 -7.882
260 HG3 GLU 38 2HG GLU 38 8.372 8.157 -9.424
261 H LYS 39 H LYS 39 7.330 10.068 -10.368
262 HA LYS 39 HA LYS 39 9.220 9.570 -12.440
263 HB2 LYS 39 1HB LYS 39 7.113 8.466 -12.582
264 HB3 LYS 39 2HB LYS 39 6.232 9.981 -12.441
265 HG2 LYS 39 1HG LYS 39 7.189 10.663 -14.637
266 HG3 LYS 39 2HG LYS 39 7.877 9.044 -14.780
267 HD2 LYS 39 1HD LYS 39 4.949 9.436 -14.264
268 HD3 LYS 39 2HD LYS 39 5.602 9.529 -15.902
269 HE2 LYS 39 1HE LYS 39 6.527 7.281 -15.663
270 HE3 LYS 39 2HE LYS 39 5.900 7.191 -14.017
271 HZ1 LYS 39 3HZ LYS 39 3.682 7.248 -14.828
272 HZ2 LYS 39 1HZ LYS 39 4.505 6.069 -15.720
273 HZ3 LYS 39 2HZ LYS 39 4.187 7.581 -16.407
274 HA PRO 40 HA PRO 40 10.022 13.723 -13.706
275 HB2 PRO 40 1HB PRO 40 11.065 13.173 -16.151
276 HB3 PRO 40 2HB PRO 40 11.948 12.894 -14.646
277 HG2 PRO 40 1HG PRO 40 10.436 10.947 -16.344
278 HG3 PRO 40 2HG PRO 40 12.014 10.756 -15.557
279 HD2 PRO 40 1HD PRO 40 9.736 9.718 -14.525
280 HD3 PRO 40 2HD PRO 40 11.074 10.285 -13.506
281 H SER 41 H SER 41 8.604 11.581 -16.184
282 HA SER 41 HA SER 41 7.408 13.719 -17.635
283 HB2 SER 41 1HB SER 41 8.012 11.465 -18.589
284 HB3 SER 41 2HB SER 41 6.628 10.798 -17.723
285 HG SER 41 HG SER 41 5.829 11.296 -19.681
286 H GLY 42 H GLY 42 5.071 13.969 -17.980
287 HA2 GLY 42 1HA GLY 42 3.471 13.223 -15.618
288 HA3 GLY 42 2HA GLY 42 3.509 14.890 -16.172
289 HA PRO 43 HA PRO 43 0.280 12.154 -18.428
290 HB2 PRO 43 1HB PRO 43 -1.922 12.697 -16.935
291 HB3 PRO 43 2HB PRO 43 -0.863 11.317 -16.618
292 HG2 PRO 43 1HG PRO 43 -0.947 13.988 -15.270
293 HG3 PRO 43 2HG PRO 43 -0.777 12.377 -14.550
294 HD2 PRO 43 1HD PRO 43 1.333 14.029 -14.939
295 HD3 PRO 43 2HD PRO 43 1.474 12.262 -15.032
296 H SER 44 H SER 44 -1.839 13.026 -19.353
297 HA SER 44 HA SER 44 -1.362 15.746 -20.218
298 HB2 SER 44 1HB SER 44 -2.094 13.800 -21.722
299 HB3 SER 44 2HB SER 44 -3.699 14.017 -21.023
300 HG SER 44 HG SER 44 -3.963 15.640 -22.313
301 H SER 45 H SER 45 -1.917 15.832 -17.575
302 HA SER 45 HA SER 45 -4.463 17.257 -17.546
303 HB2 SER 45 1HB SER 45 -4.946 16.172 -15.267
304 HB3 SER 45 2HB SER 45 -5.233 15.190 -16.703
305 HG SER 45 HG SER 45 -3.055 14.349 -16.333
306 H GLY 46 H GLY 46 -4.642 18.814 -15.864
307 HA2 GLY 46 1HA GLY 46 -2.303 19.250 -14.173
308 HA3 GLY 46 2HA GLY 46 -2.657 20.497 -15.360
Start of MODEL 15
1 H1 GLY 1 H GLY 1 10.337 -26.836 -6.113
2 HA2 GLY 1 1HA GLY 1 9.259 -27.692 -3.527
3 HA3 GLY 1 2HA GLY 1 10.375 -26.361 -3.794
4 H SER 2 H SER 2 7.094 -27.278 -4.858
5 HA SER 2 HA SER 2 6.240 -24.536 -4.193
6 HB2 SER 2 1HB SER 2 6.305 -25.023 -6.656
7 HB3 SER 2 2HB SER 2 5.085 -26.268 -6.389
8 HG SER 2 HG SER 2 3.838 -24.583 -6.797
9 H SER 3 H SER 3 4.033 -24.293 -3.501
10 HA SER 3 HA SER 3 2.964 -26.740 -2.253
11 HB2 SER 3 1HB SER 3 2.042 -25.291 -0.486
12 HB3 SER 3 2HB SER 3 3.795 -25.131 -0.596
13 HG SER 3 HG SER 3 1.865 -23.358 -1.690
14 H GLY 4 H GLY 4 0.778 -27.155 -2.371
15 HA2 GLY 4 1HA GLY 4 -0.611 -25.831 -4.546
16 HA3 GLY 4 2HA GLY 4 -1.152 -27.259 -3.675
17 H SER 5 H SER 5 -2.491 -27.045 -1.924
18 HA SER 5 HA SER 5 -4.058 -26.094 -0.577
19 HB2 SER 5 1HB SER 5 -1.995 -23.899 -0.662
20 HB3 SER 5 2HB SER 5 -3.489 -23.724 0.258
21 HG SER 5 HG SER 5 -2.386 -24.717 1.751
22 H SER 6 H SER 6 -4.614 -26.070 -3.288
23 HA SER 6 HA SER 6 -5.354 -23.601 -4.371
24 HB2 SER 6 1HB SER 6 -6.846 -24.909 -5.850
25 HB3 SER 6 2HB SER 6 -5.243 -25.632 -5.725
26 HG SER 6 HG SER 6 -6.178 -27.360 -5.015
27 H GLY 7 H GLY 7 -7.029 -22.259 -4.059
28 HA2 GLY 7 1HA GLY 7 -9.524 -22.262 -3.599
29 HA3 GLY 7 2HA GLY 7 -9.089 -23.115 -2.126
30 H THR 8 H THR 8 -7.617 -20.304 -3.731
31 HA THR 8 HA THR 8 -8.536 -18.505 -1.676
32 HB THR 8 HB THR 8 -6.650 -19.523 -0.504
33 HG1 THR 8 HG1 THR 8 -5.352 -17.469 -0.377
34 HG21 THR 8 3HG2 THR 8 -4.562 -18.415 -2.216
35 HG22 THR 8 1HG2 THR 8 -5.477 -19.710 -2.985
36 HG23 THR 8 2HG2 THR 8 -4.669 -19.996 -1.444
37 H GLY 9 H GLY 9 -8.332 -16.347 -2.247
38 HA2 GLY 9 1HA GLY 9 -6.647 -15.390 -4.309
39 HA3 GLY 9 2HA GLY 9 -8.245 -15.719 -4.961
40 H GLY 10 H GLY 10 -10.087 -14.647 -3.884
41 HA2 GLY 10 1HA GLY 10 -11.120 -12.827 -2.907
42 HA3 GLY 10 2HA GLY 10 -9.584 -12.408 -2.163
43 H LYS 11 H LYS 11 -10.929 -10.312 -2.919
44 HA LYS 11 HA LYS 11 -9.901 -9.552 -5.572
45 HB2 LYS 11 1HB LYS 11 -12.215 -8.431 -3.984
46 HB3 LYS 11 2HB LYS 11 -11.628 -7.747 -5.494
47 HG2 LYS 11 1HG LYS 11 -12.527 -10.601 -5.301
48 HG3 LYS 11 2HG LYS 11 -13.660 -9.279 -5.595
49 HD2 LYS 11 1HD LYS 11 -11.214 -9.456 -7.285
50 HD3 LYS 11 2HD LYS 11 -12.528 -10.595 -7.586
51 HE2 LYS 11 1HE LYS 11 -12.933 -7.616 -7.423
52 HE3 LYS 11 2HE LYS 11 -12.583 -8.459 -8.932
53 HZ1 LYS 11 3HZ LYS 11 -15.033 -8.012 -8.151
54 HZ2 LYS 11 1HZ LYS 11 -14.793 -9.447 -7.287
55 HZ3 LYS 11 2HZ LYS 11 -14.623 -9.433 -8.970
56 H HIS 12 H HIS 12 -7.813 -9.121 -4.622
57 HA HIS 12 HA HIS 12 -7.740 -6.657 -3.011
58 HB2 HIS 12 1HB HIS 12 -6.647 -8.952 -2.262
59 HB3 HIS 12 2HB HIS 12 -5.338 -8.407 -3.307
60 HD1 HIS 12 HD1 HIS 12 -6.234 -8.352 0.087
61 HD2 HIS 12 HD2 HIS 12 -4.694 -5.502 -2.514
62 HE1 HIS 12 HE1 HIS 12 -5.184 -6.601 1.554
63 H PHE 13 H PHE 13 -6.571 -4.918 -3.695
64 HA PHE 13 HA PHE 13 -5.600 -5.039 -6.459
65 HB2 PHE 13 1HB PHE 13 -6.266 -2.637 -4.744
66 HB3 PHE 13 2HB PHE 13 -5.791 -2.588 -6.438
67 HD1 PHE 13 HD2 PHE 13 -8.410 -3.834 -4.132
68 HD2 PHE 13 HD1 PHE 13 -7.379 -2.813 -8.133
69 HE1 PHE 13 HE2 PHE 13 -10.768 -4.062 -4.794
70 HE2 PHE 13 HE1 PHE 13 -9.736 -3.038 -8.802
71 HZ PHE 13 HZ PHE 13 -11.434 -3.664 -7.132
72 H GLU 14 H GLU 14 -3.490 -5.276 -6.735
73 HA GLU 14 HA GLU 14 -1.659 -4.381 -4.629
74 HB2 GLU 14 1HB GLU 14 -1.633 -6.762 -5.590
75 HB3 GLU 14 2HB GLU 14 -0.916 -6.044 -7.026
76 HG2 GLU 14 1HG GLU 14 1.043 -5.495 -5.939
77 HG3 GLU 14 2HG GLU 14 0.292 -5.537 -4.345
78 H CYS 15 H CYS 15 0.017 -2.969 -5.011
79 HA CYS 15 HA CYS 15 -0.369 -1.092 -7.134
80 HB2 CYS 15 1HB CYS 15 0.447 -0.539 -4.804
81 HB3 CYS 15 2HB CYS 15 1.991 -1.254 -5.256
82 H THR 16 H THR 16 0.289 -1.407 -9.145
83 HA THR 16 HA THR 16 2.160 -3.400 -9.896
84 HB THR 16 HB THR 16 2.023 -2.357 -12.168
85 HG1 THR 16 HG1 THR 16 1.478 -0.201 -11.047
86 HG21 THR 16 3HG2 THR 16 -0.703 -2.525 -12.028
87 HG22 THR 16 1HG2 THR 16 -0.208 -3.420 -10.592
88 HG23 THR 16 2HG2 THR 16 0.388 -3.901 -12.181
89 H GLU 17 H GLU 17 2.679 -0.476 -8.465
90 HA GLU 17 HA GLU 17 5.108 0.191 -9.924
91 HB2 GLU 17 1HB GLU 17 3.881 1.496 -7.488
92 HB3 GLU 17 2HB GLU 17 5.239 2.119 -8.414
93 HG2 GLU 17 1HG GLU 17 3.573 3.353 -9.327
94 HG3 GLU 17 2HG GLU 17 3.510 1.955 -10.399
95 H CYS 18 H CYS 18 4.297 -0.369 -6.493
96 HA CYS 18 HA CYS 18 7.046 -1.308 -6.070
97 HB2 CYS 18 1HB CYS 18 6.593 -0.959 -3.670
98 HB3 CYS 18 2HB CYS 18 6.347 0.512 -4.606
99 H GLY 19 H GLY 19 3.666 -2.171 -5.415
100 HA2 GLY 19 1HA GLY 19 3.099 -4.538 -5.884
101 HA3 GLY 19 2HA GLY 19 4.571 -4.957 -5.021
102 H LYS 20 H LYS 20 2.684 -2.352 -3.791
103 HA LYS 20 HA LYS 20 2.174 -3.820 -1.362
104 HB2 LYS 20 1HB LYS 20 2.783 -1.281 -1.700
105 HB3 LYS 20 2HB LYS 20 1.044 -1.100 -1.890
106 HG2 LYS 20 1HG LYS 20 0.617 -1.816 0.298
107 HG3 LYS 20 2HG LYS 20 2.237 -2.491 0.484
108 HD2 LYS 20 1HD LYS 20 3.211 -0.408 0.768
109 HD3 LYS 20 2HD LYS 20 1.882 0.434 -0.031
110 HE2 LYS 20 1HE LYS 20 1.418 0.968 2.137
111 HE3 LYS 20 2HE LYS 20 0.513 -0.539 2.010
112 HZ1 LYS 20 3HZ LYS 20 3.277 -0.320 3.073
113 HZ2 LYS 20 1HZ LYS 20 2.315 -1.711 3.046
114 HZ3 LYS 20 2HZ LYS 20 1.884 -0.404 4.029
115 H ALA 21 H ALA 21 0.335 -4.786 -0.772
116 HA ALA 21 HA ALA 21 -1.915 -4.720 -2.627
117 HB1 ALA 21 3HB ALA 21 -0.986 -6.883 -1.817
118 HB2 ALA 21 1HB ALA 21 -1.550 -6.466 -0.199
119 HB3 ALA 21 2HB ALA 21 -2.710 -6.683 -1.509
120 H PHE 22 H PHE 22 -3.809 -3.753 -2.219
121 HA PHE 22 HA PHE 22 -4.284 -2.732 0.503
122 HB2 PHE 22 1HB PHE 22 -4.976 -1.345 -2.096
123 HB3 PHE 22 2HB PHE 22 -5.322 -0.739 -0.479
124 HD1 PHE 22 HD2 PHE 22 -2.721 -1.326 -2.981
125 HD2 PHE 22 HD1 PHE 22 -3.581 0.195 0.900
126 HE1 PHE 22 HE2 PHE 22 -0.530 -0.207 -2.937
127 HE2 PHE 22 HE1 PHE 22 -1.392 1.318 0.949
128 HZ PHE 22 HZ PHE 22 0.137 1.116 -0.970
129 H THR 23 H THR 23 -6.292 -3.000 1.340
130 HA THR 23 HA THR 23 -8.077 -4.787 -0.075
131 HB THR 23 HB THR 23 -7.631 -5.171 2.308
132 HG1 THR 23 HG1 THR 23 -9.616 -5.914 1.630
133 HG21 THR 23 3HG2 THR 23 -7.580 -3.489 3.765
134 HG22 THR 23 1HG2 THR 23 -9.294 -3.187 3.486
135 HG23 THR 23 2HG2 THR 23 -8.083 -2.371 2.497
136 H ARG 24 H ARG 24 -7.655 -1.560 -0.177
137 HA ARG 24 HA ARG 24 -10.501 -1.085 -0.755
138 HB2 ARG 24 1HB ARG 24 -8.637 0.483 0.952
139 HB3 ARG 24 2HB ARG 24 -9.766 1.383 -0.051
140 HG2 ARG 24 1HG ARG 24 -11.632 0.171 0.968
141 HG3 ARG 24 2HG ARG 24 -10.492 -0.715 1.983
142 HD2 ARG 24 1HD ARG 24 -9.717 1.495 2.877
143 HD3 ARG 24 2HD ARG 24 -11.049 2.245 2.001
144 HE ARG 24 HE ARG 24 -12.086 0.189 3.587
145 HH11 ARG 24 1HH1 ARG 24 -10.559 3.298 3.942
146 HH12 ARG 24 2HH1 ARG 24 -11.342 3.656 5.445
147 HH21 ARG 24 1HH2 ARG 24 -13.124 0.650 5.566
148 HH22 ARG 24 2HH2 ARG 24 -12.800 2.149 6.368
149 H LYS 25 H LYS 25 -10.833 -0.479 -2.783
150 HA LYS 25 HA LYS 25 -8.791 -0.105 -4.655
151 HB2 LYS 25 1HB LYS 25 -11.014 -0.800 -5.328
152 HB3 LYS 25 2HB LYS 25 -11.697 0.719 -4.763
153 HG2 LYS 25 1HG LYS 25 -10.109 1.812 -6.475
154 HG3 LYS 25 2HG LYS 25 -10.005 0.194 -7.172
155 HD2 LYS 25 1HD LYS 25 -12.698 1.319 -6.573
156 HD3 LYS 25 2HD LYS 25 -11.825 1.922 -7.984
157 HE2 LYS 25 1HE LYS 25 -13.075 0.157 -8.839
158 HE3 LYS 25 2HE LYS 25 -11.489 -0.563 -8.569
159 HZ1 LYS 25 3HZ LYS 25 -12.253 -1.609 -6.606
160 HZ2 LYS 25 1HZ LYS 25 -13.423 -1.913 -7.791
161 HZ3 LYS 25 2HZ LYS 25 -13.704 -0.739 -6.607
162 H SER 26 H SER 26 -10.673 2.224 -2.793
163 HA SER 26 HA SER 26 -9.638 4.523 -4.128
164 HB2 SER 26 1HB SER 26 -10.987 4.255 -1.430
165 HB3 SER 26 2HB SER 26 -10.654 5.783 -2.246
166 HG SER 26 HG SER 26 -11.906 4.672 -4.052
167 H THR 27 H THR 27 -8.822 2.808 -1.148
168 HA THR 27 HA THR 27 -6.950 4.592 -0.111
169 HB THR 27 HB THR 27 -6.978 1.575 0.087
170 HG1 THR 27 HG1 THR 27 -7.876 2.211 2.226
171 HG21 THR 27 3HG2 THR 27 -5.191 1.648 1.436
172 HG22 THR 27 1HG2 THR 27 -5.794 3.065 2.293
173 HG23 THR 27 2HG2 THR 27 -4.905 3.261 0.783
174 H LEU 28 H LEU 28 -6.485 1.878 -2.355
175 HA LEU 28 HA LEU 28 -3.690 2.135 -2.590
176 HB2 LEU 28 1HB LEU 28 -4.448 0.114 -3.360
177 HB3 LEU 28 2HB LEU 28 -5.845 0.824 -4.166
178 HG LEU 28 HG LEU 28 -4.332 1.677 -5.936
179 HD11 LEU 28 1HD1 LEU 28 -2.061 0.894 -6.078
180 HD12 LEU 28 2HD1 LEU 28 -2.243 -0.024 -4.584
181 HD13 LEU 28 3HD1 LEU 28 -2.286 1.739 -4.546
182 HD21 LEU 28 3HD2 LEU 28 -4.973 -1.105 -5.372
183 HD22 LEU 28 1HD2 LEU 28 -3.595 -0.923 -6.457
184 HD23 LEU 28 2HD2 LEU 28 -5.142 -0.182 -6.866
185 H SER 29 H SER 29 -6.343 3.409 -4.579
186 HA SER 29 HA SER 29 -4.928 4.595 -6.611
187 HB2 SER 29 1HB SER 29 -7.431 5.528 -5.200
188 HB3 SER 29 2HB SER 29 -6.806 6.305 -6.654
189 HG SER 29 HG SER 29 -7.922 3.754 -6.330
190 H MET 30 H MET 30 -5.330 5.695 -3.307
191 HA MET 30 HA MET 30 -4.145 8.273 -3.788
192 HB2 MET 30 1HB MET 30 -4.919 6.782 -1.286
193 HB3 MET 30 2HB MET 30 -4.113 8.344 -1.236
194 HG2 MET 30 1HG MET 30 -5.997 9.227 -2.659
195 HG3 MET 30 2HG MET 30 -6.822 7.699 -2.356
196 HE1 MET 30 3HE MET 30 -6.105 7.087 0.787
197 HE2 MET 30 1HE MET 30 -7.631 7.749 1.373
198 HE3 MET 30 2HE MET 30 -7.585 6.849 -0.144
199 H HIS 31 H HIS 31 -3.058 5.114 -2.787
200 HA HIS 31 HA HIS 31 -0.509 5.975 -1.811
201 HB2 HIS 31 1HB HIS 31 -1.053 3.938 -0.891
202 HB3 HIS 31 2HB HIS 31 -1.818 3.355 -2.367
203 HD1 HIS 31 HD1 HIS 31 1.537 3.691 -0.720
204 HD2 HIS 31 HD2 HIS 31 -0.146 1.987 -4.115
205 HE1 HIS 31 HE1 HIS 31 3.326 2.212 -1.687
206 H GLN 32 H GLN 32 -1.699 4.613 -4.853
207 HA GLN 32 HA GLN 32 0.721 4.235 -6.159
208 HB2 GLN 32 1HB GLN 32 -1.897 5.140 -7.370
209 HB3 GLN 32 2HB GLN 32 -0.552 4.426 -8.249
210 HG2 GLN 32 1HG GLN 32 -0.828 2.388 -6.808
211 HG3 GLN 32 2HG GLN 32 -2.322 3.110 -6.210
212 HE21 GLN 32 1HE2 GLN 32 -1.515 0.732 -7.998
213 HE22 GLN 32 2HE2 GLN 32 -2.618 0.847 -9.322
214 H LYS 33 H LYS 33 -0.782 7.144 -5.206
215 HA LYS 33 HA LYS 33 0.274 8.884 -7.184
216 HB2 LYS 33 1HB LYS 33 -0.741 9.340 -4.382
217 HB3 LYS 33 2HB LYS 33 -0.155 10.653 -5.396
218 HG2 LYS 33 1HG LYS 33 -1.886 9.619 -7.107
219 HG3 LYS 33 2HG LYS 33 -2.633 9.039 -5.617
220 HD2 LYS 33 1HD LYS 33 -1.800 11.895 -5.786
221 HD3 LYS 33 2HD LYS 33 -3.263 11.386 -6.633
222 HE2 LYS 33 1HE LYS 33 -3.883 10.280 -4.371
223 HE3 LYS 33 2HE LYS 33 -2.666 11.365 -3.698
224 HZ1 LYS 33 3HZ LYS 33 -3.901 13.218 -4.774
225 HZ2 LYS 33 1HZ LYS 33 -4.764 12.434 -3.548
226 HZ3 LYS 33 2HZ LYS 33 -5.128 12.122 -5.170
227 H ILE 34 H ILE 34 1.737 7.172 -4.675
228 HA ILE 34 HA ILE 34 3.822 9.062 -4.080
229 HB ILE 34 HB ILE 34 4.738 7.446 -2.646
230 HG12 ILE 34 1HG1 ILE 34 3.132 5.356 -4.133
231 HG13 ILE 34 2HG1 ILE 34 4.868 5.608 -4.274
232 HG21 ILE 34 1HG2 ILE 34 2.512 6.314 -1.702
233 HG22 ILE 34 2HG2 ILE 34 2.887 8.021 -1.474
234 HG23 ILE 34 3HG2 ILE 34 1.784 7.526 -2.757
235 HD11 ILE 34 3HD1 ILE 34 3.310 4.504 -1.974
236 HD12 ILE 34 1HD1 ILE 34 4.671 3.794 -2.842
237 HD13 ILE 34 2HD1 ILE 34 4.933 5.157 -1.753
238 H HIS 35 H HIS 35 3.201 6.944 -6.624
239 HA HIS 35 HA HIS 35 6.053 6.790 -7.335
240 HB2 HIS 35 1HB HIS 35 3.785 5.150 -8.477
241 HB3 HIS 35 2HB HIS 35 5.508 4.908 -8.748
242 HD1 HIS 35 HD1 HIS 35 6.882 4.298 -6.441
243 HD2 HIS 35 HD2 HIS 35 2.779 3.641 -6.468
244 HE1 HIS 35 HE1 HIS 35 6.444 2.701 -4.549
245 H THR 36 H THR 36 3.038 8.170 -8.166
246 HA THR 36 HA THR 36 3.617 8.660 -10.933
247 HB THR 36 HB THR 36 1.651 10.198 -10.827
248 HG1 THR 36 HG1 THR 36 0.532 10.383 -8.902
249 HG21 THR 36 3HG2 THR 36 1.357 7.393 -9.765
250 HG22 THR 36 1HG2 THR 36 1.213 7.938 -11.435
251 HG23 THR 36 2HG2 THR 36 -0.013 8.390 -10.251
252 H GLY 37 H GLY 37 4.244 10.275 -7.925
253 HA2 GLY 37 1HA GLY 37 4.834 12.826 -9.161
254 HA3 GLY 37 2HA GLY 37 5.044 12.412 -7.466
255 H GLU 38 H GLU 38 6.397 11.483 -10.634
256 HA GLU 38 HA GLU 38 9.072 12.008 -9.607
257 HB2 GLU 38 1HB GLU 38 9.956 9.869 -10.052
258 HB3 GLU 38 2HB GLU 38 8.463 9.572 -9.173
259 HG2 GLU 38 1HG GLU 38 7.343 8.837 -11.083
260 HG3 GLU 38 2HG GLU 38 8.542 9.543 -12.166
261 H LYS 39 H LYS 39 10.647 12.302 -11.236
262 HA LYS 39 HA LYS 39 10.125 13.780 -13.377
263 HB2 LYS 39 1HB LYS 39 12.165 11.552 -13.290
264 HB3 LYS 39 2HB LYS 39 12.149 12.832 -14.496
265 HG2 LYS 39 1HG LYS 39 12.165 14.372 -12.354
266 HG3 LYS 39 2HG LYS 39 12.887 12.937 -11.624
267 HD2 LYS 39 1HD LYS 39 14.524 12.927 -13.544
268 HD3 LYS 39 2HD LYS 39 13.892 14.516 -13.984
269 HE2 LYS 39 1HE LYS 39 14.504 15.359 -11.762
270 HE3 LYS 39 2HE LYS 39 15.155 13.774 -11.345
271 HZ1 LYS 39 3HZ LYS 39 16.700 14.040 -13.257
272 HZ2 LYS 39 1HZ LYS 39 16.951 15.155 -12.009
273 HZ3 LYS 39 2HZ LYS 39 16.161 15.634 -13.425
274 HA PRO 40 HA PRO 40 7.431 10.903 -15.644
275 HB2 PRO 40 1HB PRO 40 6.137 12.865 -17.002
276 HB3 PRO 40 2HB PRO 40 5.708 12.395 -15.353
277 HG2 PRO 40 1HG PRO 40 7.370 14.700 -16.294
278 HG3 PRO 40 2HG PRO 40 6.124 14.660 -15.033
279 HD2 PRO 40 1HD PRO 40 8.770 14.593 -14.467
280 HD3 PRO 40 2HD PRO 40 7.559 13.768 -13.466
281 H SER 41 H SER 41 7.517 10.169 -17.746
282 HA SER 41 HA SER 41 9.718 11.211 -19.349
283 HB2 SER 41 1HB SER 41 8.046 8.718 -19.745
284 HB3 SER 41 2HB SER 41 9.508 9.139 -20.636
285 HG SER 41 HG SER 41 10.608 9.087 -18.583
286 H GLY 42 H GLY 42 8.873 13.073 -20.266
287 HA2 GLY 42 1HA GLY 42 7.275 12.668 -22.615
288 HA3 GLY 42 2HA GLY 42 6.405 13.531 -21.355
289 HA PRO 43 HA PRO 43 9.096 16.404 -23.997
290 HB2 PRO 43 1HB PRO 43 7.083 17.689 -25.288
291 HB3 PRO 43 2HB PRO 43 7.858 16.233 -25.925
292 HG2 PRO 43 1HG PRO 43 5.271 16.509 -24.444
293 HG3 PRO 43 2HG PRO 43 5.644 15.523 -25.870
294 HD2 PRO 43 1HD PRO 43 5.528 14.485 -23.372
295 HD3 PRO 43 2HD PRO 43 6.627 13.857 -24.617
296 H SER 44 H SER 44 6.011 16.872 -22.329
297 HA SER 44 HA SER 44 7.129 19.288 -21.085
298 HB2 SER 44 1HB SER 44 5.005 20.450 -21.291
299 HB3 SER 44 2HB SER 44 5.542 19.940 -22.891
300 HG SER 44 HG SER 44 3.303 19.500 -22.458
301 H SER 45 H SER 45 5.595 19.973 -19.198
302 HA SER 45 HA SER 45 5.147 17.556 -17.598
303 HB2 SER 45 1HB SER 45 5.823 20.398 -16.924
304 HB3 SER 45 2HB SER 45 5.039 19.381 -15.716
305 HG SER 45 HG SER 45 6.846 18.346 -15.441
306 H GLY 46 H GLY 46 3.088 17.039 -18.437
307 HA2 GLY 46 1HA GLY 46 0.955 18.929 -17.652
308 HA3 GLY 46 2HA GLY 46 0.836 17.850 -19.034
Start of MODEL 16
1 H1 GLY 1 H GLY 1 5.541 -29.219 -7.675
2 HA2 GLY 1 1HA GLY 1 4.700 -26.800 -7.101
3 HA3 GLY 1 2HA GLY 1 3.650 -27.864 -8.025
4 H SER 2 H SER 2 1.707 -27.129 -7.282
5 HA SER 2 HA SER 2 1.189 -27.532 -4.409
6 HB2 SER 2 1HB SER 2 1.163 -25.119 -5.161
7 HB3 SER 2 2HB SER 2 -0.229 -25.521 -6.166
8 HG SER 2 HG SER 2 -1.364 -26.076 -4.303
9 H SER 3 H SER 3 -1.025 -28.124 -3.869
10 HA SER 3 HA SER 3 -2.109 -29.962 -5.860
11 HB2 SER 3 1HB SER 3 -3.283 -31.011 -4.047
12 HB3 SER 3 2HB SER 3 -1.636 -30.702 -3.496
13 HG SER 3 HG SER 3 -3.936 -29.140 -2.922
14 H GLY 4 H GLY 4 -3.156 -27.268 -3.802
15 HA2 GLY 4 1HA GLY 4 -5.494 -26.961 -5.584
16 HA3 GLY 4 2HA GLY 4 -5.604 -26.719 -3.847
17 H SER 5 H SER 5 -4.379 -25.424 -6.858
18 HA SER 5 HA SER 5 -3.531 -22.962 -5.535
19 HB2 SER 5 1HB SER 5 -3.216 -24.004 -8.349
20 HB3 SER 5 2HB SER 5 -2.803 -22.348 -7.907
21 HG SER 5 HG SER 5 -1.036 -23.892 -7.806
22 H SER 6 H SER 6 -6.262 -23.424 -5.392
23 HA SER 6 HA SER 6 -7.268 -21.203 -7.022
24 HB2 SER 6 1HB SER 6 -8.735 -23.821 -6.618
25 HB3 SER 6 2HB SER 6 -9.364 -22.406 -7.461
26 HG SER 6 HG SER 6 -8.358 -24.163 -8.761
27 H GLY 7 H GLY 7 -8.481 -19.777 -5.918
28 HA2 GLY 7 1HA GLY 7 -9.933 -20.535 -3.540
29 HA3 GLY 7 2HA GLY 7 -8.520 -19.541 -3.217
30 H THR 8 H THR 8 -11.269 -18.871 -2.701
31 HA THR 8 HA THR 8 -11.465 -16.469 -4.390
32 HB THR 8 HB THR 8 -13.207 -18.014 -5.122
33 HG1 THR 8 HG1 THR 8 -13.564 -15.559 -4.421
34 HG21 THR 8 3HG2 THR 8 -13.309 -18.813 -2.488
35 HG22 THR 8 1HG2 THR 8 -14.456 -19.268 -3.746
36 HG23 THR 8 2HG2 THR 8 -14.807 -17.904 -2.685
37 H GLY 9 H GLY 9 -11.175 -14.733 -3.161
38 HA2 GLY 9 1HA GLY 9 -12.660 -14.440 -0.688
39 HA3 GLY 9 2HA GLY 9 -10.914 -14.498 -0.494
40 H GLY 10 H GLY 10 -13.552 -12.736 -2.056
41 HA2 GLY 10 1HA GLY 10 -13.743 -10.535 -2.679
42 HA3 GLY 10 2HA GLY 10 -12.577 -10.206 -1.405
43 H LYS 11 H LYS 11 -12.288 -8.508 -3.292
44 HA LYS 11 HA LYS 11 -10.183 -9.533 -5.082
45 HB2 LYS 11 1HB LYS 11 -12.114 -7.240 -5.440
46 HB3 LYS 11 2HB LYS 11 -10.717 -7.492 -6.479
47 HG2 LYS 11 1HG LYS 11 -12.661 -9.717 -6.087
48 HG3 LYS 11 2HG LYS 11 -13.068 -8.384 -7.171
49 HD2 LYS 11 1HD LYS 11 -10.430 -9.785 -7.401
50 HD3 LYS 11 2HD LYS 11 -11.880 -10.477 -8.133
51 HE2 LYS 11 1HE LYS 11 -12.108 -8.739 -9.637
52 HE3 LYS 11 2HE LYS 11 -11.196 -7.613 -8.632
53 HZ1 LYS 11 3HZ LYS 11 -9.205 -9.039 -9.133
54 HZ2 LYS 11 1HZ LYS 11 -9.818 -8.158 -10.441
55 HZ3 LYS 11 2HZ LYS 11 -10.141 -9.813 -10.310
56 H HIS 12 H HIS 12 -8.187 -8.856 -4.688
57 HA HIS 12 HA HIS 12 -7.824 -6.455 -3.024
58 HB2 HIS 12 1HB HIS 12 -6.951 -8.882 -2.392
59 HB3 HIS 12 2HB HIS 12 -5.613 -8.416 -3.438
60 HD1 HIS 12 HD1 HIS 12 -6.314 -8.517 -0.044
61 HD2 HIS 12 HD2 HIS 12 -4.822 -5.532 -2.520
62 HE1 HIS 12 HE1 HIS 12 -5.117 -6.915 1.481
63 H PHE 13 H PHE 13 -6.695 -4.763 -3.781
64 HA PHE 13 HA PHE 13 -5.678 -4.946 -6.522
65 HB2 PHE 13 1HB PHE 13 -6.250 -2.504 -4.829
66 HB3 PHE 13 2HB PHE 13 -5.772 -2.494 -6.524
67 HD1 PHE 13 HD2 PHE 13 -8.416 -3.819 -4.264
68 HD2 PHE 13 HD1 PHE 13 -7.395 -2.449 -8.162
69 HE1 PHE 13 HE2 PHE 13 -10.782 -3.952 -4.927
70 HE2 PHE 13 HE1 PHE 13 -9.759 -2.578 -8.831
71 HZ PHE 13 HZ PHE 13 -11.456 -3.332 -7.213
72 H GLU 14 H GLU 14 -3.572 -5.125 -6.861
73 HA GLU 14 HA GLU 14 -1.724 -4.380 -4.705
74 HB2 GLU 14 1HB GLU 14 -1.793 -6.732 -5.798
75 HB3 GLU 14 2HB GLU 14 -0.958 -5.962 -7.140
76 HG2 GLU 14 1HG GLU 14 0.929 -5.488 -5.848
77 HG3 GLU 14 2HG GLU 14 0.068 -5.759 -4.334
78 H CYS 15 H CYS 15 0.095 -3.105 -5.102
79 HA CYS 15 HA CYS 15 -0.254 -1.155 -7.202
80 HB2 CYS 15 1HB CYS 15 0.472 -0.642 -4.815
81 HB3 CYS 15 2HB CYS 15 2.041 -1.314 -5.250
82 H THR 16 H THR 16 0.458 -1.543 -9.186
83 HA THR 16 HA THR 16 2.342 -3.535 -9.852
84 HB THR 16 HB THR 16 0.546 -2.519 -11.365
85 HG1 THR 16 HG1 THR 16 3.081 -2.607 -12.621
86 HG21 THR 16 3HG2 THR 16 0.738 -0.430 -12.138
87 HG22 THR 16 1HG2 THR 16 2.435 -0.664 -12.557
88 HG23 THR 16 2HG2 THR 16 1.989 -0.191 -10.918
89 H GLU 17 H GLU 17 2.790 -0.490 -8.526
90 HA GLU 17 HA GLU 17 5.318 0.085 -9.809
91 HB2 GLU 17 1HB GLU 17 4.022 1.393 -7.411
92 HB3 GLU 17 2HB GLU 17 5.413 2.005 -8.293
93 HG2 GLU 17 1HG GLU 17 3.821 3.255 -9.286
94 HG3 GLU 17 2HG GLU 17 3.706 1.833 -10.322
95 H CYS 18 H CYS 18 4.360 -0.471 -6.415
96 HA CYS 18 HA CYS 18 7.074 -1.457 -5.884
97 HB2 CYS 18 1HB CYS 18 6.469 -1.154 -3.487
98 HB3 CYS 18 2HB CYS 18 6.390 0.338 -4.418
99 H GLY 19 H GLY 19 3.658 -2.295 -5.463
100 HA2 GLY 19 1HA GLY 19 3.054 -4.629 -5.934
101 HA3 GLY 19 2HA GLY 19 4.507 -5.097 -5.065
102 H LYS 20 H LYS 20 2.570 -2.500 -3.844
103 HA LYS 20 HA LYS 20 2.040 -4.005 -1.434
104 HB2 LYS 20 1HB LYS 20 2.722 -1.540 -1.555
105 HB3 LYS 20 2HB LYS 20 1.066 -1.221 -2.053
106 HG2 LYS 20 1HG LYS 20 0.197 -1.758 0.008
107 HG3 LYS 20 2HG LYS 20 1.573 -2.775 0.441
108 HD2 LYS 20 1HD LYS 20 2.956 -0.648 0.466
109 HD3 LYS 20 2HD LYS 20 1.427 0.231 0.378
110 HE2 LYS 20 1HE LYS 20 1.930 0.134 2.666
111 HE3 LYS 20 2HE LYS 20 0.724 -1.128 2.418
112 HZ1 LYS 20 3HZ LYS 20 2.152 -2.526 3.345
113 HZ2 LYS 20 1HZ LYS 20 3.379 -1.361 3.382
114 HZ3 LYS 20 2HZ LYS 20 3.173 -2.330 2.011
115 H ALA 21 H ALA 21 0.204 -5.012 -0.929
116 HA ALA 21 HA ALA 21 -2.050 -4.803 -2.780
117 HB1 ALA 21 3HB ALA 21 -1.595 -6.790 -0.558
118 HB2 ALA 21 1HB ALA 21 -2.846 -6.863 -1.799
119 HB3 ALA 21 2HB ALA 21 -1.148 -7.036 -2.246
120 H PHE 22 H PHE 22 -3.700 -3.525 -2.304
121 HA PHE 22 HA PHE 22 -4.212 -2.873 0.520
122 HB2 PHE 22 1HB PHE 22 -5.045 -1.314 -1.934
123 HB3 PHE 22 2HB PHE 22 -5.244 -0.813 -0.258
124 HD1 PHE 22 HD2 PHE 22 -2.749 -1.502 -2.891
125 HD2 PHE 22 HD1 PHE 22 -3.503 0.254 0.912
126 HE1 PHE 22 HE2 PHE 22 -0.545 -0.411 -2.962
127 HE2 PHE 22 HE1 PHE 22 -1.301 1.349 0.847
128 HZ PHE 22 HZ PHE 22 0.182 1.016 -1.091
129 H THR 23 H THR 23 -6.278 -3.007 1.352
130 HA THR 23 HA THR 23 -8.053 -4.825 -0.048
131 HB THR 23 HB THR 23 -8.784 -3.642 2.592
132 HG1 THR 23 HG1 THR 23 -6.408 -4.821 2.105
133 HG21 THR 23 3HG2 THR 23 -9.318 -6.144 2.937
134 HG22 THR 23 1HG2 THR 23 -9.091 -6.280 1.194
135 HG23 THR 23 2HG2 THR 23 -10.339 -5.214 1.840
136 H ARG 24 H ARG 24 -7.640 -1.557 -0.035
137 HA ARG 24 HA ARG 24 -10.469 -1.104 -0.712
138 HB2 ARG 24 1HB ARG 24 -8.627 0.761 0.793
139 HB3 ARG 24 2HB ARG 24 -10.214 1.209 0.184
140 HG2 ARG 24 1HG ARG 24 -10.764 0.697 2.325
141 HG3 ARG 24 2HG ARG 24 -10.958 -0.897 1.592
142 HD2 ARG 24 1HD ARG 24 -8.708 -1.510 2.310
143 HD3 ARG 24 2HD ARG 24 -8.488 0.092 3.014
144 HE ARG 24 HE ARG 24 -9.940 -2.114 4.145
145 HH11 ARG 24 1HH1 ARG 24 -9.589 1.350 4.085
146 HH12 ARG 24 2HH1 ARG 24 -10.265 1.576 5.664
147 HH21 ARG 24 1HH2 ARG 24 -10.832 -1.828 6.225
148 HH22 ARG 24 2HH2 ARG 24 -10.971 -0.232 6.881
149 H LYS 25 H LYS 25 -10.646 -0.639 -2.793
150 HA LYS 25 HA LYS 25 -8.574 -0.118 -4.549
151 HB2 LYS 25 1HB LYS 25 -10.922 -0.808 -5.138
152 HB3 LYS 25 2HB LYS 25 -11.411 0.863 -4.888
153 HG2 LYS 25 1HG LYS 25 -9.448 1.304 -6.610
154 HG3 LYS 25 2HG LYS 25 -9.839 -0.350 -7.087
155 HD2 LYS 25 1HD LYS 25 -12.187 0.306 -7.387
156 HD3 LYS 25 2HD LYS 25 -11.774 1.963 -6.938
157 HE2 LYS 25 1HE LYS 25 -10.556 0.483 -9.265
158 HE3 LYS 25 2HE LYS 25 -11.942 1.564 -9.399
159 HZ1 LYS 25 3HZ LYS 25 -9.379 2.459 -8.226
160 HZ2 LYS 25 1HZ LYS 25 -10.648 3.404 -8.825
161 HZ3 LYS 25 2HZ LYS 25 -9.668 2.531 -9.891
162 H SER 26 H SER 26 -10.567 2.142 -2.720
163 HA SER 26 HA SER 26 -9.606 4.497 -3.970
164 HB2 SER 26 1HB SER 26 -11.714 4.260 -2.562
165 HB3 SER 26 2HB SER 26 -10.663 4.315 -1.147
166 HG SER 26 HG SER 26 -9.852 6.343 -2.302
167 H THR 27 H THR 27 -8.714 2.847 -0.954
168 HA THR 27 HA THR 27 -6.811 4.622 -0.012
169 HB THR 27 HB THR 27 -6.797 1.605 0.190
170 HG1 THR 27 HG1 THR 27 -7.755 2.065 2.237
171 HG21 THR 27 3HG2 THR 27 -4.695 3.257 0.777
172 HG22 THR 27 1HG2 THR 27 -4.992 1.690 1.528
173 HG23 THR 27 2HG2 THR 27 -5.536 3.167 2.323
174 H LEU 28 H LEU 28 -6.301 1.823 -2.157
175 HA LEU 28 HA LEU 28 -3.545 2.168 -2.510
176 HB2 LEU 28 1HB LEU 28 -4.360 0.111 -3.191
177 HB3 LEU 28 2HB LEU 28 -5.701 0.826 -4.083
178 HG LEU 28 HG LEU 28 -4.126 1.568 -5.821
179 HD11 LEU 28 1HD1 LEU 28 -1.835 0.846 -5.824
180 HD12 LEU 28 2HD1 LEU 28 -2.060 -0.013 -4.301
181 HD13 LEU 28 3HD1 LEU 28 -2.148 1.747 -4.340
182 HD21 LEU 28 3HD2 LEU 28 -4.686 -1.214 -5.121
183 HD22 LEU 28 1HD2 LEU 28 -3.315 -1.014 -6.213
184 HD23 LEU 28 2HD2 LEU 28 -4.894 -0.363 -6.652
185 H SER 29 H SER 29 -6.238 3.215 -4.596
186 HA SER 29 HA SER 29 -4.858 4.458 -6.604
187 HB2 SER 29 1HB SER 29 -7.431 5.349 -5.285
188 HB3 SER 29 2HB SER 29 -6.832 5.985 -6.817
189 HG SER 29 HG SER 29 -7.387 3.249 -6.300
190 H MET 30 H MET 30 -5.285 5.533 -3.320
191 HA MET 30 HA MET 30 -4.324 8.205 -3.837
192 HB2 MET 30 1HB MET 30 -4.962 6.701 -1.301
193 HB3 MET 30 2HB MET 30 -4.323 8.339 -1.302
194 HG2 MET 30 1HG MET 30 -6.310 8.915 -2.803
195 HG3 MET 30 2HG MET 30 -6.971 7.362 -2.297
196 HE1 MET 30 3HE MET 30 -8.395 7.614 0.834
197 HE2 MET 30 1HE MET 30 -9.276 8.512 -0.403
198 HE3 MET 30 2HE MET 30 -8.371 7.063 -0.842
199 H HIS 31 H HIS 31 -3.017 5.146 -2.782
200 HA HIS 31 HA HIS 31 -0.534 6.211 -1.832
201 HB2 HIS 31 1HB HIS 31 -0.981 4.165 -0.854
202 HB3 HIS 31 2HB HIS 31 -1.632 3.478 -2.339
203 HD1 HIS 31 HD1 HIS 31 1.733 4.513 -0.907
204 HD2 HIS 31 HD2 HIS 31 0.099 1.849 -3.645
205 HE1 HIS 31 HE1 HIS 31 3.650 3.077 -1.675
206 H GLN 32 H GLN 32 -1.587 4.585 -4.804
207 HA GLN 32 HA GLN 32 0.859 4.402 -6.097
208 HB2 GLN 32 1HB GLN 32 -1.824 4.973 -7.368
209 HB3 GLN 32 2HB GLN 32 -0.411 4.315 -8.184
210 HG2 GLN 32 1HG GLN 32 -0.543 2.387 -6.545
211 HG3 GLN 32 2HG GLN 32 -2.133 3.007 -6.106
212 HE21 GLN 32 1HE2 GLN 32 -3.757 3.101 -7.748
213 HE22 GLN 32 2HE2 GLN 32 -3.704 2.009 -9.086
214 H LYS 33 H LYS 33 -0.988 7.181 -5.341
215 HA LYS 33 HA LYS 33 -0.116 8.914 -7.398
216 HB2 LYS 33 1HB LYS 33 -1.150 9.410 -4.610
217 HB3 LYS 33 2HB LYS 33 -0.714 10.721 -5.698
218 HG2 LYS 33 1HG LYS 33 -2.338 9.470 -7.339
219 HG3 LYS 33 2HG LYS 33 -2.994 8.818 -5.835
220 HD2 LYS 33 1HD LYS 33 -2.524 11.754 -6.044
221 HD3 LYS 33 2HD LYS 33 -3.921 11.056 -6.867
222 HE2 LYS 33 1HE LYS 33 -4.849 10.276 -4.854
223 HE3 LYS 33 2HE LYS 33 -3.336 10.490 -3.976
224 HZ1 LYS 33 3HZ LYS 33 -3.779 12.633 -3.587
225 HZ2 LYS 33 1HZ LYS 33 -5.382 12.232 -3.951
226 HZ3 LYS 33 2HZ LYS 33 -4.388 12.911 -5.140
227 H ILE 34 H ILE 34 1.539 7.508 -4.817
228 HA ILE 34 HA ILE 34 3.455 9.654 -4.467
229 HB ILE 34 HB ILE 34 4.424 8.397 -2.765
230 HG12 ILE 34 1HG1 ILE 34 3.152 5.933 -3.978
231 HG13 ILE 34 2HG1 ILE 34 4.856 6.367 -4.068
232 HG21 ILE 34 1HG2 ILE 34 2.640 8.565 -1.460
233 HG22 ILE 34 2HG2 ILE 34 1.599 8.556 -2.882
234 HG23 ILE 34 3HG2 ILE 34 2.022 7.039 -2.089
235 HD11 ILE 34 3HD1 ILE 34 4.709 4.737 -2.399
236 HD12 ILE 34 1HD1 ILE 34 4.855 6.267 -1.534
237 HD13 ILE 34 2HD1 ILE 34 3.282 5.481 -1.678
238 H HIS 35 H HIS 35 3.052 6.909 -6.477
239 HA HIS 35 HA HIS 35 5.865 6.601 -7.079
240 HB2 HIS 35 1HB HIS 35 3.359 5.328 -8.174
241 HB3 HIS 35 2HB HIS 35 4.951 5.014 -8.859
242 HD1 HIS 35 HD1 HIS 35 6.747 4.280 -6.771
243 HD2 HIS 35 HD2 HIS 35 2.698 3.434 -6.382
244 HE1 HIS 35 HE1 HIS 35 6.605 2.445 -5.057
245 H THR 36 H THR 36 3.036 8.119 -8.490
246 HA THR 36 HA THR 36 4.409 8.794 -10.945
247 HB THR 36 HB THR 36 2.004 8.323 -11.007
248 HG1 THR 36 HG1 THR 36 2.184 11.075 -11.567
249 HG21 THR 36 3HG2 THR 36 0.380 9.624 -9.925
250 HG22 THR 36 1HG2 THR 36 1.525 10.915 -9.563
251 HG23 THR 36 2HG2 THR 36 1.623 9.380 -8.698
252 H GLY 37 H GLY 37 3.436 10.398 -7.960
253 HA2 GLY 37 1HA GLY 37 3.950 13.048 -8.697
254 HA3 GLY 37 2HA GLY 37 4.032 12.422 -7.057
255 H GLU 38 H GLU 38 5.786 13.691 -9.644
256 HA GLU 38 HA GLU 38 8.279 12.580 -9.534
257 HB2 GLU 38 1HB GLU 38 9.170 14.806 -10.142
258 HB3 GLU 38 2HB GLU 38 7.749 14.367 -11.079
259 HG2 GLU 38 1HG GLU 38 7.227 16.517 -10.576
260 HG3 GLU 38 2HG GLU 38 6.502 15.706 -9.189
261 H LYS 39 H LYS 39 9.586 12.136 -7.901
262 HA LYS 39 HA LYS 39 9.683 14.003 -5.623
263 HB2 LYS 39 1HB LYS 39 8.604 11.982 -4.885
264 HB3 LYS 39 2HB LYS 39 9.857 10.988 -5.616
265 HG2 LYS 39 1HG LYS 39 10.221 11.028 -3.265
266 HG3 LYS 39 2HG LYS 39 11.489 11.991 -4.026
267 HD2 LYS 39 1HD LYS 39 10.618 13.988 -3.255
268 HD3 LYS 39 2HD LYS 39 8.992 13.326 -3.071
269 HE2 LYS 39 1HE LYS 39 9.582 12.171 -1.098
270 HE3 LYS 39 2HE LYS 39 11.305 12.417 -1.379
271 HZ1 LYS 39 3HZ LYS 39 10.066 13.885 0.330
272 HZ2 LYS 39 1HZ LYS 39 9.541 14.745 -1.030
273 HZ3 LYS 39 2HZ LYS 39 11.195 14.598 -0.709
274 HA PRO 40 HA PRO 40 13.897 13.998 -7.380
275 HB2 PRO 40 1HB PRO 40 14.482 16.502 -6.509
276 HB3 PRO 40 2HB PRO 40 13.593 16.188 -8.004
277 HG2 PRO 40 1HG PRO 40 12.548 16.950 -5.304
278 HG3 PRO 40 2HG PRO 40 12.063 17.548 -6.901
279 HD2 PRO 40 1HD PRO 40 10.640 15.682 -5.550
280 HD3 PRO 40 2HD PRO 40 10.732 15.715 -7.323
281 H SER 41 H SER 41 14.475 12.381 -5.804
282 HA SER 41 HA SER 41 15.015 13.119 -3.088
283 HB2 SER 41 1HB SER 41 16.103 10.835 -3.005
284 HB3 SER 41 2HB SER 41 14.409 10.839 -3.495
285 HG SER 41 HG SER 41 16.204 11.082 -5.568
286 H GLY 42 H GLY 42 16.446 14.884 -3.262
287 HA2 GLY 42 1HA GLY 42 19.136 14.214 -4.277
288 HA3 GLY 42 2HA GLY 42 18.488 15.844 -4.168
289 HA PRO 43 HA PRO 43 20.287 16.424 -0.219
290 HB2 PRO 43 1HB PRO 43 18.360 17.749 1.160
291 HB3 PRO 43 2HB PRO 43 19.288 18.492 -0.148
292 HG2 PRO 43 1HG PRO 43 16.538 17.311 -0.210
293 HG3 PRO 43 2HG PRO 43 17.129 18.809 -0.952
294 HD2 PRO 43 1HD PRO 43 16.793 16.521 -2.359
295 HD3 PRO 43 2HD PRO 43 18.061 17.702 -2.746
296 H SER 44 H SER 44 17.647 14.385 -0.592
297 HA SER 44 HA SER 44 17.432 13.685 2.228
298 HB2 SER 44 1HB SER 44 15.440 13.813 0.626
299 HB3 SER 44 2HB SER 44 16.041 12.307 -0.068
300 HG SER 44 HG SER 44 15.212 11.290 1.561
301 H SER 45 H SER 45 18.381 12.170 -0.840
302 HA SER 45 HA SER 45 20.337 10.544 0.501
303 HB2 SER 45 1HB SER 45 17.773 9.364 -0.507
304 HB3 SER 45 2HB SER 45 19.261 8.423 -0.618
305 HG SER 45 HG SER 45 17.710 8.890 1.527
306 H GLY 46 H GLY 46 22.004 10.125 -0.827
307 HA2 GLY 46 1HA GLY 46 21.546 10.425 -3.730
308 HA3 GLY 46 2HA GLY 46 22.923 11.167 -2.930
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -9.603 -25.300 3.615
2 HA2 GLY 1 1HA GLY 1 -9.120 -22.432 4.131
3 HA3 GLY 1 2HA GLY 1 -10.704 -23.190 4.184
4 H SER 2 H SER 2 -7.499 -23.417 5.717
5 HA SER 2 HA SER 2 -8.742 -24.417 8.159
6 HB2 SER 2 1HB SER 2 -6.505 -25.251 7.052
7 HB3 SER 2 2HB SER 2 -5.804 -23.882 7.916
8 HG SER 2 HG SER 2 -7.507 -25.543 9.356
9 H SER 3 H SER 3 -9.477 -21.816 7.554
10 HA SER 3 HA SER 3 -8.134 -20.327 9.709
11 HB2 SER 3 1HB SER 3 -9.107 -19.190 7.076
12 HB3 SER 3 2HB SER 3 -8.462 -18.245 8.418
13 HG SER 3 HG SER 3 -6.894 -20.344 7.487
14 H GLY 4 H GLY 4 -9.539 -18.417 10.432
15 HA2 GLY 4 1HA GLY 4 -12.022 -19.448 11.332
16 HA3 GLY 4 2HA GLY 4 -11.456 -17.797 11.538
17 H SER 5 H SER 5 -12.268 -16.209 10.269
18 HA SER 5 HA SER 5 -14.472 -16.964 8.509
19 HB2 SER 5 1HB SER 5 -15.088 -14.580 8.606
20 HB3 SER 5 2HB SER 5 -14.913 -15.263 10.223
21 HG SER 5 HG SER 5 -13.346 -13.917 10.590
22 H SER 6 H SER 6 -13.338 -17.684 6.692
23 HA SER 6 HA SER 6 -11.292 -16.204 5.416
24 HB2 SER 6 1HB SER 6 -11.507 -18.574 4.986
25 HB3 SER 6 2HB SER 6 -13.141 -18.355 4.360
26 HG SER 6 HG SER 6 -10.949 -18.338 2.975
27 H GLY 7 H GLY 7 -14.788 -16.440 4.861
28 HA2 GLY 7 1HA GLY 7 -16.225 -15.127 3.643
29 HA3 GLY 7 2HA GLY 7 -15.133 -13.809 4.042
30 H THR 8 H THR 8 -16.252 -15.935 1.601
31 HA THR 8 HA THR 8 -14.116 -15.429 -0.260
32 HB THR 8 HB THR 8 -16.861 -16.545 -0.857
33 HG1 THR 8 HG1 THR 8 -14.536 -18.098 -0.422
34 HG21 THR 8 3HG2 THR 8 -16.109 -16.465 -2.961
35 HG22 THR 8 1HG2 THR 8 -14.965 -17.725 -2.502
36 HG23 THR 8 2HG2 THR 8 -14.481 -16.030 -2.440
37 H GLY 9 H GLY 9 -13.989 -13.192 -0.494
38 HA2 GLY 9 1HA GLY 9 -15.263 -11.977 -2.572
39 HA3 GLY 9 2HA GLY 9 -16.302 -11.630 -1.198
40 H GLY 10 H GLY 10 -13.958 -10.341 -3.032
41 HA2 GLY 10 1HA GLY 10 -13.446 -8.014 -2.054
42 HA3 GLY 10 2HA GLY 10 -12.639 -8.944 -0.800
43 H LYS 11 H LYS 11 -12.576 -8.009 -4.175
44 HA LYS 11 HA LYS 11 -10.174 -9.386 -4.833
45 HB2 LYS 11 1HB LYS 11 -11.387 -6.960 -6.169
46 HB3 LYS 11 2HB LYS 11 -10.183 -8.037 -6.864
47 HG2 LYS 11 1HG LYS 11 -11.982 -9.872 -6.446
48 HG3 LYS 11 2HG LYS 11 -13.091 -8.499 -6.392
49 HD2 LYS 11 1HD LYS 11 -11.788 -7.854 -8.616
50 HD3 LYS 11 2HD LYS 11 -11.524 -9.599 -8.665
51 HE2 LYS 11 1HE LYS 11 -14.047 -9.799 -8.274
52 HE3 LYS 11 2HE LYS 11 -14.120 -8.090 -8.697
53 HZ1 LYS 11 3HZ LYS 11 -12.924 -10.173 -10.439
54 HZ2 LYS 11 1HZ LYS 11 -13.227 -8.557 -10.840
55 HZ3 LYS 11 2HZ LYS 11 -14.517 -9.622 -10.585
56 H HIS 12 H HIS 12 -8.261 -8.955 -3.965
57 HA HIS 12 HA HIS 12 -7.671 -6.406 -2.771
58 HB2 HIS 12 1HB HIS 12 -6.850 -8.853 -2.142
59 HB3 HIS 12 2HB HIS 12 -5.540 -8.440 -3.244
60 HD1 HIS 12 HD1 HIS 12 -5.901 -8.608 0.130
61 HD2 HIS 12 HD2 HIS 12 -4.838 -5.445 -2.346
62 HE1 HIS 12 HE1 HIS 12 -4.651 -6.995 1.599
63 H PHE 13 H PHE 13 -6.694 -4.721 -3.684
64 HA PHE 13 HA PHE 13 -5.640 -5.034 -6.399
65 HB2 PHE 13 1HB PHE 13 -6.327 -2.503 -4.890
66 HB3 PHE 13 2HB PHE 13 -5.874 -2.610 -6.588
67 HD1 PHE 13 HD2 PHE 13 -8.459 -3.644 -4.143
68 HD2 PHE 13 HD1 PHE 13 -7.483 -2.990 -8.234
69 HE1 PHE 13 HE2 PHE 13 -10.826 -3.935 -4.751
70 HE2 PHE 13 HE1 PHE 13 -9.848 -3.278 -8.848
71 HZ PHE 13 HZ PHE 13 -11.523 -3.753 -7.106
72 H GLU 14 H GLU 14 -3.522 -5.188 -6.667
73 HA GLU 14 HA GLU 14 -1.743 -4.202 -4.557
74 HB2 GLU 14 1HB GLU 14 -1.656 -6.606 -5.464
75 HB3 GLU 14 2HB GLU 14 -0.921 -5.905 -6.898
76 HG2 GLU 14 1HG GLU 14 0.981 -5.216 -5.731
77 HG3 GLU 14 2HG GLU 14 0.194 -5.402 -4.165
78 H CYS 15 H CYS 15 0.124 -2.969 -5.069
79 HA CYS 15 HA CYS 15 -0.335 -1.073 -7.200
80 HB2 CYS 15 1HB CYS 15 0.440 -0.378 -4.934
81 HB3 CYS 15 2HB CYS 15 1.960 -1.214 -5.234
82 H THR 16 H THR 16 0.407 -1.325 -9.189
83 HA THR 16 HA THR 16 2.194 -3.392 -9.932
84 HB THR 16 HB THR 16 0.515 -2.560 -11.495
85 HG1 THR 16 HG1 THR 16 3.203 -2.119 -12.342
86 HG21 THR 16 3HG2 THR 16 1.334 -0.297 -12.653
87 HG22 THR 16 1HG2 THR 16 1.923 0.008 -11.019
88 HG23 THR 16 2HG2 THR 16 0.210 -0.310 -11.294
89 H GLU 17 H GLU 17 2.745 -0.342 -8.610
90 HA GLU 17 HA GLU 17 5.278 0.152 -9.904
91 HB2 GLU 17 1HB GLU 17 4.136 1.474 -7.439
92 HB3 GLU 17 2HB GLU 17 5.445 2.074 -8.447
93 HG2 GLU 17 1HG GLU 17 2.537 1.841 -9.165
94 HG3 GLU 17 2HG GLU 17 3.489 3.313 -8.974
95 H CYS 18 H CYS 18 4.356 -0.408 -6.501
96 HA CYS 18 HA CYS 18 7.042 -1.491 -6.025
97 HB2 CYS 18 1HB CYS 18 6.523 -1.172 -3.626
98 HB3 CYS 18 2HB CYS 18 6.405 0.327 -4.542
99 H GLY 19 H GLY 19 3.610 -2.203 -5.456
100 HA2 GLY 19 1HA GLY 19 2.907 -4.512 -5.965
101 HA3 GLY 19 2HA GLY 19 4.369 -5.043 -5.146
102 H LYS 20 H LYS 20 2.575 -2.393 -3.832
103 HA LYS 20 HA LYS 20 2.085 -3.880 -1.412
104 HB2 LYS 20 1HB LYS 20 2.755 -1.394 -1.630
105 HB3 LYS 20 2HB LYS 20 1.055 -1.113 -1.983
106 HG2 LYS 20 1HG LYS 20 0.380 -1.666 0.148
107 HG3 LYS 20 2HG LYS 20 1.819 -2.638 0.465
108 HD2 LYS 20 1HD LYS 20 3.176 -0.674 0.676
109 HD3 LYS 20 2HD LYS 20 1.852 0.359 0.135
110 HE2 LYS 20 1HE LYS 20 0.623 -0.740 2.199
111 HE3 LYS 20 2HE LYS 20 2.277 -0.981 2.759
112 HZ1 LYS 20 3HZ LYS 20 1.346 1.662 1.824
113 HZ2 LYS 20 1HZ LYS 20 2.671 1.296 2.811
114 HZ3 LYS 20 2HZ LYS 20 1.099 1.160 3.420
115 H ALA 21 H ALA 21 0.273 -4.901 -0.861
116 HA ALA 21 HA ALA 21 -2.020 -4.757 -2.653
117 HB1 ALA 21 3HB ALA 21 -0.980 -6.926 -1.786
118 HB2 ALA 21 1HB ALA 21 -1.786 -6.554 -0.262
119 HB3 ALA 21 2HB ALA 21 -2.737 -6.784 -1.730
120 H PHE 22 H PHE 22 -3.849 -3.709 -2.205
121 HA PHE 22 HA PHE 22 -4.284 -2.791 0.561
122 HB2 PHE 22 1HB PHE 22 -5.071 -1.320 -1.962
123 HB3 PHE 22 2HB PHE 22 -5.267 -0.748 -0.308
124 HD1 PHE 22 HD2 PHE 22 -2.798 -1.541 -2.928
125 HD2 PHE 22 HD1 PHE 22 -3.488 0.288 0.853
126 HE1 PHE 22 HE2 PHE 22 -0.575 -0.493 -3.033
127 HE2 PHE 22 HE1 PHE 22 -1.266 1.340 0.753
128 HZ PHE 22 HZ PHE 22 0.194 0.949 -1.191
129 H THR 23 H THR 23 -6.268 -3.086 1.434
130 HA THR 23 HA THR 23 -8.100 -4.808 0.003
131 HB THR 23 HB THR 23 -7.578 -5.218 2.390
132 HG1 THR 23 HG1 THR 23 -9.810 -5.491 3.003
133 HG21 THR 23 3HG2 THR 23 -8.565 -3.778 4.106
134 HG22 THR 23 1HG2 THR 23 -9.129 -2.668 2.857
135 HG23 THR 23 2HG2 THR 23 -7.400 -2.888 3.126
136 H ARG 24 H ARG 24 -7.656 -1.713 -0.362
137 HA ARG 24 HA ARG 24 -10.498 -1.166 -0.787
138 HB2 ARG 24 1HB ARG 24 -8.627 0.427 0.920
139 HB3 ARG 24 2HB ARG 24 -9.882 1.262 0.013
140 HG2 ARG 24 1HG ARG 24 -11.597 -0.015 1.125
141 HG3 ARG 24 2HG ARG 24 -10.378 -0.980 1.959
142 HD2 ARG 24 1HD ARG 24 -9.534 1.197 2.945
143 HD3 ARG 24 2HD ARG 24 -11.006 1.939 2.320
144 HE ARG 24 HE ARG 24 -11.947 -0.152 3.739
145 HH11 ARG 24 1HH1 ARG 24 -9.711 2.409 4.488
146 HH12 ARG 24 2HH1 ARG 24 -10.110 2.442 6.173
147 HH21 ARG 24 1HH2 ARG 24 -12.481 -0.119 5.957
148 HH22 ARG 24 2HH2 ARG 24 -11.685 1.003 7.008
149 H LYS 25 H LYS 25 -10.668 -0.789 -2.890
150 HA LYS 25 HA LYS 25 -8.642 -0.250 -4.675
151 HB2 LYS 25 1HB LYS 25 -11.082 -0.901 -5.131
152 HB3 LYS 25 2HB LYS 25 -11.433 0.820 -5.048
153 HG2 LYS 25 1HG LYS 25 -9.536 1.018 -6.816
154 HG3 LYS 25 2HG LYS 25 -9.862 -0.697 -7.080
155 HD2 LYS 25 1HD LYS 25 -12.357 0.136 -7.185
156 HD3 LYS 25 2HD LYS 25 -11.594 1.674 -7.595
157 HE2 LYS 25 1HE LYS 25 -10.747 -0.809 -9.017
158 HE3 LYS 25 2HE LYS 25 -12.262 -0.030 -9.471
159 HZ1 LYS 25 3HZ LYS 25 -11.188 1.811 -10.257
160 HZ2 LYS 25 1HZ LYS 25 -10.035 0.627 -10.622
161 HZ3 LYS 25 2HZ LYS 25 -9.837 1.608 -9.258
162 H SER 26 H SER 26 -10.630 2.033 -2.859
163 HA SER 26 HA SER 26 -9.630 4.367 -4.131
164 HB2 SER 26 1HB SER 26 -11.732 4.517 -2.988
165 HB3 SER 26 2HB SER 26 -11.021 3.941 -1.481
166 HG SER 26 HG SER 26 -9.745 6.142 -2.433
167 H THR 27 H THR 27 -8.788 2.686 -1.127
168 HA THR 27 HA THR 27 -6.935 4.466 -0.096
169 HB THR 27 HB THR 27 -6.907 1.446 0.026
170 HG1 THR 27 HG1 THR 27 -7.569 3.003 2.229
171 HG21 THR 27 3HG2 THR 27 -5.555 1.921 2.151
172 HG22 THR 27 1HG2 THR 27 -5.256 3.513 1.454
173 HG23 THR 27 2HG2 THR 27 -4.716 2.063 0.607
174 H LEU 28 H LEU 28 -6.367 1.773 -2.352
175 HA LEU 28 HA LEU 28 -3.599 2.148 -2.625
176 HB2 LEU 28 1HB LEU 28 -4.358 0.112 -3.405
177 HB3 LEU 28 2HB LEU 28 -5.714 0.833 -4.270
178 HG LEU 28 HG LEU 28 -4.115 1.706 -5.953
179 HD11 LEU 28 1HD1 LEU 28 -2.122 1.800 -4.566
180 HD12 LEU 28 2HD1 LEU 28 -1.839 0.804 -5.992
181 HD13 LEU 28 3HD1 LEU 28 -2.116 0.042 -4.426
182 HD21 LEU 28 3HD2 LEU 28 -3.359 -0.948 -6.376
183 HD22 LEU 28 1HD2 LEU 28 -4.790 -0.131 -7.004
184 HD23 LEU 28 2HD2 LEU 28 -4.883 -1.032 -5.491
185 H SER 29 H SER 29 -6.252 3.218 -4.754
186 HA SER 29 HA SER 29 -4.931 4.525 -6.714
187 HB2 SER 29 1HB SER 29 -7.482 4.392 -6.205
188 HB3 SER 29 2HB SER 29 -7.230 5.931 -5.381
189 HG SER 29 HG SER 29 -6.199 6.589 -7.443
190 H MET 30 H MET 30 -5.343 5.637 -3.404
191 HA MET 30 HA MET 30 -4.178 8.217 -3.893
192 HB2 MET 30 1HB MET 30 -4.790 6.742 -1.327
193 HB3 MET 30 2HB MET 30 -4.194 8.395 -1.398
194 HG2 MET 30 1HG MET 30 -6.277 8.735 -2.959
195 HG3 MET 30 2HG MET 30 -6.865 7.307 -2.112
196 HE1 MET 30 3HE MET 30 -7.898 7.171 -0.264
197 HE2 MET 30 1HE MET 30 -8.000 8.273 1.110
198 HE3 MET 30 2HE MET 30 -8.974 8.568 -0.331
199 H HIS 31 H HIS 31 -3.058 5.088 -2.777
200 HA HIS 31 HA HIS 31 -0.517 5.967 -1.849
201 HB2 HIS 31 1HB HIS 31 -1.054 3.908 -0.961
202 HB3 HIS 31 2HB HIS 31 -1.770 3.328 -2.462
203 HD1 HIS 31 HD1 HIS 31 1.520 3.681 -0.707
204 HD2 HIS 31 HD2 HIS 31 -0.010 2.063 -4.214
205 HE1 HIS 31 HE1 HIS 31 3.370 2.269 -1.658
206 H GLN 32 H GLN 32 -1.695 4.676 -4.921
207 HA GLN 32 HA GLN 32 0.721 4.315 -6.234
208 HB2 GLN 32 1HB GLN 32 -1.901 5.267 -7.400
209 HB3 GLN 32 2HB GLN 32 -0.555 4.614 -8.324
210 HG2 GLN 32 1HG GLN 32 -0.806 2.516 -6.918
211 HG3 GLN 32 2HG GLN 32 -2.344 3.191 -6.384
212 HE21 GLN 32 1HE2 GLN 32 -4.068 2.734 -7.552
213 HE22 GLN 32 2HE2 GLN 32 -4.066 2.142 -9.175
214 H LYS 33 H LYS 33 -0.776 7.215 -5.222
215 HA LYS 33 HA LYS 33 0.299 9.003 -7.135
216 HB2 LYS 33 1HB LYS 33 -0.682 9.379 -4.309
217 HB3 LYS 33 2HB LYS 33 -0.090 10.717 -5.285
218 HG2 LYS 33 1HG LYS 33 -1.824 9.996 -7.013
219 HG3 LYS 33 2HG LYS 33 -2.520 9.016 -5.720
220 HD2 LYS 33 1HD LYS 33 -2.022 11.986 -5.532
221 HD3 LYS 33 2HD LYS 33 -3.572 11.260 -5.965
222 HE2 LYS 33 1HE LYS 33 -3.903 11.512 -3.726
223 HE3 LYS 33 2HE LYS 33 -3.146 9.920 -3.719
224 HZ1 LYS 33 3HZ LYS 33 -2.252 11.589 -2.082
225 HZ2 LYS 33 1HZ LYS 33 -1.589 12.417 -3.400
226 HZ3 LYS 33 2HZ LYS 33 -1.100 10.834 -3.063
227 H ILE 34 H ILE 34 1.736 7.237 -4.620
228 HA ILE 34 HA ILE 34 3.859 9.070 -4.020
229 HB ILE 34 HB ILE 34 4.754 7.419 -2.622
230 HG12 ILE 34 1HG1 ILE 34 3.133 5.348 -4.119
231 HG13 ILE 34 2HG1 ILE 34 4.855 5.635 -4.343
232 HG21 ILE 34 1HG2 ILE 34 2.901 7.955 -1.437
233 HG22 ILE 34 2HG2 ILE 34 1.803 7.510 -2.743
234 HG23 ILE 34 3HG2 ILE 34 2.517 6.258 -1.726
235 HD11 ILE 34 3HD1 ILE 34 3.452 4.513 -1.945
236 HD12 ILE 34 1HD1 ILE 34 4.695 3.764 -2.945
237 HD13 ILE 34 2HD1 ILE 34 5.111 5.107 -1.880
238 H HIS 35 H HIS 35 3.187 7.125 -6.654
239 HA HIS 35 HA HIS 35 6.033 6.856 -7.353
240 HB2 HIS 35 1HB HIS 35 3.648 5.413 -8.530
241 HB3 HIS 35 2HB HIS 35 5.334 5.146 -8.964
242 HD1 HIS 35 HD1 HIS 35 6.859 4.378 -6.764
243 HD2 HIS 35 HD2 HIS 35 2.765 3.683 -6.656
244 HE1 HIS 35 HE1 HIS 35 6.523 2.614 -5.003
245 H THR 36 H THR 36 2.959 8.179 -8.338
246 HA THR 36 HA THR 36 3.760 8.944 -10.966
247 HB THR 36 HB THR 36 1.739 10.459 -10.851
248 HG1 THR 36 HG1 THR 36 0.357 10.006 -9.000
249 HG21 THR 36 3HG2 THR 36 0.862 8.633 -11.789
250 HG22 THR 36 1HG2 THR 36 0.325 8.150 -10.180
251 HG23 THR 36 2HG2 THR 36 1.868 7.569 -10.806
252 H GLY 37 H GLY 37 3.613 10.606 -7.840
253 HA2 GLY 37 1HA GLY 37 4.274 13.180 -8.754
254 HA3 GLY 37 2HA GLY 37 4.540 12.579 -7.124
255 H GLU 38 H GLU 38 6.553 11.783 -6.538
256 HA GLU 38 HA GLU 38 8.762 12.877 -7.950
257 HB2 GLU 38 1HB GLU 38 8.570 12.476 -5.439
258 HB3 GLU 38 2HB GLU 38 8.922 10.788 -5.783
259 HG2 GLU 38 1HG GLU 38 11.001 11.594 -5.268
260 HG3 GLU 38 2HG GLU 38 10.993 11.753 -7.023
261 H LYS 39 H LYS 39 10.496 11.796 -8.958
262 HA LYS 39 HA LYS 39 9.691 9.318 -10.281
263 HB2 LYS 39 1HB LYS 39 11.613 11.513 -10.894
264 HB3 LYS 39 2HB LYS 39 11.948 9.916 -11.551
265 HG2 LYS 39 1HG LYS 39 9.219 11.027 -11.911
266 HG3 LYS 39 2HG LYS 39 10.534 11.700 -12.879
267 HD2 LYS 39 1HD LYS 39 11.107 9.287 -13.474
268 HD3 LYS 39 2HD LYS 39 9.532 8.866 -12.795
269 HE2 LYS 39 1HE LYS 39 8.511 10.525 -14.367
270 HE3 LYS 39 2HE LYS 39 10.096 10.703 -15.117
271 HZ1 LYS 39 3HZ LYS 39 9.931 8.133 -15.312
272 HZ2 LYS 39 1HZ LYS 39 9.132 9.115 -16.434
273 HZ3 LYS 39 2HZ LYS 39 8.268 8.404 -15.165
274 HA PRO 40 HA PRO 40 12.455 6.724 -8.067
275 HB2 PRO 40 1HB PRO 40 13.176 4.954 -9.995
276 HB3 PRO 40 2HB PRO 40 11.571 4.967 -9.255
277 HG2 PRO 40 1HG PRO 40 12.461 6.119 -11.871
278 HG3 PRO 40 2HG PRO 40 10.988 5.206 -11.494
279 HD2 PRO 40 1HD PRO 40 11.013 7.905 -11.717
280 HD3 PRO 40 2HD PRO 40 9.923 7.049 -10.608
281 H SER 41 H SER 41 14.688 5.860 -8.046
282 HA SER 41 HA SER 41 16.525 7.622 -9.533
283 HB2 SER 41 1HB SER 41 16.855 6.472 -6.751
284 HB3 SER 41 2HB SER 41 18.064 7.434 -7.601
285 HG SER 41 HG SER 41 16.392 9.100 -7.707
286 H GLY 42 H GLY 42 16.791 6.140 -11.233
287 HA2 GLY 42 1HA GLY 42 18.872 4.241 -10.841
288 HA3 GLY 42 2HA GLY 42 17.327 3.428 -11.042
289 HA PRO 43 HA PRO 43 19.352 4.579 -15.181
290 HB2 PRO 43 1HB PRO 43 20.094 2.081 -15.941
291 HB3 PRO 43 2HB PRO 43 21.153 3.161 -15.026
292 HG2 PRO 43 1HG PRO 43 19.454 0.899 -14.048
293 HG3 PRO 43 2HG PRO 43 21.115 1.326 -13.598
294 HD2 PRO 43 1HD PRO 43 18.981 1.955 -12.055
295 HD3 PRO 43 2HD PRO 43 20.431 2.976 -12.142
296 H SER 44 H SER 44 18.253 4.397 -17.095
297 HA SER 44 HA SER 44 15.590 3.515 -17.053
298 HB2 SER 44 1HB SER 44 17.435 4.249 -19.328
299 HB3 SER 44 2HB SER 44 15.741 3.825 -19.578
300 HG SER 44 HG SER 44 15.681 5.973 -19.323
301 H SER 45 H SER 45 18.368 2.149 -18.827
302 HA SER 45 HA SER 45 17.284 -0.021 -20.007
303 HB2 SER 45 1HB SER 45 19.426 -1.114 -19.868
304 HB3 SER 45 2HB SER 45 19.715 0.619 -20.021
305 HG SER 45 HG SER 45 19.785 0.533 -17.603
306 H GLY 46 H GLY 46 17.675 0.462 -16.589
307 HA2 GLY 46 1HA GLY 46 17.200 -2.302 -15.898
308 HA3 GLY 46 2HA GLY 46 17.308 -0.948 -14.782
Start of MODEL 18
1 H1 GLY 1 H GLY 1 7.757 -24.287 -14.331
2 HA2 GLY 1 1HA GLY 1 6.275 -26.169 -14.330
3 HA3 GLY 1 2HA GLY 1 7.080 -26.756 -12.883
4 H SER 2 H SER 2 4.784 -24.431 -14.150
5 HA SER 2 HA SER 2 3.849 -23.930 -11.401
6 HB2 SER 2 1HB SER 2 3.758 -22.204 -13.874
7 HB3 SER 2 2HB SER 2 2.747 -21.877 -12.467
8 HG SER 2 HG SER 2 5.438 -21.478 -12.832
9 H SER 3 H SER 3 2.221 -25.289 -10.998
10 HA SER 3 HA SER 3 0.106 -25.551 -13.034
11 HB2 SER 3 1HB SER 3 -0.339 -27.795 -12.212
12 HB3 SER 3 2HB SER 3 1.367 -27.661 -12.638
13 HG SER 3 HG SER 3 1.913 -27.696 -10.545
14 H GLY 4 H GLY 4 -1.899 -24.972 -12.461
15 HA2 GLY 4 1HA GLY 4 -3.718 -24.864 -10.911
16 HA3 GLY 4 2HA GLY 4 -2.550 -24.769 -9.601
17 H SER 5 H SER 5 -4.296 -22.989 -9.204
18 HA SER 5 HA SER 5 -3.004 -20.480 -9.775
19 HB2 SER 5 1HB SER 5 -4.459 -20.850 -11.782
20 HB3 SER 5 2HB SER 5 -5.858 -20.856 -10.708
21 HG SER 5 HG SER 5 -5.782 -18.782 -11.166
22 H SER 6 H SER 6 -3.444 -18.944 -8.253
23 HA SER 6 HA SER 6 -5.184 -19.798 -6.048
24 HB2 SER 6 1HB SER 6 -2.780 -18.001 -6.205
25 HB3 SER 6 2HB SER 6 -3.896 -17.884 -4.844
26 HG SER 6 HG SER 6 -2.318 -19.344 -4.291
27 H GLY 7 H GLY 7 -6.485 -18.185 -4.948
28 HA2 GLY 7 1HA GLY 7 -6.965 -15.615 -6.047
29 HA3 GLY 7 2HA GLY 7 -8.162 -16.755 -6.644
30 H THR 8 H THR 8 -6.712 -15.529 -3.646
31 HA THR 8 HA THR 8 -8.786 -16.516 -1.965
32 HB THR 8 HB THR 8 -7.825 -15.024 -0.238
33 HG1 THR 8 HG1 THR 8 -5.897 -13.850 -0.872
34 HG21 THR 8 3HG2 THR 8 -6.681 -17.258 -1.384
35 HG22 THR 8 1HG2 THR 8 -6.214 -16.531 0.153
36 HG23 THR 8 2HG2 THR 8 -5.347 -16.106 -1.323
37 H GLY 9 H GLY 9 -10.498 -15.420 -0.992
38 HA2 GLY 9 1HA GLY 9 -11.820 -13.506 -2.608
39 HA3 GLY 9 2HA GLY 9 -12.315 -14.014 -1.000
40 H GLY 10 H GLY 10 -12.403 -11.348 -2.140
41 HA2 GLY 10 1HA GLY 10 -12.143 -9.531 -0.402
42 HA3 GLY 10 2HA GLY 10 -10.444 -9.980 -0.403
43 H LYS 11 H LYS 11 -10.568 -10.444 -3.361
44 HA LYS 11 HA LYS 11 -9.950 -9.278 -5.218
45 HB2 LYS 11 1HB LYS 11 -12.162 -7.459 -4.246
46 HB3 LYS 11 2HB LYS 11 -11.454 -7.412 -5.855
47 HG2 LYS 11 1HG LYS 11 -12.743 -9.887 -4.753
48 HG3 LYS 11 2HG LYS 11 -13.662 -8.634 -5.591
49 HD2 LYS 11 1HD LYS 11 -11.210 -9.809 -6.846
50 HD3 LYS 11 2HD LYS 11 -12.752 -10.662 -6.933
51 HE2 LYS 11 1HE LYS 11 -13.779 -8.863 -8.091
52 HE3 LYS 11 2HE LYS 11 -12.421 -7.788 -7.763
53 HZ1 LYS 11 3HZ LYS 11 -12.124 -10.256 -9.370
54 HZ2 LYS 11 1HZ LYS 11 -11.069 -8.937 -9.273
55 HZ3 LYS 11 2HZ LYS 11 -12.554 -8.775 -10.067
56 H HIS 12 H HIS 12 -8.229 -8.820 -3.164
57 HA HIS 12 HA HIS 12 -7.835 -6.087 -2.537
58 HB2 HIS 12 1HB HIS 12 -5.755 -6.756 -1.587
59 HB3 HIS 12 2HB HIS 12 -6.885 -8.073 -1.288
60 HD1 HIS 12 HD1 HIS 12 -6.141 -10.336 -1.996
61 HD2 HIS 12 HD2 HIS 12 -3.972 -7.322 -3.859
62 HE1 HIS 12 HE1 HIS 12 -4.327 -11.510 -3.282
63 H PHE 13 H PHE 13 -6.575 -4.530 -3.466
64 HA PHE 13 HA PHE 13 -5.651 -5.101 -6.193
65 HB2 PHE 13 1HB PHE 13 -6.222 -2.441 -4.867
66 HB3 PHE 13 2HB PHE 13 -5.760 -2.672 -6.550
67 HD1 PHE 13 HD2 PHE 13 -8.410 -3.362 -4.067
68 HD2 PHE 13 HD1 PHE 13 -7.360 -3.190 -8.188
69 HE1 PHE 13 HE2 PHE 13 -10.781 -3.606 -4.678
70 HE2 PHE 13 HE1 PHE 13 -9.729 -3.432 -8.806
71 HZ PHE 13 HZ PHE 13 -11.443 -3.642 -7.050
72 H GLU 14 H GLU 14 -3.550 -5.149 -6.646
73 HA GLU 14 HA GLU 14 -1.660 -4.294 -4.577
74 HB2 GLU 14 1HB GLU 14 -1.544 -6.625 -5.476
75 HB3 GLU 14 2HB GLU 14 -1.128 -5.952 -7.046
76 HG2 GLU 14 1HG GLU 14 0.809 -4.806 -5.804
77 HG3 GLU 14 2HG GLU 14 0.478 -5.970 -4.523
78 H CYS 15 H CYS 15 0.115 -2.968 -5.049
79 HA CYS 15 HA CYS 15 -0.403 -0.990 -7.081
80 HB2 CYS 15 1HB CYS 15 0.429 -0.408 -4.799
81 HB3 CYS 15 2HB CYS 15 1.951 -1.199 -5.194
82 H THR 16 H THR 16 0.219 -1.244 -9.112
83 HA THR 16 HA THR 16 2.011 -3.217 -10.006
84 HB THR 16 HB THR 16 1.282 -0.707 -11.519
85 HG1 THR 16 HG1 THR 16 -0.628 -1.692 -10.806
86 HG21 THR 16 3HG2 THR 16 3.027 -2.049 -12.559
87 HG22 THR 16 1HG2 THR 16 1.531 -2.174 -13.484
88 HG23 THR 16 2HG2 THR 16 2.025 -3.493 -12.422
89 H GLU 17 H GLU 17 2.574 -0.148 -8.644
90 HA GLU 17 HA GLU 17 5.090 0.363 -9.934
91 HB2 GLU 17 1HB GLU 17 4.028 1.573 -7.378
92 HB3 GLU 17 2HB GLU 17 5.296 2.221 -8.409
93 HG2 GLU 17 1HG GLU 17 2.559 1.784 -9.513
94 HG3 GLU 17 2HG GLU 17 2.900 3.203 -8.524
95 H CYS 18 H CYS 18 4.300 -0.259 -6.509
96 HA CYS 18 HA CYS 18 6.979 -1.392 -6.159
97 HB2 CYS 18 1HB CYS 18 6.526 -1.175 -3.740
98 HB3 CYS 18 2HB CYS 18 6.363 0.361 -4.585
99 H GLY 19 H GLY 19 3.564 -2.143 -5.538
100 HA2 GLY 19 1HA GLY 19 2.872 -4.439 -6.142
101 HA3 GLY 19 2HA GLY 19 4.342 -4.989 -5.352
102 H LYS 20 H LYS 20 2.711 -2.391 -3.833
103 HA LYS 20 HA LYS 20 2.193 -3.971 -1.504
104 HB2 LYS 20 1HB LYS 20 2.860 -1.491 -1.610
105 HB3 LYS 20 2HB LYS 20 1.168 -1.180 -1.980
106 HG2 LYS 20 1HG LYS 20 0.453 -1.830 0.120
107 HG3 LYS 20 2HG LYS 20 1.906 -2.782 0.432
108 HD2 LYS 20 1HD LYS 20 3.202 -0.651 0.490
109 HD3 LYS 20 2HD LYS 20 1.675 0.225 0.363
110 HE2 LYS 20 1HE LYS 20 2.131 -1.808 2.520
111 HE3 LYS 20 2HE LYS 20 2.692 -0.146 2.700
112 HZ1 LYS 20 3HZ LYS 20 0.189 0.278 1.941
113 HZ2 LYS 20 1HZ LYS 20 0.644 0.116 3.563
114 HZ3 LYS 20 2HZ LYS 20 -0.015 -1.203 2.733
115 H ALA 21 H ALA 21 0.342 -4.886 -0.836
116 HA ALA 21 HA ALA 21 -1.954 -4.766 -2.638
117 HB1 ALA 21 3HB ALA 21 -1.575 -6.980 -2.220
118 HB2 ALA 21 1HB ALA 21 -0.997 -6.686 -0.579
119 HB3 ALA 21 2HB ALA 21 -2.725 -6.624 -0.931
120 H PHE 22 H PHE 22 -3.802 -3.754 -2.161
121 HA PHE 22 HA PHE 22 -4.169 -2.773 0.594
122 HB2 PHE 22 1HB PHE 22 -4.910 -1.418 -2.006
123 HB3 PHE 22 2HB PHE 22 -5.372 -0.833 -0.412
124 HD1 PHE 22 HD2 PHE 22 -2.606 -1.295 -2.763
125 HD2 PHE 22 HD1 PHE 22 -3.769 0.212 1.044
126 HE1 PHE 22 HE2 PHE 22 -0.484 -0.060 -2.608
127 HE2 PHE 22 HE1 PHE 22 -1.649 1.451 1.205
128 HZ PHE 22 HZ PHE 22 -0.003 1.315 -0.622
129 H THR 23 H THR 23 -6.186 -2.926 1.503
130 HA THR 23 HA THR 23 -7.988 -4.823 0.256
131 HB THR 23 HB THR 23 -7.410 -4.986 2.675
132 HG1 THR 23 HG1 THR 23 -10.019 -4.688 3.063
133 HG21 THR 23 3HG2 THR 23 -9.329 -2.841 3.356
134 HG22 THR 23 1HG2 THR 23 -7.741 -2.320 2.793
135 HG23 THR 23 2HG2 THR 23 -7.875 -3.373 4.202
136 H ARG 24 H ARG 24 -7.615 -1.786 -0.417
137 HA ARG 24 HA ARG 24 -10.461 -1.334 -0.874
138 HB2 ARG 24 1HB ARG 24 -8.670 0.419 0.758
139 HB3 ARG 24 2HB ARG 24 -9.925 1.161 -0.225
140 HG2 ARG 24 1HG ARG 24 -11.629 -0.113 0.928
141 HG3 ARG 24 2HG ARG 24 -10.393 -0.951 1.868
142 HD2 ARG 24 1HD ARG 24 -9.694 1.504 2.509
143 HD3 ARG 24 2HD ARG 24 -11.365 1.857 2.073
144 HE ARG 24 HE ARG 24 -10.440 0.430 4.393
145 HH11 ARG 24 1HH1 ARG 24 -13.114 0.971 2.231
146 HH12 ARG 24 2HH1 ARG 24 -14.314 0.487 3.383
147 HH21 ARG 24 1HH2 ARG 24 -12.010 -0.209 5.920
148 HH22 ARG 24 2HH2 ARG 24 -13.685 -0.183 5.482
149 H LYS 25 H LYS 25 -10.810 -0.677 -2.891
150 HA LYS 25 HA LYS 25 -8.708 -0.322 -4.735
151 HB2 LYS 25 1HB LYS 25 -11.053 -1.107 -5.246
152 HB3 LYS 25 2HB LYS 25 -11.571 0.568 -5.101
153 HG2 LYS 25 1HG LYS 25 -9.706 0.999 -6.873
154 HG3 LYS 25 2HG LYS 25 -9.900 -0.724 -7.202
155 HD2 LYS 25 1HD LYS 25 -12.192 -0.445 -7.761
156 HD3 LYS 25 2HD LYS 25 -12.210 1.208 -7.143
157 HE2 LYS 25 1HE LYS 25 -10.342 0.474 -9.355
158 HE3 LYS 25 2HE LYS 25 -12.045 0.758 -9.713
159 HZ1 LYS 25 3HZ LYS 25 -11.753 2.933 -8.503
160 HZ2 LYS 25 1HZ LYS 25 -10.969 2.808 -9.997
161 HZ3 LYS 25 2HZ LYS 25 -10.086 2.656 -8.563
162 H SER 26 H SER 26 -10.717 1.954 -2.955
163 HA SER 26 HA SER 26 -9.776 4.269 -4.344
164 HB2 SER 26 1HB SER 26 -10.883 5.520 -2.494
165 HB3 SER 26 2HB SER 26 -11.942 4.328 -3.248
166 HG SER 26 HG SER 26 -10.815 3.014 -1.348
167 H THR 27 H THR 27 -8.878 2.590 -1.385
168 HA THR 27 HA THR 27 -7.143 4.512 -0.315
169 HB THR 27 HB THR 27 -7.020 1.500 -0.074
170 HG1 THR 27 HG1 THR 27 -7.945 3.285 1.908
171 HG21 THR 27 3HG2 THR 27 -5.012 3.222 0.587
172 HG22 THR 27 1HG2 THR 27 -5.307 1.675 1.379
173 HG23 THR 27 2HG2 THR 27 -5.934 3.163 2.089
174 H LEU 28 H LEU 28 -6.445 1.728 -2.422
175 HA LEU 28 HA LEU 28 -3.687 2.135 -2.640
176 HB2 LEU 28 1HB LEU 28 -4.454 0.070 -3.377
177 HB3 LEU 28 2HB LEU 28 -5.729 0.787 -4.360
178 HG LEU 28 HG LEU 28 -3.952 1.610 -5.918
179 HD11 LEU 28 1HD1 LEU 28 -2.131 -0.308 -4.497
180 HD12 LEU 28 2HD1 LEU 28 -2.140 1.421 -4.150
181 HD13 LEU 28 3HD1 LEU 28 -1.735 0.848 -5.768
182 HD21 LEU 28 3HD2 LEU 28 -4.979 -1.035 -5.559
183 HD22 LEU 28 1HD2 LEU 28 -3.353 -1.121 -6.235
184 HD23 LEU 28 2HD2 LEU 28 -4.599 -0.181 -7.055
185 H SER 29 H SER 29 -6.335 3.267 -4.723
186 HA SER 29 HA SER 29 -4.942 4.501 -6.726
187 HB2 SER 29 1HB SER 29 -7.522 5.215 -5.361
188 HB3 SER 29 2HB SER 29 -6.886 6.228 -6.657
189 HG SER 29 HG SER 29 -7.901 4.831 -7.868
190 H MET 30 H MET 30 -5.233 5.493 -3.410
191 HA MET 30 HA MET 30 -4.163 8.140 -3.905
192 HB2 MET 30 1HB MET 30 -4.898 6.662 -1.379
193 HB3 MET 30 2HB MET 30 -4.191 8.273 -1.377
194 HG2 MET 30 1HG MET 30 -6.148 8.904 -2.916
195 HG3 MET 30 2HG MET 30 -6.876 7.400 -2.358
196 HE1 MET 30 3HE MET 30 -9.126 9.277 -0.577
197 HE2 MET 30 1HE MET 30 -8.644 7.779 -1.374
198 HE3 MET 30 2HE MET 30 -8.599 7.896 0.385
199 H HIS 31 H HIS 31 -3.041 5.007 -2.855
200 HA HIS 31 HA HIS 31 -0.515 5.922 -1.866
201 HB2 HIS 31 1HB HIS 31 -1.128 3.890 -0.925
202 HB3 HIS 31 2HB HIS 31 -1.728 3.247 -2.451
203 HD1 HIS 31 HD1 HIS 31 1.419 3.716 -0.480
204 HD2 HIS 31 HD2 HIS 31 0.182 1.986 -4.049
205 HE1 HIS 31 HE1 HIS 31 3.362 2.322 -1.260
206 H GLN 32 H GLN 32 -1.659 4.497 -4.895
207 HA GLN 32 HA GLN 32 0.783 4.129 -6.168
208 HB2 GLN 32 1HB GLN 32 -1.934 4.827 -7.277
209 HB3 GLN 32 2HB GLN 32 -0.553 4.454 -8.300
210 HG2 GLN 32 1HG GLN 32 -0.434 2.286 -6.857
211 HG3 GLN 32 2HG GLN 32 -2.118 2.668 -6.503
212 HE21 GLN 32 1HE2 GLN 32 -3.648 2.323 -8.026
213 HE22 GLN 32 2HE2 GLN 32 -3.332 1.632 -9.577
214 H LYS 33 H LYS 33 -0.735 7.023 -5.244
215 HA LYS 33 HA LYS 33 0.291 8.746 -7.262
216 HB2 LYS 33 1HB LYS 33 -0.729 9.254 -4.469
217 HB3 LYS 33 2HB LYS 33 -0.195 10.545 -5.537
218 HG2 LYS 33 1HG LYS 33 -1.907 9.447 -7.196
219 HG3 LYS 33 2HG LYS 33 -2.611 8.818 -5.704
220 HD2 LYS 33 1HD LYS 33 -1.958 11.731 -6.039
221 HD3 LYS 33 2HD LYS 33 -3.493 11.055 -6.588
222 HE2 LYS 33 1HE LYS 33 -3.773 10.137 -4.248
223 HE3 LYS 33 2HE LYS 33 -2.396 11.137 -3.786
224 HZ1 LYS 33 3HZ LYS 33 -4.648 12.138 -3.409
225 HZ2 LYS 33 1HZ LYS 33 -4.815 12.244 -5.089
226 HZ3 LYS 33 2HZ LYS 33 -3.578 13.092 -4.308
227 H ILE 34 H ILE 34 1.738 7.134 -4.662
228 HA ILE 34 HA ILE 34 3.790 9.055 -4.091
229 HB ILE 34 HB ILE 34 4.724 7.473 -2.633
230 HG12 ILE 34 1HG1 ILE 34 3.166 5.320 -4.080
231 HG13 ILE 34 2HG1 ILE 34 4.887 5.631 -4.279
232 HG21 ILE 34 1HG2 ILE 34 1.791 7.578 -2.763
233 HG22 ILE 34 2HG2 ILE 34 2.451 6.272 -1.780
234 HG23 ILE 34 3HG2 ILE 34 2.884 7.945 -1.429
235 HD11 ILE 34 3HD1 ILE 34 5.084 5.201 -1.781
236 HD12 ILE 34 1HD1 ILE 34 3.450 4.546 -1.886
237 HD13 ILE 34 2HD1 ILE 34 4.756 3.814 -2.820
238 H HIS 35 H HIS 35 3.228 6.984 -6.660
239 HA HIS 35 HA HIS 35 6.094 6.828 -7.319
240 HB2 HIS 35 1HB HIS 35 3.832 5.197 -8.490
241 HB3 HIS 35 2HB HIS 35 5.553 4.975 -8.791
242 HD1 HIS 35 HD1 HIS 35 6.973 4.283 -6.559
243 HD2 HIS 35 HD2 HIS 35 2.862 3.693 -6.451
244 HE1 HIS 35 HE1 HIS 35 6.576 2.660 -4.680
245 H THR 36 H THR 36 3.888 8.967 -7.750
246 HA THR 36 HA THR 36 4.264 9.274 -10.656
247 HB THR 36 HB THR 36 2.299 10.676 -10.703
248 HG1 THR 36 HG1 THR 36 1.102 10.993 -8.731
249 HG21 THR 36 3HG2 THR 36 2.091 8.002 -9.403
250 HG22 THR 36 1HG2 THR 36 1.552 8.523 -10.999
251 HG23 THR 36 2HG2 THR 36 0.632 8.979 -9.564
252 H GLY 37 H GLY 37 5.958 10.099 -8.212
253 HA2 GLY 37 1HA GLY 37 6.176 12.958 -8.932
254 HA3 GLY 37 2HA GLY 37 6.536 12.331 -7.330
255 H GLU 38 H GLU 38 7.472 11.252 -10.593
256 HA GLU 38 HA GLU 38 10.041 10.446 -9.903
257 HB2 GLU 38 1HB GLU 38 9.102 11.493 -12.580
258 HB3 GLU 38 2HB GLU 38 10.545 10.528 -12.303
259 HG2 GLU 38 1HG GLU 38 8.877 8.811 -11.291
260 HG3 GLU 38 2HG GLU 38 7.679 9.711 -12.218
261 H LYS 39 H LYS 39 12.042 11.485 -11.072
262 HA LYS 39 HA LYS 39 12.104 14.321 -10.279
263 HB2 LYS 39 1HB LYS 39 14.266 12.215 -10.254
264 HB3 LYS 39 2HB LYS 39 14.594 13.929 -10.038
265 HG2 LYS 39 1HG LYS 39 14.468 13.241 -7.864
266 HG3 LYS 39 2HG LYS 39 12.793 13.722 -8.147
267 HD2 LYS 39 1HD LYS 39 12.450 11.254 -8.839
268 HD3 LYS 39 2HD LYS 39 13.971 10.970 -7.989
269 HE2 LYS 39 1HE LYS 39 13.025 11.928 -5.958
270 HE3 LYS 39 2HE LYS 39 11.516 12.266 -6.805
271 HZ1 LYS 39 3HZ LYS 39 12.660 9.560 -6.368
272 HZ2 LYS 39 1HZ LYS 39 11.186 9.909 -7.122
273 HZ3 LYS 39 2HZ LYS 39 11.393 10.238 -5.476
274 HA PRO 40 HA PRO 40 12.687 14.331 -14.852
275 HB2 PRO 40 1HB PRO 40 11.305 16.636 -15.237
276 HB3 PRO 40 2HB PRO 40 10.525 15.052 -15.146
277 HG2 PRO 40 1HG PRO 40 10.800 17.153 -13.031
278 HG3 PRO 40 2HG PRO 40 9.390 16.161 -13.447
279 HD2 PRO 40 1HD PRO 40 10.995 15.599 -11.341
280 HD3 PRO 40 2HD PRO 40 10.170 14.336 -12.276
281 H SER 41 H SER 41 13.726 16.144 -12.241
282 HA SER 41 HA SER 41 14.802 18.444 -13.429
283 HB2 SER 41 1HB SER 41 14.604 17.678 -10.900
284 HB3 SER 41 2HB SER 41 16.254 17.121 -11.177
285 HG SER 41 HG SER 41 16.814 19.115 -10.887
286 H GLY 42 H GLY 42 16.321 15.292 -12.753
287 HA2 GLY 42 1HA GLY 42 18.691 16.062 -14.253
288 HA3 GLY 42 2HA GLY 42 18.446 14.551 -13.389
289 HA PRO 43 HA PRO 43 18.142 13.710 -17.943
290 HB2 PRO 43 1HB PRO 43 19.776 11.542 -17.894
291 HB3 PRO 43 2HB PRO 43 20.377 13.194 -18.081
292 HG2 PRO 43 1HG PRO 43 20.267 11.485 -15.626
293 HG3 PRO 43 2HG PRO 43 21.574 12.537 -16.198
294 HD2 PRO 43 1HD PRO 43 19.854 13.282 -14.244
295 HD3 PRO 43 2HD PRO 43 20.566 14.443 -15.383
296 H SER 44 H SER 44 17.555 11.559 -18.977
297 HA SER 44 HA SER 44 16.021 9.863 -17.125
298 HB2 SER 44 1HB SER 44 15.063 11.070 -19.725
299 HB3 SER 44 2HB SER 44 14.243 9.731 -18.922
300 HG SER 44 HG SER 44 13.572 11.043 -17.376
301 H SER 45 H SER 45 16.885 10.071 -20.583
302 HA SER 45 HA SER 45 16.781 7.490 -21.344
303 HB2 SER 45 1HB SER 45 18.652 7.943 -22.902
304 HB3 SER 45 2HB SER 45 17.494 9.272 -22.857
305 HG SER 45 HG SER 45 20.092 9.370 -22.396
306 H GLY 46 H GLY 46 17.983 5.629 -21.182
307 HA2 GLY 46 1HA GLY 46 20.041 4.487 -20.603
308 HA3 GLY 46 2HA GLY 46 20.303 5.703 -19.361
Start of MODEL 19
1 H1 GLY 1 H GLY 1 1.134 -23.396 -3.770
2 HA2 GLY 1 1HA GLY 1 2.719 -22.372 -1.703
3 HA3 GLY 1 2HA GLY 1 1.955 -21.011 -2.512
4 H SER 2 H SER 2 1.669 -22.638 0.161
5 HA SER 2 HA SER 2 -1.273 -22.793 0.063
6 HB2 SER 2 1HB SER 2 0.612 -24.286 1.903
7 HB3 SER 2 2HB SER 2 -1.146 -24.423 1.894
8 HG SER 2 HG SER 2 0.704 -25.263 -0.067
9 H SER 3 H SER 3 -1.633 -20.644 0.613
10 HA SER 3 HA SER 3 -0.440 -19.555 3.021
11 HB2 SER 3 1HB SER 3 -2.260 -18.468 0.890
12 HB3 SER 3 2HB SER 3 -2.040 -17.597 2.407
13 HG SER 3 HG SER 3 -0.335 -16.827 1.449
14 H GLY 4 H GLY 4 -3.686 -20.436 1.869
15 HA2 GLY 4 1HA GLY 4 -5.290 -21.512 3.259
16 HA3 GLY 4 2HA GLY 4 -4.479 -20.840 4.666
17 H SER 5 H SER 5 -6.182 -19.726 1.739
18 HA SER 5 HA SER 5 -7.048 -17.318 3.076
19 HB2 SER 5 1HB SER 5 -6.475 -17.319 0.666
20 HB3 SER 5 2HB SER 5 -7.831 -18.405 0.360
21 HG SER 5 HG SER 5 -8.460 -16.119 1.769
22 H SER 6 H SER 6 -8.805 -17.145 4.286
23 HA SER 6 HA SER 6 -10.680 -19.323 4.474
24 HB2 SER 6 1HB SER 6 -10.275 -16.732 5.926
25 HB3 SER 6 2HB SER 6 -11.805 -17.591 6.098
26 HG SER 6 HG SER 6 -10.702 -18.595 7.604
27 H GLY 7 H GLY 7 -11.595 -19.302 2.361
28 HA2 GLY 7 1HA GLY 7 -13.931 -18.728 1.670
29 HA3 GLY 7 2HA GLY 7 -13.457 -17.052 1.902
30 H THR 8 H THR 8 -14.516 -18.118 -0.497
31 HA THR 8 HA THR 8 -12.249 -18.362 -2.315
32 HB THR 8 HB THR 8 -14.213 -19.855 -2.601
33 HG1 THR 8 HG1 THR 8 -14.382 -19.445 -4.893
34 HG21 THR 8 3HG2 THR 8 -16.175 -18.647 -3.835
35 HG22 THR 8 1HG2 THR 8 -15.594 -17.228 -2.966
36 HG23 THR 8 2HG2 THR 8 -16.118 -18.656 -2.073
37 H GLY 9 H GLY 9 -12.493 -15.860 -1.022
38 HA2 GLY 9 1HA GLY 9 -13.122 -14.152 -3.347
39 HA3 GLY 9 2HA GLY 9 -13.583 -13.684 -1.717
40 H GLY 10 H GLY 10 -12.213 -11.810 -2.799
41 HA2 GLY 10 1HA GLY 10 -10.151 -11.070 -1.332
42 HA3 GLY 10 2HA GLY 10 -9.350 -12.235 -2.376
43 H LYS 11 H LYS 11 -11.357 -9.308 -2.469
44 HA LYS 11 HA LYS 11 -10.445 -8.694 -5.156
45 HB2 LYS 11 1HB LYS 11 -12.488 -7.597 -3.288
46 HB3 LYS 11 2HB LYS 11 -11.831 -6.509 -4.504
47 HG2 LYS 11 1HG LYS 11 -12.750 -7.681 -6.251
48 HG3 LYS 11 2HG LYS 11 -12.821 -9.192 -5.340
49 HD2 LYS 11 1HD LYS 11 -14.765 -8.595 -4.249
50 HD3 LYS 11 2HD LYS 11 -14.473 -6.866 -4.455
51 HE2 LYS 11 1HE LYS 11 -14.742 -7.441 -6.998
52 HE3 LYS 11 2HE LYS 11 -15.599 -8.852 -6.379
53 HZ1 LYS 11 3HZ LYS 11 -16.261 -6.016 -5.795
54 HZ2 LYS 11 1HZ LYS 11 -17.067 -7.359 -5.154
55 HZ3 LYS 11 2HZ LYS 11 -17.127 -7.051 -6.816
56 H HIS 12 H HIS 12 -8.352 -8.809 -3.312
57 HA HIS 12 HA HIS 12 -7.676 -6.166 -2.415
58 HB2 HIS 12 1HB HIS 12 -5.801 -7.121 -1.443
59 HB3 HIS 12 2HB HIS 12 -6.914 -8.485 -1.472
60 HD1 HIS 12 HD1 HIS 12 -6.119 -10.549 -2.623
61 HD2 HIS 12 HD2 HIS 12 -3.845 -7.216 -3.615
62 HE1 HIS 12 HE1 HIS 12 -4.201 -11.427 -3.992
63 H PHE 13 H PHE 13 -6.654 -4.614 -3.504
64 HA PHE 13 HA PHE 13 -5.700 -5.219 -6.204
65 HB2 PHE 13 1HB PHE 13 -6.297 -2.577 -4.857
66 HB3 PHE 13 2HB PHE 13 -5.734 -2.752 -6.516
67 HD1 PHE 13 HD2 PHE 13 -8.504 -3.678 -4.228
68 HD2 PHE 13 HD1 PHE 13 -7.247 -3.086 -8.252
69 HE1 PHE 13 HE2 PHE 13 -10.832 -3.917 -4.987
70 HE2 PHE 13 HE1 PHE 13 -9.573 -3.323 -9.017
71 HZ PHE 13 HZ PHE 13 -11.369 -3.740 -7.384
72 H GLU 14 H GLU 14 -3.604 -5.395 -6.615
73 HA GLU 14 HA GLU 14 -1.688 -4.466 -4.603
74 HB2 GLU 14 1HB GLU 14 -1.625 -6.847 -5.353
75 HB3 GLU 14 2HB GLU 14 -1.213 -6.287 -6.967
76 HG2 GLU 14 1HG GLU 14 0.827 -5.254 -6.066
77 HG3 GLU 14 2HG GLU 14 0.422 -5.889 -4.473
78 H CYS 15 H CYS 15 -0.289 -2.854 -4.973
79 HA CYS 15 HA CYS 15 -0.646 -1.061 -7.086
80 HB2 CYS 15 1HB CYS 15 0.396 -0.520 -4.881
81 HB3 CYS 15 2HB CYS 15 1.841 -1.384 -5.396
82 H THR 16 H THR 16 0.044 -1.031 -9.120
83 HA THR 16 HA THR 16 1.725 -3.174 -10.090
84 HB THR 16 HB THR 16 0.733 -0.881 -11.766
85 HG1 THR 16 HG1 THR 16 -0.946 -2.001 -10.384
86 HG21 THR 16 3HG2 THR 16 0.976 -2.321 -13.567
87 HG22 THR 16 1HG2 THR 16 0.875 -3.764 -12.559
88 HG23 THR 16 2HG2 THR 16 2.338 -2.779 -12.545
89 H GLU 17 H GLU 17 2.795 -0.946 -8.357
90 HA GLU 17 HA GLU 17 4.973 -0.117 -10.160
91 HB2 GLU 17 1HB GLU 17 3.815 1.448 -7.846
92 HB3 GLU 17 2HB GLU 17 5.202 1.934 -8.811
93 HG2 GLU 17 1HG GLU 17 3.785 2.063 -10.792
94 HG3 GLU 17 2HG GLU 17 2.394 1.567 -9.830
95 H CYS 18 H CYS 18 4.143 -0.578 -6.725
96 HA CYS 18 HA CYS 18 6.919 -1.432 -6.249
97 HB2 CYS 18 1HB CYS 18 6.592 -0.852 -3.925
98 HB3 CYS 18 2HB CYS 18 6.109 0.514 -4.924
99 H GLY 19 H GLY 19 3.535 -2.281 -5.724
100 HA2 GLY 19 1HA GLY 19 2.930 -4.632 -5.960
101 HA3 GLY 19 2HA GLY 19 4.424 -5.033 -5.124
102 H LYS 20 H LYS 20 2.598 -2.354 -3.956
103 HA LYS 20 HA LYS 20 2.154 -3.704 -1.448
104 HB2 LYS 20 1HB LYS 20 2.828 -1.254 -1.758
105 HB3 LYS 20 2HB LYS 20 1.151 -0.963 -2.200
106 HG2 LYS 20 1HG LYS 20 0.389 -1.269 -0.077
107 HG3 LYS 20 2HG LYS 20 1.683 -2.392 0.345
108 HD2 LYS 20 1HD LYS 20 3.270 -0.488 0.356
109 HD3 LYS 20 2HD LYS 20 1.916 0.603 0.054
110 HE2 LYS 20 1HE LYS 20 0.922 -0.612 2.176
111 HE3 LYS 20 2HE LYS 20 2.625 -0.926 2.509
112 HZ1 LYS 20 3HZ LYS 20 1.975 1.103 3.570
113 HZ2 LYS 20 1HZ LYS 20 1.355 1.730 2.127
114 HZ3 LYS 20 2HZ LYS 20 3.020 1.485 2.296
115 H ALA 21 H ALA 21 0.380 -4.769 -0.882
116 HA ALA 21 HA ALA 21 -1.955 -4.679 -2.617
117 HB1 ALA 21 3HB ALA 21 -1.575 -6.421 -0.194
118 HB2 ALA 21 1HB ALA 21 -2.667 -6.669 -1.557
119 HB3 ALA 21 2HB ALA 21 -0.925 -6.829 -1.782
120 H PHE 22 H PHE 22 -3.799 -3.661 -2.149
121 HA PHE 22 HA PHE 22 -4.179 -2.668 0.599
122 HB2 PHE 22 1HB PHE 22 -5.005 -1.275 -1.957
123 HB3 PHE 22 2HB PHE 22 -5.231 -0.666 -0.320
124 HD1 PHE 22 HD2 PHE 22 -2.748 -1.412 -2.928
125 HD2 PHE 22 HD1 PHE 22 -3.458 0.381 0.866
126 HE1 PHE 22 HE2 PHE 22 -0.547 -0.317 -3.038
127 HE2 PHE 22 HE1 PHE 22 -1.258 1.479 0.762
128 HZ PHE 22 HZ PHE 22 0.200 1.130 -1.191
129 H THR 23 H THR 23 -6.139 -2.966 1.522
130 HA THR 23 HA THR 23 -7.964 -4.776 0.218
131 HB THR 23 HB THR 23 -7.429 -4.981 2.634
132 HG1 THR 23 HG1 THR 23 -10.167 -4.409 2.576
133 HG21 THR 23 3HG2 THR 23 -9.268 -2.705 3.218
134 HG22 THR 23 1HG2 THR 23 -7.575 -2.363 2.863
135 HG23 THR 23 2HG2 THR 23 -7.998 -3.410 4.218
136 H ARG 24 H ARG 24 -7.562 -1.682 -0.329
137 HA ARG 24 HA ARG 24 -10.402 -1.231 -0.855
138 HB2 ARG 24 1HB ARG 24 -8.639 0.467 0.856
139 HB3 ARG 24 2HB ARG 24 -9.841 1.257 -0.156
140 HG2 ARG 24 1HG ARG 24 -11.623 0.128 0.932
141 HG3 ARG 24 2HG ARG 24 -10.506 -0.942 1.782
142 HD2 ARG 24 1HD ARG 24 -9.831 0.711 3.248
143 HD3 ARG 24 2HD ARG 24 -10.295 2.013 2.153
144 HE ARG 24 HE ARG 24 -12.546 0.505 3.047
145 HH11 ARG 24 1HH1 ARG 24 -10.321 3.028 3.945
146 HH12 ARG 24 2HH1 ARG 24 -11.423 3.788 5.044
147 HH21 ARG 24 1HH2 ARG 24 -14.007 1.498 4.491
148 HH22 ARG 24 2HH2 ARG 24 -13.519 2.917 5.355
149 H LYS 25 H LYS 25 -10.461 -1.043 -2.994
150 HA LYS 25 HA LYS 25 -8.394 -0.479 -4.716
151 HB2 LYS 25 1HB LYS 25 -10.662 -1.344 -5.339
152 HB3 LYS 25 2HB LYS 25 -11.278 0.296 -5.180
153 HG2 LYS 25 1HG LYS 25 -9.609 0.987 -6.921
154 HG3 LYS 25 2HG LYS 25 -9.271 -0.728 -7.171
155 HD2 LYS 25 1HD LYS 25 -11.892 -0.861 -7.415
156 HD3 LYS 25 2HD LYS 25 -11.716 0.848 -7.820
157 HE2 LYS 25 1HE LYS 25 -10.206 0.316 -9.618
158 HE3 LYS 25 2HE LYS 25 -10.192 -1.385 -9.155
159 HZ1 LYS 25 3HZ LYS 25 -12.554 0.117 -10.148
160 HZ2 LYS 25 1HZ LYS 25 -12.543 -1.514 -9.699
161 HZ3 LYS 25 2HZ LYS 25 -11.648 -1.000 -11.038
162 H SER 26 H SER 26 -10.648 1.796 -3.207
163 HA SER 26 HA SER 26 -9.716 4.101 -4.550
164 HB2 SER 26 1HB SER 26 -10.982 5.361 -2.939
165 HB3 SER 26 2HB SER 26 -11.899 3.901 -3.313
166 HG SER 26 HG SER 26 -11.634 4.510 -1.009
167 H THR 27 H THR 27 -8.834 2.598 -1.475
168 HA THR 27 HA THR 27 -7.134 4.581 -0.496
169 HB THR 27 HB THR 27 -6.891 1.588 -0.131
170 HG1 THR 27 HG1 THR 27 -8.717 3.348 0.726
171 HG21 THR 27 3HG2 THR 27 -5.696 2.184 1.950
172 HG22 THR 27 1HG2 THR 27 -5.732 3.878 1.462
173 HG23 THR 27 2HG2 THR 27 -4.832 2.703 0.503
174 H LEU 28 H LEU 28 -6.268 1.656 -2.348
175 HA LEU 28 HA LEU 28 -3.557 2.093 -2.595
176 HB2 LEU 28 1HB LEU 28 -4.235 0.040 -3.372
177 HB3 LEU 28 2HB LEU 28 -5.590 0.712 -4.277
178 HG LEU 28 HG LEU 28 -3.960 1.594 -5.941
179 HD11 LEU 28 1HD1 LEU 28 -1.715 1.224 -5.833
180 HD12 LEU 28 2HD1 LEU 28 -1.887 -0.238 -4.862
181 HD13 LEU 28 3HD1 LEU 28 -2.071 1.347 -4.110
182 HD21 LEU 28 3HD2 LEU 28 -3.209 -1.105 -6.253
183 HD22 LEU 28 1HD2 LEU 28 -4.544 -0.249 -7.026
184 HD23 LEU 28 2HD2 LEU 28 -4.805 -1.099 -5.502
185 H SER 29 H SER 29 -6.104 3.134 -4.860
186 HA SER 29 HA SER 29 -4.639 4.392 -6.776
187 HB2 SER 29 1HB SER 29 -7.235 4.212 -6.421
188 HB3 SER 29 2HB SER 29 -7.053 5.814 -5.706
189 HG SER 29 HG SER 29 -5.790 5.413 -8.140
190 H MET 30 H MET 30 -5.275 5.522 -3.521
191 HA MET 30 HA MET 30 -4.201 8.149 -3.969
192 HB2 MET 30 1HB MET 30 -4.851 6.664 -1.418
193 HB3 MET 30 2HB MET 30 -4.354 8.349 -1.490
194 HG2 MET 30 1HG MET 30 -6.369 8.614 -3.094
195 HG3 MET 30 2HG MET 30 -6.907 7.092 -2.387
196 HE1 MET 30 3HE MET 30 -9.319 8.666 -1.186
197 HE2 MET 30 1HE MET 30 -8.539 7.091 -1.040
198 HE3 MET 30 2HE MET 30 -8.856 8.054 0.403
199 H HIS 31 H HIS 31 -2.987 5.061 -2.877
200 HA HIS 31 HA HIS 31 -0.535 6.052 -1.803
201 HB2 HIS 31 1HB HIS 31 -0.997 3.973 -0.935
202 HB3 HIS 31 2HB HIS 31 -1.662 3.369 -2.450
203 HD1 HIS 31 HD1 HIS 31 1.589 3.863 -0.646
204 HD2 HIS 31 HD2 HIS 31 0.166 2.136 -4.146
205 HE1 HIS 31 HE1 HIS 31 3.503 2.508 -1.553
206 H GLN 32 H GLN 32 -1.459 4.572 -4.893
207 HA GLN 32 HA GLN 32 0.990 4.345 -6.110
208 HB2 GLN 32 1HB GLN 32 -1.603 5.240 -7.381
209 HB3 GLN 32 2HB GLN 32 -0.199 4.646 -8.258
210 HG2 GLN 32 1HG GLN 32 -0.478 2.547 -6.755
211 HG3 GLN 32 2HG GLN 32 -2.116 3.158 -6.525
212 HE21 GLN 32 1HE2 GLN 32 -3.409 1.965 -7.731
213 HE22 GLN 32 2HE2 GLN 32 -3.160 1.560 -9.392
214 H LYS 33 H LYS 33 -0.870 7.239 -5.503
215 HA LYS 33 HA LYS 33 0.288 9.046 -7.239
216 HB2 LYS 33 1HB LYS 33 -0.734 9.360 -4.425
217 HB3 LYS 33 2HB LYS 33 -0.119 10.730 -5.339
218 HG2 LYS 33 1HG LYS 33 -1.805 10.017 -7.143
219 HG3 LYS 33 2HG LYS 33 -2.548 9.061 -5.858
220 HD2 LYS 33 1HD LYS 33 -1.918 11.908 -5.285
221 HD3 LYS 33 2HD LYS 33 -3.279 11.565 -6.356
222 HE2 LYS 33 1HE LYS 33 -3.090 10.025 -3.825
223 HE3 LYS 33 2HE LYS 33 -3.545 11.724 -3.713
224 HZ1 LYS 33 3HZ LYS 33 -4.948 10.240 -5.755
225 HZ2 LYS 33 1HZ LYS 33 -5.544 11.326 -4.603
226 HZ3 LYS 33 2HZ LYS 33 -5.261 9.713 -4.178
227 H ILE 34 H ILE 34 1.615 7.603 -4.356
228 HA ILE 34 HA ILE 34 3.731 9.400 -3.897
229 HB ILE 34 HB ILE 34 4.640 7.818 -2.443
230 HG12 ILE 34 1HG1 ILE 34 3.202 5.647 -3.985
231 HG13 ILE 34 2HG1 ILE 34 4.915 6.026 -4.129
232 HG21 ILE 34 1HG2 ILE 34 1.807 8.113 -2.536
233 HG22 ILE 34 2HG2 ILE 34 2.193 6.497 -1.946
234 HG23 ILE 34 3HG2 ILE 34 2.854 7.915 -1.131
235 HD11 ILE 34 3HD1 ILE 34 5.045 5.547 -1.628
236 HD12 ILE 34 1HD1 ILE 34 3.454 4.812 -1.817
237 HD13 ILE 34 2HD1 ILE 34 4.832 4.178 -2.718
238 H HIS 35 H HIS 35 3.325 6.792 -6.172
239 HA HIS 35 HA HIS 35 6.118 6.673 -6.883
240 HB2 HIS 35 1HB HIS 35 3.647 5.435 -8.104
241 HB3 HIS 35 2HB HIS 35 5.272 5.182 -8.734
242 HD1 HIS 35 HD1 HIS 35 6.980 4.333 -6.612
243 HD2 HIS 35 HD2 HIS 35 2.930 3.416 -6.477
244 HE1 HIS 35 HE1 HIS 35 6.783 2.386 -5.032
245 H THR 36 H THR 36 3.178 8.126 -8.165
246 HA THR 36 HA THR 36 4.669 9.251 -10.418
247 HB THR 36 HB THR 36 2.506 8.245 -10.950
248 HG1 THR 36 HG1 THR 36 3.146 10.050 -12.190
249 HG21 THR 36 3HG2 THR 36 1.419 10.295 -9.020
250 HG22 THR 36 1HG2 THR 36 1.308 8.540 -8.891
251 HG23 THR 36 2HG2 THR 36 0.424 9.388 -10.160
252 H GLY 37 H GLY 37 4.605 10.079 -7.407
253 HA2 GLY 37 1HA GLY 37 4.231 12.957 -7.963
254 HA3 GLY 37 2HA GLY 37 3.741 12.231 -6.439
255 H GLU 38 H GLU 38 5.300 11.673 -4.911
256 HA GLU 38 HA GLU 38 7.858 13.043 -5.288
257 HB2 GLU 38 1HB GLU 38 8.084 12.825 -2.833
258 HB3 GLU 38 2HB GLU 38 6.622 13.679 -3.307
259 HG2 GLU 38 1HG GLU 38 5.260 11.806 -2.815
260 HG3 GLU 38 2HG GLU 38 6.662 10.752 -2.635
261 H LYS 39 H LYS 39 9.769 12.014 -5.361
262 HA LYS 39 HA LYS 39 9.960 9.225 -4.529
263 HB2 LYS 39 1HB LYS 39 11.043 8.583 -6.669
264 HB3 LYS 39 2HB LYS 39 9.347 9.012 -6.855
265 HG2 LYS 39 1HG LYS 39 9.914 11.138 -7.783
266 HG3 LYS 39 2HG LYS 39 11.623 10.900 -7.412
267 HD2 LYS 39 1HD LYS 39 11.368 10.447 -9.725
268 HD3 LYS 39 2HD LYS 39 11.547 8.882 -8.928
269 HE2 LYS 39 1HE LYS 39 8.927 8.978 -8.850
270 HE3 LYS 39 2HE LYS 39 9.136 10.121 -10.175
271 HZ1 LYS 39 3HZ LYS 39 8.893 8.014 -11.154
272 HZ2 LYS 39 1HZ LYS 39 9.973 7.283 -10.076
273 HZ3 LYS 39 2HZ LYS 39 10.547 8.356 -11.249
274 HA PRO 40 HA PRO 40 13.951 10.433 -3.153
275 HB2 PRO 40 1HB PRO 40 15.285 8.074 -3.317
276 HB3 PRO 40 2HB PRO 40 14.061 8.401 -2.085
277 HG2 PRO 40 1HG PRO 40 13.804 6.888 -4.655
278 HG3 PRO 40 2HG PRO 40 13.161 6.488 -3.052
279 HD2 PRO 40 1HD PRO 40 11.638 7.596 -4.997
280 HD3 PRO 40 2HD PRO 40 11.371 7.923 -3.272
281 H SER 41 H SER 41 16.174 10.689 -3.797
282 HA SER 41 HA SER 41 16.712 11.696 -6.202
283 HB2 SER 41 1HB SER 41 18.503 10.059 -4.422
284 HB3 SER 41 2HB SER 41 19.112 10.769 -5.916
285 HG SER 41 HG SER 41 18.692 12.787 -5.127
286 H GLY 42 H GLY 42 17.588 8.298 -5.530
287 HA2 GLY 42 1HA GLY 42 17.481 7.766 -8.410
288 HA3 GLY 42 2HA GLY 42 18.215 6.731 -7.195
289 HA PRO 43 HA PRO 43 14.098 4.947 -8.429
290 HB2 PRO 43 1HB PRO 43 15.041 2.443 -8.891
291 HB3 PRO 43 2HB PRO 43 15.026 3.707 -10.126
292 HG2 PRO 43 1HG PRO 43 17.283 2.781 -8.393
293 HG3 PRO 43 2HG PRO 43 17.289 3.172 -10.122
294 HD2 PRO 43 1HD PRO 43 18.191 4.893 -8.236
295 HD3 PRO 43 2HD PRO 43 17.417 5.441 -9.737
296 H SER 44 H SER 44 12.778 3.725 -7.123
297 HA SER 44 HA SER 44 13.989 2.745 -4.623
298 HB2 SER 44 1HB SER 44 11.932 3.275 -3.490
299 HB3 SER 44 2HB SER 44 12.412 4.693 -4.421
300 HG SER 44 HG SER 44 10.590 2.752 -5.388
301 H SER 45 H SER 45 13.822 0.650 -4.168
302 HA SER 45 HA SER 45 11.664 -0.926 -5.362
303 HB2 SER 45 1HB SER 45 13.958 -0.981 -6.669
304 HB3 SER 45 2HB SER 45 14.416 -2.101 -5.387
305 HG SER 45 HG SER 45 12.011 -2.803 -6.230
306 H GLY 46 H GLY 46 10.947 -2.596 -4.107
307 HA2 GLY 46 1HA GLY 46 11.823 -4.242 -2.330
308 HA3 GLY 46 2HA GLY 46 12.157 -2.772 -1.428
Start of MODEL 20
1 H1 GLY 1 H GLY 1 -17.081 -25.798 -18.045
2 HA2 GLY 1 1HA GLY 1 -15.091 -27.727 -17.707
3 HA3 GLY 1 2HA GLY 1 -14.300 -26.157 -17.701
4 H SER 2 H SER 2 -15.400 -24.509 -16.212
5 HA SER 2 HA SER 2 -15.658 -25.780 -13.607
6 HB2 SER 2 1HB SER 2 -14.200 -23.701 -14.174
7 HB3 SER 2 2HB SER 2 -15.718 -22.809 -14.066
8 HG SER 2 HG SER 2 -15.194 -22.772 -12.017
9 H SER 3 H SER 3 -17.350 -25.220 -12.121
10 HA SER 3 HA SER 3 -19.919 -24.967 -13.462
11 HB2 SER 3 1HB SER 3 -20.841 -25.540 -11.199
12 HB3 SER 3 2HB SER 3 -19.746 -26.757 -11.856
13 HG SER 3 HG SER 3 -19.098 -24.762 -9.940
14 H GLY 4 H GLY 4 -18.707 -22.605 -13.708
15 HA2 GLY 4 1HA GLY 4 -20.421 -20.693 -12.894
16 HA3 GLY 4 2HA GLY 4 -19.363 -20.851 -11.499
17 H SER 5 H SER 5 -17.779 -19.419 -11.445
18 HA SER 5 HA SER 5 -16.080 -18.921 -13.677
19 HB2 SER 5 1HB SER 5 -16.604 -16.635 -14.138
20 HB3 SER 5 2HB SER 5 -18.125 -17.523 -14.218
21 HG SER 5 HG SER 5 -17.945 -15.441 -12.926
22 H SER 6 H SER 6 -14.128 -18.511 -12.885
23 HA SER 6 HA SER 6 -13.501 -18.399 -10.211
24 HB2 SER 6 1HB SER 6 -11.280 -17.660 -10.876
25 HB3 SER 6 2HB SER 6 -11.875 -18.845 -12.039
26 HG SER 6 HG SER 6 -12.148 -17.284 -13.518
27 H GLY 7 H GLY 7 -14.455 -16.980 -8.862
28 HA2 GLY 7 1HA GLY 7 -13.556 -14.380 -8.583
29 HA3 GLY 7 2HA GLY 7 -15.021 -14.274 -9.548
30 H THR 8 H THR 8 -14.340 -16.558 -6.940
31 HA THR 8 HA THR 8 -16.568 -15.355 -5.430
32 HB THR 8 HB THR 8 -17.056 -17.632 -6.287
33 HG1 THR 8 HG1 THR 8 -18.120 -17.107 -4.415
34 HG21 THR 8 3HG2 THR 8 -15.274 -19.012 -6.333
35 HG22 THR 8 1HG2 THR 8 -15.729 -19.368 -4.668
36 HG23 THR 8 2HG2 THR 8 -14.469 -18.180 -5.003
37 H GLY 9 H GLY 9 -13.909 -14.432 -5.166
38 HA2 GLY 9 1HA GLY 9 -13.390 -15.245 -2.379
39 HA3 GLY 9 2HA GLY 9 -12.066 -15.104 -3.526
40 H GLY 10 H GLY 10 -11.257 -13.585 -1.859
41 HA2 GLY 10 1HA GLY 10 -12.630 -11.029 -1.685
42 HA3 GLY 10 2HA GLY 10 -11.146 -11.477 -0.856
43 H LYS 11 H LYS 11 -12.317 -9.392 -3.025
44 HA LYS 11 HA LYS 11 -10.217 -9.501 -5.002
45 HB2 LYS 11 1HB LYS 11 -11.250 -7.419 -5.858
46 HB3 LYS 11 2HB LYS 11 -12.409 -8.731 -5.685
47 HG2 LYS 11 1HG LYS 11 -13.119 -7.742 -3.520
48 HG3 LYS 11 2HG LYS 11 -12.052 -6.375 -3.847
49 HD2 LYS 11 1HD LYS 11 -13.306 -5.997 -5.971
50 HD3 LYS 11 2HD LYS 11 -14.436 -7.258 -5.472
51 HE2 LYS 11 1HE LYS 11 -15.486 -5.299 -4.789
52 HE3 LYS 11 2HE LYS 11 -14.695 -5.865 -3.319
53 HZ1 LYS 11 3HZ LYS 11 -12.789 -4.322 -4.378
54 HZ2 LYS 11 1HZ LYS 11 -13.929 -3.773 -3.254
55 HZ3 LYS 11 2HZ LYS 11 -14.171 -3.501 -4.906
56 H HIS 12 H HIS 12 -8.274 -8.613 -4.815
57 HA HIS 12 HA HIS 12 -7.916 -6.379 -2.930
58 HB2 HIS 12 1HB HIS 12 -6.984 -8.788 -2.323
59 HB3 HIS 12 2HB HIS 12 -5.671 -8.292 -3.387
60 HD1 HIS 12 HD1 HIS 12 -6.276 -8.443 0.011
61 HD2 HIS 12 HD2 HIS 12 -4.964 -5.373 -2.462
62 HE1 HIS 12 HE1 HIS 12 -5.097 -6.818 1.525
63 H PHE 13 H PHE 13 -6.649 -4.708 -3.600
64 HA PHE 13 HA PHE 13 -5.719 -4.835 -6.385
65 HB2 PHE 13 1HB PHE 13 -6.373 -2.433 -4.665
66 HB3 PHE 13 2HB PHE 13 -5.831 -2.367 -6.339
67 HD1 PHE 13 HD2 PHE 13 -8.491 -3.987 -4.285
68 HD2 PHE 13 HD1 PHE 13 -7.425 -2.142 -7.969
69 HE1 PHE 13 HE2 PHE 13 -10.826 -4.158 -5.042
70 HE2 PHE 13 HE1 PHE 13 -9.759 -2.309 -8.732
71 HZ PHE 13 HZ PHE 13 -11.462 -3.319 -7.268
72 H GLU 14 H GLU 14 -3.611 -4.934 -6.750
73 HA GLU 14 HA GLU 14 -1.771 -4.149 -4.595
74 HB2 GLU 14 1HB GLU 14 -1.766 -6.524 -5.551
75 HB3 GLU 14 2HB GLU 14 -1.066 -5.819 -7.001
76 HG2 GLU 14 1HG GLU 14 0.854 -5.066 -5.779
77 HG3 GLU 14 2HG GLU 14 0.133 -5.576 -4.253
78 H CYS 15 H CYS 15 -0.009 -2.822 -5.003
79 HA CYS 15 HA CYS 15 -0.387 -0.897 -7.096
80 HB2 CYS 15 1HB CYS 15 0.455 -0.373 -4.774
81 HB3 CYS 15 2HB CYS 15 1.975 -1.137 -5.228
82 H THR 16 H THR 16 0.233 -1.232 -9.117
83 HA THR 16 HA THR 16 2.017 -3.263 -9.924
84 HB THR 16 HB THR 16 1.159 -0.828 -11.499
85 HG1 THR 16 HG1 THR 16 -0.415 -2.568 -10.550
86 HG21 THR 16 3HG2 THR 16 2.585 -1.630 -13.025
87 HG22 THR 16 1HG2 THR 16 1.470 -2.982 -13.212
88 HG23 THR 16 2HG2 THR 16 2.843 -3.117 -12.113
89 H GLU 17 H GLU 17 2.650 -0.321 -8.488
90 HA GLU 17 HA GLU 17 5.144 0.200 -9.878
91 HB2 GLU 17 1HB GLU 17 4.017 1.534 -7.411
92 HB3 GLU 17 2HB GLU 17 5.356 2.113 -8.393
93 HG2 GLU 17 1HG GLU 17 2.548 1.776 -9.413
94 HG3 GLU 17 2HG GLU 17 3.197 3.287 -8.778
95 H CYS 18 H CYS 18 4.261 -0.373 -6.467
96 HA CYS 18 HA CYS 18 6.956 -1.443 -6.018
97 HB2 CYS 18 1HB CYS 18 6.430 -1.168 -3.609
98 HB3 CYS 18 2HB CYS 18 6.320 0.344 -4.504
99 H GLY 19 H GLY 19 3.530 -2.215 -5.576
100 HA2 GLY 19 1HA GLY 19 2.835 -4.505 -6.058
101 HA3 GLY 19 2HA GLY 19 4.317 -5.047 -5.284
102 H LYS 20 H LYS 20 2.514 -2.448 -3.873
103 HA LYS 20 HA LYS 20 2.068 -4.026 -1.493
104 HB2 LYS 20 1HB LYS 20 2.767 -1.514 -1.678
105 HB3 LYS 20 2HB LYS 20 1.041 -1.233 -1.869
106 HG2 LYS 20 1HG LYS 20 0.562 -2.059 0.278
107 HG3 LYS 20 2HG LYS 20 2.161 -2.789 0.441
108 HD2 LYS 20 1HD LYS 20 3.160 -0.534 0.437
109 HD3 LYS 20 2HD LYS 20 1.541 0.164 0.346
110 HE2 LYS 20 1HE LYS 20 2.198 0.239 2.626
111 HE3 LYS 20 2HE LYS 20 1.009 -1.054 2.478
112 HZ1 LYS 20 3HZ LYS 20 3.413 -1.303 3.661
113 HZ2 LYS 20 1HZ LYS 20 3.737 -1.913 2.116
114 HZ3 LYS 20 2HZ LYS 20 2.504 -2.593 3.052
115 H ALA 21 H ALA 21 0.210 -4.935 -0.860
116 HA ALA 21 HA ALA 21 -2.104 -4.688 -2.628
117 HB1 ALA 21 3HB ALA 21 -2.926 -6.698 -1.591
118 HB2 ALA 21 1HB ALA 21 -1.238 -6.934 -2.045
119 HB3 ALA 21 2HB ALA 21 -1.665 -6.625 -0.361
120 H PHE 22 H PHE 22 -3.880 -3.594 -2.093
121 HA PHE 22 HA PHE 22 -4.174 -2.713 0.703
122 HB2 PHE 22 1HB PHE 22 -5.091 -1.324 -1.824
123 HB3 PHE 22 2HB PHE 22 -5.374 -0.745 -0.185
124 HD1 PHE 22 HD2 PHE 22 -2.723 -1.506 -2.653
125 HD2 PHE 22 HD1 PHE 22 -3.760 0.521 0.944
126 HE1 PHE 22 HE2 PHE 22 -0.572 -0.314 -2.708
127 HE2 PHE 22 HE1 PHE 22 -1.610 1.717 0.893
128 HZ PHE 22 HZ PHE 22 -0.013 1.300 -0.934
129 H THR 23 H THR 23 -6.070 -3.054 1.735
130 HA THR 23 HA THR 23 -7.851 -5.009 0.745
131 HB THR 23 HB THR 23 -8.235 -3.110 3.068
132 HG1 THR 23 HG1 THR 23 -7.596 -5.779 3.484
133 HG21 THR 23 3HG2 THR 23 -9.784 -5.446 2.054
134 HG22 THR 23 1HG2 THR 23 -10.356 -3.948 2.788
135 HG23 THR 23 2HG2 THR 23 -9.654 -5.212 3.797
136 H ARG 24 H ARG 24 -7.600 -1.794 -0.044
137 HA ARG 24 HA ARG 24 -10.288 -1.799 -1.185
138 HB2 ARG 24 1HB ARG 24 -9.204 0.527 0.416
139 HB3 ARG 24 2HB ARG 24 -10.745 0.477 -0.431
140 HG2 ARG 24 1HG ARG 24 -11.731 -0.842 1.144
141 HG3 ARG 24 2HG ARG 24 -10.211 -1.607 1.613
142 HD2 ARG 24 1HD ARG 24 -11.016 1.229 2.250
143 HD3 ARG 24 2HD ARG 24 -11.093 -0.131 3.370
144 HE ARG 24 HE ARG 24 -8.483 0.312 2.242
145 HH11 ARG 24 1HH1 ARG 24 -10.687 1.148 4.804
146 HH12 ARG 24 2HH1 ARG 24 -9.436 1.644 5.895
147 HH21 ARG 24 1HH2 ARG 24 -6.827 0.962 3.669
148 HH22 ARG 24 2HH2 ARG 24 -7.241 1.539 5.248
149 H LYS 25 H LYS 25 -10.398 -0.879 -3.167
150 HA LYS 25 HA LYS 25 -7.967 -0.293 -4.529
151 HB2 LYS 25 1HB LYS 25 -9.805 -1.341 -5.710
152 HB3 LYS 25 2HB LYS 25 -10.853 0.029 -5.369
153 HG2 LYS 25 1HG LYS 25 -8.330 0.546 -6.842
154 HG3 LYS 25 2HG LYS 25 -9.644 -0.266 -7.697
155 HD2 LYS 25 1HD LYS 25 -10.081 2.272 -6.148
156 HD3 LYS 25 2HD LYS 25 -9.549 2.285 -7.831
157 HE2 LYS 25 1HE LYS 25 -11.539 1.398 -8.602
158 HE3 LYS 25 2HE LYS 25 -11.939 0.674 -7.045
159 HZ1 LYS 25 3HZ LYS 25 -11.893 3.312 -6.479
160 HZ2 LYS 25 1HZ LYS 25 -13.288 2.421 -6.827
161 HZ3 LYS 25 2HZ LYS 25 -12.525 3.307 -8.048
162 H SER 26 H SER 26 -10.474 1.636 -3.046
163 HA SER 26 HA SER 26 -9.789 4.111 -4.245
164 HB2 SER 26 1HB SER 26 -11.091 5.107 -2.361
165 HB3 SER 26 2HB SER 26 -11.960 3.829 -3.210
166 HG SER 26 HG SER 26 -11.942 2.662 -1.457
167 H THR 27 H THR 27 -8.811 2.521 -1.243
168 HA THR 27 HA THR 27 -7.264 4.676 -0.245
169 HB THR 27 HB THR 27 -6.999 1.725 0.365
170 HG1 THR 27 HG1 THR 27 -9.078 2.565 0.855
171 HG21 THR 27 3HG2 THR 27 -6.097 4.127 1.958
172 HG22 THR 27 1HG2 THR 27 -5.035 3.071 1.027
173 HG23 THR 27 2HG2 THR 27 -5.914 2.435 2.418
174 H LEU 28 H LEU 28 -6.609 2.074 -2.473
175 HA LEU 28 HA LEU 28 -3.758 2.352 -2.405
176 HB2 LEU 28 1HB LEU 28 -4.326 0.259 -3.114
177 HB3 LEU 28 2HB LEU 28 -5.734 0.827 -4.010
178 HG LEU 28 HG LEU 28 -4.092 1.769 -5.705
179 HD11 LEU 28 1HD1 LEU 28 -2.038 -0.143 -5.129
180 HD12 LEU 28 2HD1 LEU 28 -2.239 0.954 -3.763
181 HD13 LEU 28 3HD1 LEU 28 -1.908 1.599 -5.371
182 HD21 LEU 28 3HD2 LEU 28 -5.036 -0.020 -6.671
183 HD22 LEU 28 1HD2 LEU 28 -4.880 -1.010 -5.219
184 HD23 LEU 28 2HD2 LEU 28 -3.507 -0.824 -6.312
185 H SER 29 H SER 29 -6.291 3.302 -4.716
186 HA SER 29 HA SER 29 -4.860 4.438 -6.716
187 HB2 SER 29 1HB SER 29 -7.445 4.381 -6.261
188 HB3 SER 29 2HB SER 29 -7.172 6.002 -5.622
189 HG SER 29 HG SER 29 -6.047 5.408 -8.097
190 H MET 30 H MET 30 -5.286 5.701 -3.484
191 HA MET 30 HA MET 30 -4.133 8.268 -4.089
192 HB2 MET 30 1HB MET 30 -4.780 6.920 -1.463
193 HB3 MET 30 2HB MET 30 -4.178 8.566 -1.606
194 HG2 MET 30 1HG MET 30 -6.231 8.867 -3.189
195 HG3 MET 30 2HG MET 30 -6.839 7.450 -2.336
196 HE1 MET 30 3HE MET 30 -6.696 7.276 0.253
197 HE2 MET 30 1HE MET 30 -7.428 8.559 1.217
198 HE3 MET 30 2HE MET 30 -8.339 7.816 -0.099
199 H HIS 31 H HIS 31 -3.029 5.192 -2.830
200 HA HIS 31 HA HIS 31 -0.505 6.100 -1.892
201 HB2 HIS 31 1HB HIS 31 -1.114 4.063 -0.964
202 HB3 HIS 31 2HB HIS 31 -1.705 3.424 -2.495
203 HD1 HIS 31 HD1 HIS 31 1.458 3.951 -0.546
204 HD2 HIS 31 HD2 HIS 31 0.188 2.113 -4.049
205 HE1 HIS 31 HE1 HIS 31 3.400 2.549 -1.312
206 H GLN 32 H GLN 32 -1.620 4.698 -4.941
207 HA GLN 32 HA GLN 32 0.808 4.301 -6.207
208 HB2 GLN 32 1HB GLN 32 -1.762 5.274 -7.467
209 HB3 GLN 32 2HB GLN 32 -0.417 4.526 -8.319
210 HG2 GLN 32 1HG GLN 32 -0.800 2.523 -6.773
211 HG3 GLN 32 2HG GLN 32 -2.350 3.277 -6.405
212 HE21 GLN 32 1HE2 GLN 32 -1.902 0.748 -7.673
213 HE22 GLN 32 2HE2 GLN 32 -2.608 0.837 -9.247
214 H LYS 33 H LYS 33 -0.730 7.248 -5.348
215 HA LYS 33 HA LYS 33 0.393 8.981 -7.261
216 HB2 LYS 33 1HB LYS 33 -0.576 9.421 -4.441
217 HB3 LYS 33 2HB LYS 33 0.029 10.734 -5.442
218 HG2 LYS 33 1HG LYS 33 -1.737 9.819 -7.153
219 HG3 LYS 33 2HG LYS 33 -2.477 9.153 -5.695
220 HD2 LYS 33 1HD LYS 33 -1.674 12.043 -5.911
221 HD3 LYS 33 2HD LYS 33 -3.255 11.463 -6.440
222 HE2 LYS 33 1HE LYS 33 -3.864 10.816 -4.267
223 HE3 LYS 33 2HE LYS 33 -2.200 10.886 -3.688
224 HZ1 LYS 33 3HZ LYS 33 -3.499 13.332 -4.679
225 HZ2 LYS 33 1HZ LYS 33 -2.249 13.165 -3.552
226 HZ3 LYS 33 2HZ LYS 33 -3.838 12.784 -3.115
227 H ILE 34 H ILE 34 1.719 7.435 -4.470
228 HA ILE 34 HA ILE 34 3.891 9.199 -4.010
229 HB ILE 34 HB ILE 34 4.745 7.608 -2.530
230 HG12 ILE 34 1HG1 ILE 34 3.192 5.480 -4.021
231 HG13 ILE 34 2HG1 ILE 34 4.924 5.764 -4.163
232 HG21 ILE 34 1HG2 ILE 34 1.912 8.007 -2.619
233 HG22 ILE 34 2HG2 ILE 34 2.267 6.416 -1.946
234 HG23 ILE 34 3HG2 ILE 34 2.973 7.859 -1.218
235 HD11 ILE 34 3HD1 ILE 34 4.578 3.900 -2.725
236 HD12 ILE 34 1HD1 ILE 34 5.137 5.253 -1.741
237 HD13 ILE 34 2HD1 ILE 34 3.430 4.805 -1.739
238 H HIS 35 H HIS 35 3.232 7.112 -6.554
239 HA HIS 35 HA HIS 35 6.081 6.812 -7.222
240 HB2 HIS 35 1HB HIS 35 3.684 5.337 -8.332
241 HB3 HIS 35 2HB HIS 35 5.360 5.059 -8.795
242 HD1 HIS 35 HD1 HIS 35 6.935 4.357 -6.609
243 HD2 HIS 35 HD2 HIS 35 2.844 3.671 -6.381
244 HE1 HIS 35 HE1 HIS 35 6.641 2.651 -4.786
245 H THR 36 H THR 36 3.038 8.143 -8.274
246 HA THR 36 HA THR 36 3.685 8.717 -10.946
247 HB THR 36 HB THR 36 1.949 10.566 -10.700
248 HG1 THR 36 HG1 THR 36 0.869 10.696 -8.766
249 HG21 THR 36 3HG2 THR 36 0.461 9.006 -11.283
250 HG22 THR 36 1HG2 THR 36 0.502 8.273 -9.681
251 HG23 THR 36 2HG2 THR 36 1.689 7.802 -10.897
252 H GLY 37 H GLY 37 4.200 10.549 -7.962
253 HA2 GLY 37 1HA GLY 37 6.246 11.879 -7.823
254 HA3 GLY 37 2HA GLY 37 5.976 12.343 -9.496
255 H GLU 38 H GLU 38 6.082 14.550 -8.938
256 HA GLU 38 HA GLU 38 3.889 15.552 -7.263
257 HB2 GLU 38 1HB GLU 38 6.260 16.236 -6.757
258 HB3 GLU 38 2HB GLU 38 6.274 17.090 -8.294
259 HG2 GLU 38 1HG GLU 38 4.501 18.544 -7.553
260 HG3 GLU 38 2HG GLU 38 4.349 17.640 -6.047
261 H LYS 39 H LYS 39 2.855 17.599 -7.990
262 HA LYS 39 HA LYS 39 2.061 17.330 -10.767
263 HB2 LYS 39 1HB LYS 39 1.067 19.217 -8.624
264 HB3 LYS 39 2HB LYS 39 0.337 18.988 -10.207
265 HG2 LYS 39 1HG LYS 39 0.639 16.768 -8.205
266 HG3 LYS 39 2HG LYS 39 -0.786 17.805 -8.297
267 HD2 LYS 39 1HD LYS 39 -0.865 17.136 -10.775
268 HD3 LYS 39 2HD LYS 39 0.249 15.844 -10.322
269 HE2 LYS 39 1HE LYS 39 -1.733 14.750 -10.043
270 HE3 LYS 39 2HE LYS 39 -1.552 15.441 -8.431
271 HZ1 LYS 39 3HZ LYS 39 -3.272 16.833 -8.741
272 HZ2 LYS 39 1HZ LYS 39 -3.742 15.713 -9.918
273 HZ3 LYS 39 2HZ LYS 39 -2.913 17.116 -10.369
274 HA PRO 40 HA PRO 40 4.714 20.520 -12.268
275 HB2 PRO 40 1HB PRO 40 3.412 21.043 -14.592
276 HB3 PRO 40 2HB PRO 40 4.390 19.592 -14.345
277 HG2 PRO 40 1HG PRO 40 1.420 19.925 -14.176
278 HG3 PRO 40 2HG PRO 40 2.359 18.618 -14.921
279 HD2 PRO 40 1HD PRO 40 1.222 18.384 -12.474
280 HD3 PRO 40 2HD PRO 40 2.742 17.573 -12.902
281 H SER 41 H SER 41 1.353 20.959 -11.611
282 HA SER 41 HA SER 41 1.391 23.810 -12.140
283 HB2 SER 41 1HB SER 41 -0.616 22.100 -12.356
284 HB3 SER 41 2HB SER 41 -0.838 22.486 -10.650
285 HG SER 41 HG SER 41 -0.643 24.783 -11.529
286 H GLY 42 H GLY 42 1.552 25.414 -10.655
287 HA2 GLY 42 1HA GLY 42 1.508 26.374 -8.505
288 HA3 GLY 42 2HA GLY 42 1.469 24.760 -7.810
289 HA PRO 43 HA PRO 43 6.033 26.114 -8.892
290 HB2 PRO 43 1HB PRO 43 6.430 28.760 -8.427
291 HB3 PRO 43 2HB PRO 43 5.995 28.118 -10.016
292 HG2 PRO 43 1HG PRO 43 4.250 29.396 -7.946
293 HG3 PRO 43 2HG PRO 43 4.262 29.636 -9.703
294 HD2 PRO 43 1HD PRO 43 2.449 28.055 -8.461
295 HD3 PRO 43 2HD PRO 43 3.044 27.720 -10.099
296 H SER 44 H SER 44 3.904 26.899 -6.356
297 HA SER 44 HA SER 44 6.127 26.813 -4.423
298 HB2 SER 44 1HB SER 44 4.968 28.318 -2.978
299 HB3 SER 44 2HB SER 44 4.919 29.040 -4.586
300 HG SER 44 HG SER 44 2.844 27.561 -3.333
301 H SER 45 H SER 45 6.105 25.091 -3.151
302 HA SER 45 HA SER 45 3.576 23.620 -2.824
303 HB2 SER 45 1HB SER 45 4.958 21.634 -2.388
304 HB3 SER 45 2HB SER 45 5.350 22.345 -3.954
305 HG SER 45 HG SER 45 7.256 23.000 -3.203
306 H GLY 46 H GLY 46 2.876 24.908 -1.061
307 HA2 GLY 46 1HA GLY 46 4.524 24.836 1.361
308 HA3 GLY 46 2HA GLY 46 3.092 25.823 1.115