Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
505446 | 2yrh RC | 11238 | cing | 1-original | 7 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 -28.402 -22.186 -2.283
2 HA2 GLY 1 1HA GLY 1 -28.506 -19.916 -2.627
3 HA3 GLY 1 2HA GLY 1 -28.307 -19.815 -0.883
4 H SER 2 H SER 2 -26.304 -20.462 -3.763
5 HA SER 2 HA SER 2 -23.878 -19.649 -2.633
6 HB2 SER 2 1HB SER 2 -24.071 -20.948 -4.737
7 HB3 SER 2 2HB SER 2 -24.687 -19.508 -5.548
8 HG SER 2 HG SER 2 -22.712 -18.500 -5.180
9 H SER 3 H SER 3 -23.284 -17.722 -1.924
10 HA SER 3 HA SER 3 -24.744 -15.369 -2.237
11 HB2 SER 3 1HB SER 3 -21.823 -15.744 -1.536
12 HB3 SER 3 2HB SER 3 -22.699 -14.223 -1.368
13 HG SER 3 HG SER 3 -24.000 -15.156 0.173
14 H GLY 4 H GLY 4 -21.825 -16.465 -3.944
15 HA2 GLY 4 1HA GLY 4 -22.310 -15.687 -6.452
16 HA3 GLY 4 2HA GLY 4 -21.913 -14.148 -5.702
17 H SER 5 H SER 5 -19.874 -14.792 -4.017
18 HA SER 5 HA SER 5 -17.603 -14.960 -4.009
19 HB2 SER 5 1HB SER 5 -18.344 -17.399 -5.630
20 HB3 SER 5 2HB SER 5 -16.693 -17.061 -5.109
21 HG SER 5 HG SER 5 -17.790 -18.417 -3.632
22 H SER 6 H SER 6 -18.579 -13.135 -5.858
23 HA SER 6 HA SER 6 -17.382 -13.504 -8.428
24 HB2 SER 6 1HB SER 6 -18.491 -11.044 -7.061
25 HB3 SER 6 2HB SER 6 -17.931 -11.075 -8.733
26 HG SER 6 HG SER 6 -19.704 -12.059 -9.301
27 H GLY 7 H GLY 7 -16.642 -11.244 -5.762
28 HA2 GLY 7 1HA GLY 7 -13.827 -11.681 -5.999
29 HA3 GLY 7 2HA GLY 7 -14.309 -10.162 -6.739
30 H LYS 8 H LYS 8 -14.297 -8.432 -5.474
31 HA LYS 8 HA LYS 8 -14.350 -7.096 -3.630
32 HB2 LYS 8 1HB LYS 8 -16.457 -8.527 -3.200
33 HB3 LYS 8 2HB LYS 8 -15.465 -9.386 -2.030
34 HG2 LYS 8 1HG LYS 8 -15.106 -7.353 -0.780
35 HG3 LYS 8 2HG LYS 8 -15.987 -6.421 -1.992
36 HD2 LYS 8 1HD LYS 8 -18.025 -7.640 -1.482
37 HD3 LYS 8 2HD LYS 8 -17.155 -8.649 -0.324
38 HE2 LYS 8 1HE LYS 8 -17.100 -5.684 -0.005
39 HE3 LYS 8 2HE LYS 8 -18.545 -6.572 0.477
40 HZ1 LYS 8 3HZ LYS 8 -17.463 -6.826 2.400
41 HZ2 LYS 8 1HZ LYS 8 -15.953 -6.456 1.733
42 HZ3 LYS 8 2HZ LYS 8 -16.576 -8.023 1.599
43 H LYS 9 H LYS 9 -11.992 -8.414 -4.233
44 HA LYS 9 HA LYS 9 -10.858 -9.698 -1.954
45 HB2 LYS 9 1HB LYS 9 -9.874 -8.718 -4.581
46 HB3 LYS 9 2HB LYS 9 -8.679 -8.915 -3.305
47 HG2 LYS 9 1HG LYS 9 -8.713 -10.926 -4.553
48 HG3 LYS 9 2HG LYS 9 -9.508 -11.260 -3.013
49 HD2 LYS 9 1HD LYS 9 -11.213 -10.386 -5.282
50 HD3 LYS 9 2HD LYS 9 -10.544 -12.018 -5.344
51 HE2 LYS 9 1HE LYS 9 -12.056 -10.918 -2.982
52 HE3 LYS 9 2HE LYS 9 -12.814 -11.829 -4.286
53 HZ1 LYS 9 3HZ LYS 9 -11.427 -13.712 -3.764
54 HZ2 LYS 9 1HZ LYS 9 -12.251 -13.221 -2.370
55 HZ3 LYS 9 2HZ LYS 9 -10.615 -12.839 -2.564
56 HA PRO 10 HA PRO 10 -9.911 -6.156 0.499
57 HB2 PRO 10 1HB PRO 10 -8.024 -7.279 2.094
58 HB3 PRO 10 2HB PRO 10 -9.750 -7.618 2.264
59 HG2 PRO 10 1HG PRO 10 -7.628 -9.233 0.903
60 HG3 PRO 10 2HG PRO 10 -8.941 -9.777 1.963
61 HD2 PRO 10 1HD PRO 10 -9.071 -9.973 -0.735
62 HD3 PRO 10 2HD PRO 10 -10.507 -9.701 0.273
63 H LEU 11 H LEU 11 -8.010 -4.848 1.183
64 HA LEU 11 HA LEU 11 -5.973 -4.853 -0.937
65 HB2 LEU 11 1HB LEU 11 -6.631 -2.573 0.907
66 HB3 LEU 11 2HB LEU 11 -5.719 -2.522 -0.600
67 HG LEU 11 HG LEU 11 -8.680 -3.059 -0.371
68 HD11 LEU 11 1HD1 LEU 11 -7.838 -0.662 -1.773
69 HD12 LEU 11 2HD1 LEU 11 -7.373 -0.648 -0.073
70 HD13 LEU 11 3HD1 LEU 11 -9.063 -0.872 -0.522
71 HD21 LEU 11 3HD2 LEU 11 -6.817 -2.795 -2.719
72 HD22 LEU 11 1HD2 LEU 11 -8.568 -2.630 -2.854
73 HD23 LEU 11 2HD2 LEU 11 -7.865 -4.153 -2.306
74 H VAL 12 H VAL 12 -4.286 -6.023 -0.216
75 HA VAL 12 HA VAL 12 -3.181 -5.324 2.428
76 HB VAL 12 HB VAL 12 -3.742 -7.548 2.715
77 HG11 VAL 12 1HG1 VAL 12 -4.568 -8.491 0.848
78 HG12 VAL 12 2HG1 VAL 12 -3.393 -7.693 -0.199
79 HG13 VAL 12 3HG1 VAL 12 -2.942 -9.153 0.683
80 HG21 VAL 12 3HG2 VAL 12 -1.329 -7.147 3.127
81 HG22 VAL 12 1HG2 VAL 12 -1.698 -8.822 2.718
82 HG23 VAL 12 2HG2 VAL 12 -0.985 -7.755 1.508
83 H CYS 13 H CYS 13 -0.963 -5.047 2.615
84 HA CYS 13 HA CYS 13 0.365 -4.101 0.271
85 HB2 CYS 13 1HB CYS 13 0.663 -3.160 2.585
86 HB3 CYS 13 2HB CYS 13 1.574 -4.610 2.994
87 H ASN 14 H ASN 14 1.163 -5.436 -1.210
88 HA ASN 14 HA ASN 14 1.841 -8.141 -0.710
89 HB2 ASN 14 1HB ASN 14 2.022 -6.282 -3.026
90 HB3 ASN 14 2HB ASN 14 3.038 -7.720 -3.066
91 HD21 ASN 14 1HD2 ASN 14 -0.299 -6.693 -2.497
92 HD22 ASN 14 2HD2 ASN 14 -1.032 -8.090 -3.202
93 H GLU 15 H GLU 15 3.434 -5.389 0.151
94 HA GLU 15 HA GLU 15 6.127 -6.380 -0.318
95 HB2 GLU 15 1HB GLU 15 5.273 -3.907 1.191
96 HB3 GLU 15 2HB GLU 15 6.883 -4.276 0.589
97 HG2 GLU 15 1HG GLU 15 4.656 -4.161 -1.367
98 HG3 GLU 15 2HG GLU 15 5.253 -2.647 -0.690
99 H CYS 16 H CYS 16 3.964 -5.708 2.405
100 HA CYS 16 HA CYS 16 5.776 -7.268 4.129
101 HB2 CYS 16 1HB CYS 16 4.878 -5.996 6.033
102 HB3 CYS 16 2HB CYS 16 5.622 -4.933 4.844
103 H GLY 17 H GLY 17 2.429 -6.628 3.233
104 HA2 GLY 17 1HA GLY 17 0.862 -8.436 3.045
105 HA3 GLY 17 2HA GLY 17 1.724 -9.266 4.332
106 H LYS 18 H LYS 18 0.609 -5.906 4.237
107 HA LYS 18 HA LYS 18 -0.983 -6.467 6.646
108 HB2 LYS 18 1HB LYS 18 0.951 -4.721 6.589
109 HB3 LYS 18 2HB LYS 18 -0.214 -3.709 5.746
110 HG2 LYS 18 1HG LYS 18 -1.768 -4.008 7.666
111 HG3 LYS 18 2HG LYS 18 -0.474 -4.857 8.515
112 HD2 LYS 18 1HD LYS 18 0.786 -2.949 8.781
113 HD3 LYS 18 2HD LYS 18 0.072 -2.154 7.376
114 HE2 LYS 18 1HE LYS 18 -0.685 -1.079 9.409
115 HE3 LYS 18 2HE LYS 18 -2.034 -1.895 8.621
116 HZ1 LYS 18 3HZ LYS 18 -2.331 -3.206 10.377
117 HZ2 LYS 18 1HZ LYS 18 -1.295 -2.173 11.227
118 HZ3 LYS 18 2HZ LYS 18 -0.685 -3.575 10.504
119 H THR 19 H THR 19 -3.108 -6.533 6.406
120 HA THR 19 HA THR 19 -4.361 -5.618 3.979
121 HB THR 19 HB THR 19 -6.446 -6.489 4.958
122 HG1 THR 19 1HG THR 19 -4.975 -7.422 7.180
123 HG21 THR 19 3HG2 THR 19 -3.990 -8.068 4.646
124 HG22 THR 19 1HG2 THR 19 -5.584 -8.298 3.928
125 HG23 THR 19 2HG2 THR 19 -5.264 -8.868 5.566
126 H PHE 20 H PHE 20 -5.902 -3.997 3.769
127 HA PHE 20 HA PHE 20 -6.203 -2.175 6.058
128 HB2 PHE 20 1HB PHE 20 -5.604 -1.394 3.198
129 HB3 PHE 20 2HB PHE 20 -6.040 -0.261 4.472
130 HD1 PHE 20 1HD PHE 20 -3.487 -2.724 3.427
131 HD2 PHE 20 2HD PHE 20 -4.430 0.559 5.967
132 HE1 PHE 20 1HE PHE 20 -1.119 -2.546 4.070
133 HE2 PHE 20 2HE PHE 20 -2.063 0.743 6.613
134 HZ PHE 20 HZ PHE 20 -0.404 -0.810 5.664
135 H ARG 21 H ARG 21 -8.014 -0.569 5.670
136 HA ARG 21 HA ARG 21 -10.312 -2.044 4.626
137 HB2 ARG 21 1HB ARG 21 -10.139 0.408 6.386
138 HB3 ARG 21 2HB ARG 21 -11.644 -0.326 5.850
139 HG2 ARG 21 1HG ARG 21 -9.657 -2.026 7.265
140 HG3 ARG 21 2HG ARG 21 -10.618 -0.878 8.199
141 HD2 ARG 21 1HD ARG 21 -11.720 -2.990 6.347
142 HD3 ARG 21 2HD ARG 21 -11.652 -3.108 8.105
143 HE ARG 21 HE ARG 21 -13.068 -0.806 7.070
144 HH11 ARG 21 2HH1 ARG 21 -13.272 -4.094 8.194
145 HH12 ARG 21 1HH1 ARG 21 -14.958 -3.995 8.582
146 HH21 ARG 21 2HH2 ARG 21 -15.287 -0.662 7.577
147 HH22 ARG 21 1HH2 ARG 21 -16.103 -2.042 8.230
148 H GLN 22 H GLN 22 -8.866 1.201 4.439
149 HA GLN 22 HA GLN 22 -10.564 1.842 2.156
150 HB2 GLN 22 1HB GLN 22 -8.522 3.555 3.582
151 HB3 GLN 22 2HB GLN 22 -9.666 4.104 2.365
152 HG2 GLN 22 1HG GLN 22 -11.508 3.762 3.808
153 HG3 GLN 22 2HG GLN 22 -10.518 2.878 4.970
154 HE21 GLN 22 1HE2 GLN 22 -10.300 6.001 3.291
155 HE22 GLN 22 2HE2 GLN 22 -9.986 6.934 4.710
156 H SER 23 H SER 23 -9.535 2.905 0.255
157 HA SER 23 HA SER 23 -7.408 1.229 -0.726
158 HB2 SER 23 1HB SER 23 -7.803 2.266 -2.861
159 HB3 SER 23 2HB SER 23 -9.373 1.967 -2.116
160 HG SER 23 HG SER 23 -9.683 4.013 -2.471
161 H SER 24 H SER 24 -7.819 4.646 0.087
162 HA SER 24 HA SER 24 -5.273 5.506 -0.772
163 HB2 SER 24 1HB SER 24 -7.038 7.118 -0.377
164 HB3 SER 24 2HB SER 24 -7.137 6.651 1.321
165 HG SER 24 HG SER 24 -4.636 7.285 0.904
166 H CYS 25 H CYS 25 -6.407 4.026 2.182
167 HA CYS 25 HA CYS 25 -4.259 4.638 3.867
168 HB2 CYS 25 1HB CYS 25 -6.340 2.504 3.790
169 HB3 CYS 25 2HB CYS 25 -4.965 2.273 4.862
170 HG CYS 25 HG CYS 25 -5.517 4.197 6.598
171 H LEU 26 H LEU 26 -4.817 1.499 2.264
172 HA LEU 26 HA LEU 26 -2.377 0.348 2.718
173 HB2 LEU 26 1HB LEU 26 -4.038 -0.986 1.745
174 HB3 LEU 26 2HB LEU 26 -4.267 0.130 0.400
175 HG LEU 26 HG LEU 26 -1.900 -0.537 -0.315
176 HD11 LEU 26 1HD1 LEU 26 -2.298 -3.127 1.019
177 HD12 LEU 26 2HD1 LEU 26 -1.799 -1.800 2.067
178 HD13 LEU 26 3HD1 LEU 26 -0.813 -2.240 0.673
179 HD21 LEU 26 3HD2 LEU 26 -4.251 -1.329 -1.176
180 HD22 LEU 26 1HD2 LEU 26 -3.749 -2.867 -0.473
181 HD23 LEU 26 2HD2 LEU 26 -2.772 -2.113 -1.733
182 H SER 27 H SER 27 -3.247 2.185 -0.215
183 HA SER 27 HA SER 27 -0.775 2.162 -1.452
184 HB2 SER 27 1HB SER 27 -2.688 2.988 -2.643
185 HB3 SER 27 2HB SER 27 -2.933 4.281 -1.468
186 HG SER 27 HG SER 27 -1.423 5.426 -2.406
187 H LYS 28 H LYS 28 -2.070 4.792 0.585
188 HA LYS 28 HA LYS 28 0.211 6.357 0.691
189 HB2 LYS 28 1HB LYS 28 -2.108 5.972 2.547
190 HB3 LYS 28 2HB LYS 28 -0.759 6.985 3.046
191 HG2 LYS 28 1HG LYS 28 -1.098 8.228 0.847
192 HG3 LYS 28 2HG LYS 28 -2.644 7.383 0.749
193 HD2 LYS 28 1HD LYS 28 -3.332 8.334 2.871
194 HD3 LYS 28 2HD LYS 28 -1.758 9.111 3.059
195 HE2 LYS 28 1HE LYS 28 -2.263 10.286 0.854
196 HE3 LYS 28 2HE LYS 28 -3.921 9.722 1.062
197 HZ1 LYS 28 3HZ LYS 28 -2.721 11.072 3.342
198 HZ2 LYS 28 1HZ LYS 28 -4.297 11.165 2.734
199 HZ3 LYS 28 2HZ LYS 28 -3.053 12.041 1.996
200 H HIS 29 H HIS 29 -0.294 3.276 2.021
201 HA HIS 29 HA HIS 29 1.791 3.593 4.043
202 HB2 HIS 29 1HB HIS 29 0.162 2.300 5.014
203 HB3 HIS 29 2HB HIS 29 -0.322 1.571 3.486
204 HD1 HIS 29 1HD HIS 29 1.738 0.993 6.461
205 HD2 HIS 29 2HD HIS 29 1.422 -0.571 2.625
206 HE1 HIS 29 1HE HIS 29 2.971 -1.199 6.525
207 H GLN 30 H GLN 30 1.156 1.957 0.996
208 HA GLN 30 HA GLN 30 3.365 0.258 0.915
209 HB2 GLN 30 1HB GLN 30 2.011 1.682 -1.383
210 HB3 GLN 30 2HB GLN 30 3.088 0.299 -1.535
211 HG2 GLN 30 1HG GLN 30 1.388 -0.846 0.072
212 HG3 GLN 30 2HG GLN 30 0.301 0.424 -0.488
213 HE21 GLN 30 1HE2 GLN 30 1.474 -2.632 -1.085
214 HE22 GLN 30 2HE2 GLN 30 0.951 -2.807 -2.722
215 H ARG 31 H ARG 31 3.070 3.674 0.124
216 HA ARG 31 HA ARG 31 5.410 4.155 -1.228
217 HB2 ARG 31 1HB ARG 31 5.365 6.425 -0.108
218 HB3 ARG 31 2HB ARG 31 3.888 5.950 -0.936
219 HG2 ARG 31 1HG ARG 31 2.695 5.771 0.993
220 HG3 ARG 31 2HG ARG 31 4.108 5.334 1.956
221 HD2 ARG 31 1HD ARG 31 4.823 7.812 1.332
222 HD3 ARG 31 2HD ARG 31 3.077 8.011 1.187
223 HE ARG 31 HE ARG 31 4.069 6.793 3.638
224 HH11 ARG 31 2HH1 ARG 31 2.879 9.630 2.009
225 HH12 ARG 31 1HH1 ARG 31 2.461 10.455 3.474
226 HH21 ARG 31 2HH2 ARG 31 3.523 7.869 5.574
227 HH22 ARG 31 1HH2 ARG 31 2.829 9.453 5.501
228 H ILE 32 H ILE 32 5.021 3.159 2.036
229 HA ILE 32 HA ILE 32 7.447 4.133 3.116
230 HB ILE 32 HB ILE 32 7.075 2.729 4.964
231 HG12 ILE 32 1HG1 ILE 32 5.405 1.032 3.103
232 HG13 ILE 32 2HG1 ILE 32 6.916 0.585 3.886
233 HG21 ILE 32 1HG2 ILE 32 4.750 3.975 3.708
234 HG22 ILE 32 2HG2 ILE 32 4.342 2.748 4.906
235 HG23 ILE 32 3HG2 ILE 32 5.361 4.115 5.356
236 HD11 ILE 32 3HD1 ILE 32 5.393 -0.501 5.196
237 HD12 ILE 32 1HD1 ILE 32 5.559 1.019 6.075
238 HD13 ILE 32 2HD1 ILE 32 4.172 0.759 5.016
239 H HIS 33 H HIS 33 6.609 1.233 1.320
240 HA HIS 33 HA HIS 33 9.275 0.120 1.662
241 HB2 HIS 33 1HB HIS 33 7.012 -0.948 -0.031
242 HB3 HIS 33 2HB HIS 33 8.442 -1.822 0.509
243 HD1 HIS 33 1HD HIS 33 8.581 -2.105 3.231
244 HD2 HIS 33 2HD HIS 33 4.861 -1.247 1.592
245 HE1 HIS 33 1HE HIS 33 6.906 -2.742 4.995
246 H SER 34 H SER 34 7.215 1.330 -0.964
247 HA SER 34 HA SER 34 9.491 1.263 -2.795
248 HB2 SER 34 1HB SER 34 7.514 0.403 -3.791
249 HB3 SER 34 2HB SER 34 6.538 1.744 -3.191
250 HG SER 34 HG SER 34 7.114 1.904 -5.441
251 H GLY 35 H GLY 35 10.746 2.984 -3.025
252 HA2 GLY 35 1HA GLY 35 10.180 5.483 -1.815
253 HA3 GLY 35 2HA GLY 35 11.504 5.151 -2.921
254 H GLU 36 H GLU 36 11.483 6.379 -4.670
255 HA GLU 36 HA GLU 36 9.312 8.010 -5.405
256 HB2 GLU 36 1HB GLU 36 11.773 7.191 -6.955
257 HB3 GLU 36 2HB GLU 36 10.638 8.421 -7.493
258 HG2 GLU 36 1HG GLU 36 11.890 8.660 -4.800
259 HG3 GLU 36 2HG GLU 36 12.817 9.089 -6.237
260 H LYS 37 H LYS 37 8.493 7.999 -7.771
261 HA LYS 37 HA LYS 37 6.971 5.622 -8.121
262 HB2 LYS 37 1HB LYS 37 7.335 7.967 -9.996
263 HB3 LYS 37 2HB LYS 37 6.088 6.734 -10.128
264 HG2 LYS 37 1HG LYS 37 4.910 7.539 -8.319
265 HG3 LYS 37 2HG LYS 37 6.322 8.336 -7.621
266 HD2 LYS 37 1HD LYS 37 5.155 9.223 -10.242
267 HD3 LYS 37 2HD LYS 37 4.516 9.807 -8.703
268 HE2 LYS 37 1HE LYS 37 6.850 10.520 -8.118
269 HE3 LYS 37 2HE LYS 37 7.316 10.126 -9.771
270 HZ1 LYS 37 3HZ LYS 37 6.342 12.519 -8.907
271 HZ2 LYS 37 1HZ LYS 37 5.005 11.807 -9.661
272 HZ3 LYS 37 2HZ LYS 37 6.448 12.016 -10.518
273 HA PRO 38 HA PRO 38 9.528 3.222 -10.764
274 HB2 PRO 38 1HB PRO 38 7.662 1.983 -12.297
275 HB3 PRO 38 2HB PRO 38 7.937 1.573 -10.599
276 HG2 PRO 38 1HG PRO 38 5.822 3.312 -11.809
277 HG3 PRO 38 2HG PRO 38 5.672 2.094 -10.528
278 HD2 PRO 38 1HD PRO 38 5.800 4.749 -10.007
279 HD3 PRO 38 2HD PRO 38 6.460 3.526 -8.902
280 H SER 39 H SER 39 10.583 4.873 -11.941
281 HA SER 39 HA SER 39 9.374 6.127 -14.206
282 HB2 SER 39 1HB SER 39 11.352 6.959 -12.736
283 HB3 SER 39 2HB SER 39 12.346 5.952 -13.788
284 HG SER 39 HG SER 39 10.798 7.313 -15.386
285 H GLY 40 H GLY 40 11.964 3.693 -13.880
286 HA2 GLY 40 1HA GLY 40 11.070 2.014 -15.911
287 HA3 GLY 40 2HA GLY 40 12.158 3.174 -16.658
288 HA PRO 41 HA PRO 41 15.226 0.123 -15.620
289 HB2 PRO 41 1HB PRO 41 17.322 1.457 -16.714
290 HB3 PRO 41 2HB PRO 41 16.142 0.564 -17.680
291 HG2 PRO 41 1HG PRO 41 16.302 3.501 -17.126
292 HG3 PRO 41 2HG PRO 41 15.952 2.668 -18.652
293 HD2 PRO 41 1HD PRO 41 14.011 3.746 -17.102
294 HD3 PRO 41 2HD PRO 41 13.750 2.292 -18.087
295 H SER 42 H SER 42 14.676 3.055 -14.222
296 HA SER 42 HA SER 42 17.171 3.424 -12.847
297 HB2 SER 42 1HB SER 42 14.435 4.661 -12.574
298 HB3 SER 42 2HB SER 42 15.739 5.035 -11.447
299 HG SER 42 HG SER 42 15.306 6.106 -13.811
300 H SER 43 H SER 43 13.897 2.613 -11.678
301 HA SER 43 HA SER 43 14.948 1.617 -9.188
302 HB2 SER 43 1HB SER 43 12.777 2.775 -9.265
303 HB3 SER 43 2HB SER 43 12.134 1.504 -10.306
304 HG SER 43 HG SER 43 13.282 0.729 -7.887
305 H GLY 44 H GLY 44 12.992 0.119 -11.777
306 HA2 GLY 44 1HA GLY 44 14.407 -2.411 -11.219
307 HA3 GLY 44 2HA GLY 44 12.663 -2.370 -11.428
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -14.872 -22.859 -13.833
2 HA2 GLY 1 1HA GLY 1 -15.465 -25.435 -12.857
3 HA3 GLY 1 2HA GLY 1 -14.321 -24.667 -11.767
4 H SER 2 H SER 2 -15.172 -22.045 -11.834
5 HA SER 2 HA SER 2 -17.705 -22.279 -10.389
6 HB2 SER 2 1HB SER 2 -17.144 -20.233 -9.306
7 HB3 SER 2 2HB SER 2 -15.655 -21.176 -9.361
8 HG SER 2 HG SER 2 -16.205 -18.767 -10.467
9 H SER 3 H SER 3 -19.116 -20.223 -10.554
10 HA SER 3 HA SER 3 -19.220 -19.215 -13.304
11 HB2 SER 3 1HB SER 3 -20.740 -21.139 -13.234
12 HB3 SER 3 2HB SER 3 -21.573 -20.442 -11.844
13 HG SER 3 HG SER 3 -21.950 -19.955 -14.457
14 H GLY 4 H GLY 4 -19.092 -17.080 -13.109
15 HA2 GLY 4 1HA GLY 4 -19.828 -14.946 -12.567
16 HA3 GLY 4 2HA GLY 4 -21.018 -15.662 -11.490
17 H SER 5 H SER 5 -18.976 -13.428 -11.226
18 HA SER 5 HA SER 5 -17.098 -14.323 -9.263
19 HB2 SER 5 1HB SER 5 -17.987 -11.534 -10.035
20 HB3 SER 5 2HB SER 5 -16.644 -11.895 -8.950
21 HG SER 5 HG SER 5 -15.456 -12.188 -10.645
22 H SER 6 H SER 6 -17.186 -14.200 -7.069
23 HA SER 6 HA SER 6 -19.805 -14.000 -5.883
24 HB2 SER 6 1HB SER 6 -18.626 -14.630 -3.785
25 HB3 SER 6 2HB SER 6 -18.299 -15.746 -5.110
26 HG SER 6 HG SER 6 -16.590 -14.122 -3.734
27 H GLY 7 H GLY 7 -16.681 -12.379 -5.278
28 HA2 GLY 7 1HA GLY 7 -18.064 -9.864 -4.840
29 HA3 GLY 7 2HA GLY 7 -17.279 -10.540 -3.420
30 H LYS 8 H LYS 8 -15.665 -9.088 -3.127
31 HA LYS 8 HA LYS 8 -13.714 -8.838 -5.321
32 HB2 LYS 8 1HB LYS 8 -14.603 -6.755 -3.325
33 HB3 LYS 8 2HB LYS 8 -13.153 -6.587 -4.306
34 HG2 LYS 8 1HG LYS 8 -15.857 -7.050 -5.522
35 HG3 LYS 8 2HG LYS 8 -15.257 -5.436 -5.134
36 HD2 LYS 8 1HD LYS 8 -13.714 -7.377 -6.840
37 HD3 LYS 8 2HD LYS 8 -14.886 -6.240 -7.512
38 HE2 LYS 8 1HE LYS 8 -12.791 -5.183 -5.686
39 HE3 LYS 8 2HE LYS 8 -12.310 -5.651 -7.317
40 HZ1 LYS 8 3HZ LYS 8 -14.569 -4.199 -7.713
41 HZ2 LYS 8 1HZ LYS 8 -12.987 -3.625 -7.894
42 HZ3 LYS 8 2HZ LYS 8 -13.817 -3.373 -6.442
43 H LYS 9 H LYS 9 -11.534 -7.981 -4.345
44 HA LYS 9 HA LYS 9 -10.913 -9.707 -2.042
45 HB2 LYS 9 1HB LYS 9 -9.218 -8.793 -4.364
46 HB3 LYS 9 2HB LYS 9 -8.539 -9.556 -2.932
47 HG2 LYS 9 1HG LYS 9 -10.289 -11.424 -3.461
48 HG3 LYS 9 2HG LYS 9 -10.236 -10.726 -5.082
49 HD2 LYS 9 1HD LYS 9 -7.735 -11.483 -3.598
50 HD3 LYS 9 2HD LYS 9 -8.633 -12.654 -4.567
51 HE2 LYS 9 1HE LYS 9 -8.473 -10.755 -6.387
52 HE3 LYS 9 2HE LYS 9 -7.083 -10.259 -5.423
53 HZ1 LYS 9 3HZ LYS 9 -7.458 -12.659 -7.046
54 HZ2 LYS 9 1HZ LYS 9 -6.543 -12.815 -5.632
55 HZ3 LYS 9 2HZ LYS 9 -6.075 -11.710 -6.823
56 HA PRO 10 HA PRO 10 -9.836 -6.201 0.379
57 HB2 PRO 10 1HB PRO 10 -7.975 -7.307 2.017
58 HB3 PRO 10 2HB PRO 10 -9.704 -7.644 2.162
59 HG2 PRO 10 1HG PRO 10 -7.560 -9.272 0.854
60 HG3 PRO 10 2HG PRO 10 -8.890 -9.806 1.897
61 HD2 PRO 10 1HD PRO 10 -8.975 -10.030 -0.800
62 HD3 PRO 10 2HD PRO 10 -10.427 -9.748 0.181
63 H LEU 11 H LEU 11 -7.979 -4.850 1.039
64 HA LEU 11 HA LEU 11 -5.892 -4.896 -1.028
65 HB2 LEU 11 1HB LEU 11 -6.586 -2.582 0.759
66 HB3 LEU 11 2HB LEU 11 -5.661 -2.559 -0.741
67 HG LEU 11 HG LEU 11 -8.631 -3.022 -0.473
68 HD11 LEU 11 1HD1 LEU 11 -8.777 -0.893 -1.712
69 HD12 LEU 11 2HD1 LEU 11 -7.029 -0.715 -1.567
70 HD13 LEU 11 3HD1 LEU 11 -8.038 -0.711 -0.121
71 HD21 LEU 11 3HD2 LEU 11 -8.760 -3.357 -2.760
72 HD22 LEU 11 1HD2 LEU 11 -7.306 -4.256 -2.327
73 HD23 LEU 11 2HD2 LEU 11 -7.168 -2.657 -3.058
74 H VAL 12 H VAL 12 -4.167 -5.974 -0.288
75 HA VAL 12 HA VAL 12 -3.132 -5.240 2.374
76 HB VAL 12 HB VAL 12 -3.681 -7.461 2.700
77 HG11 VAL 12 1HG1 VAL 12 -4.489 -8.374 0.790
78 HG12 VAL 12 2HG1 VAL 12 -3.196 -7.705 -0.207
79 HG13 VAL 12 3HG1 VAL 12 -2.903 -9.143 0.772
80 HG21 VAL 12 3HG2 VAL 12 -0.918 -7.738 1.531
81 HG22 VAL 12 1HG2 VAL 12 -1.252 -6.994 3.095
82 HG23 VAL 12 2HG2 VAL 12 -1.640 -8.693 2.826
83 H CYS 13 H CYS 13 -0.916 -4.951 2.593
84 HA CYS 13 HA CYS 13 0.443 -4.029 0.261
85 HB2 CYS 13 1HB CYS 13 0.741 -3.024 2.516
86 HB3 CYS 13 2HB CYS 13 1.550 -4.498 3.037
87 H ASN 14 H ASN 14 1.490 -5.237 -1.161
88 HA ASN 14 HA ASN 14 2.071 -7.991 -0.684
89 HB2 ASN 14 1HB ASN 14 1.452 -6.944 -2.916
90 HB3 ASN 14 2HB ASN 14 3.097 -6.318 -2.979
91 HD21 ASN 14 1HD2 ASN 14 1.162 -9.240 -2.854
92 HD22 ASN 14 2HD2 ASN 14 2.346 -10.279 -3.563
93 H GLU 15 H GLU 15 3.685 -5.158 0.097
94 HA GLU 15 HA GLU 15 6.372 -6.176 -0.192
95 HB2 GLU 15 1HB GLU 15 5.465 -3.737 1.340
96 HB3 GLU 15 2HB GLU 15 7.088 -4.087 0.763
97 HG2 GLU 15 1HG GLU 15 4.900 -3.935 -1.235
98 HG3 GLU 15 2HG GLU 15 5.477 -2.435 -0.511
99 H CYS 16 H CYS 16 4.102 -5.559 2.456
100 HA CYS 16 HA CYS 16 5.860 -7.124 4.229
101 HB2 CYS 16 1HB CYS 16 4.869 -5.910 6.110
102 HB3 CYS 16 2HB CYS 16 5.593 -4.792 4.959
103 H GLY 17 H GLY 17 2.538 -6.543 3.200
104 HA2 GLY 17 1HA GLY 17 1.007 -8.356 2.906
105 HA3 GLY 17 2HA GLY 17 1.857 -9.234 4.169
106 H LYS 18 H LYS 18 0.669 -5.897 4.215
107 HA LYS 18 HA LYS 18 -0.965 -6.613 6.554
108 HB2 LYS 18 1HB LYS 18 0.938 -4.829 6.629
109 HB3 LYS 18 2HB LYS 18 -0.236 -3.796 5.825
110 HG2 LYS 18 1HG LYS 18 -1.810 -4.214 7.693
111 HG3 LYS 18 2HG LYS 18 -0.535 -5.119 8.513
112 HD2 LYS 18 1HD LYS 18 0.793 -3.206 8.796
113 HD3 LYS 18 2HD LYS 18 -0.117 -2.291 7.591
114 HE2 LYS 18 1HE LYS 18 -2.025 -2.172 9.051
115 HE3 LYS 18 2HE LYS 18 -1.250 -3.240 10.219
116 HZ1 LYS 18 3HZ LYS 18 0.402 -1.569 10.650
117 HZ2 LYS 18 1HZ LYS 18 -1.133 -0.885 10.850
118 HZ3 LYS 18 2HZ LYS 18 -0.236 -0.556 9.455
119 H THR 19 H THR 19 -3.081 -6.711 6.252
120 HA THR 19 HA THR 19 -4.322 -5.832 3.842
121 HB THR 19 HB THR 19 -6.442 -6.524 4.915
122 HG1 THR 19 1HG THR 19 -5.821 -7.705 7.071
123 HG21 THR 19 3HG2 THR 19 -5.670 -8.411 3.945
124 HG22 THR 19 1HG2 THR 19 -5.390 -8.927 5.607
125 HG23 THR 19 2HG2 THR 19 -4.067 -8.245 4.660
126 H PHE 20 H PHE 20 -6.065 -4.303 3.662
127 HA PHE 20 HA PHE 20 -6.228 -2.279 5.766
128 HB2 PHE 20 1HB PHE 20 -5.450 -1.726 2.899
129 HB3 PHE 20 2HB PHE 20 -6.009 -0.478 4.008
130 HD1 PHE 20 1HD PHE 20 -3.326 -2.918 3.352
131 HD2 PHE 20 2HD PHE 20 -4.576 0.438 5.653
132 HE1 PHE 20 1HE PHE 20 -1.028 -2.637 4.184
133 HE2 PHE 20 2HE PHE 20 -2.280 0.724 6.489
134 HZ PHE 20 HZ PHE 20 -0.502 -0.814 5.754
135 H ARG 21 H ARG 21 -8.039 -0.784 5.459
136 HA ARG 21 HA ARG 21 -10.306 -2.180 4.259
137 HB2 ARG 21 1HB ARG 21 -11.686 -0.595 5.545
138 HB3 ARG 21 2HB ARG 21 -10.554 -1.466 6.571
139 HG2 ARG 21 1HG ARG 21 -9.066 0.681 6.081
140 HG3 ARG 21 2HG ARG 21 -10.662 1.405 5.870
141 HD2 ARG 21 1HD ARG 21 -10.452 1.715 8.108
142 HD3 ARG 21 2HD ARG 21 -11.116 0.082 8.136
143 HE ARG 21 HE ARG 21 -9.070 -0.718 8.842
144 HH11 ARG 21 2HH1 ARG 21 -8.796 2.626 7.911
145 HH12 ARG 21 1HH1 ARG 21 -7.212 2.819 8.587
146 HH21 ARG 21 2HH2 ARG 21 -6.985 -0.476 9.735
147 HH22 ARG 21 1HH2 ARG 21 -6.183 1.054 9.623
148 H GLN 22 H GLN 22 -8.770 1.021 4.222
149 HA GLN 22 HA GLN 22 -10.384 1.745 1.885
150 HB2 GLN 22 1HB GLN 22 -8.798 3.321 3.884
151 HB3 GLN 22 2HB GLN 22 -9.188 4.021 2.319
152 HG2 GLN 22 1HG GLN 22 -11.182 2.978 4.319
153 HG3 GLN 22 2HG GLN 22 -10.789 4.673 4.040
154 HE21 GLN 22 1HE2 GLN 22 -10.935 5.251 1.603
155 HE22 GLN 22 2HE2 GLN 22 -12.387 4.737 0.820
156 H SER 23 H SER 23 -9.415 2.558 -0.018
157 HA SER 23 HA SER 23 -7.117 1.150 -0.856
158 HB2 SER 23 1HB SER 23 -8.692 3.413 -2.078
159 HB3 SER 23 2HB SER 23 -7.278 2.723 -2.874
160 HG SER 23 HG SER 23 -8.510 1.162 -3.515
161 H SER 24 H SER 24 -7.597 4.657 -0.403
162 HA SER 24 HA SER 24 -5.007 5.493 -0.839
163 HB2 SER 24 1HB SER 24 -6.977 6.990 -0.502
164 HB3 SER 24 2HB SER 24 -6.894 6.652 1.227
165 HG SER 24 HG SER 24 -5.423 8.130 1.349
166 H CYS 25 H CYS 25 -6.383 3.978 1.994
167 HA CYS 25 HA CYS 25 -4.375 4.579 3.854
168 HB2 CYS 25 1HB CYS 25 -6.714 3.370 4.097
169 HB3 CYS 25 2HB CYS 25 -5.735 1.919 3.923
170 HG CYS 25 HG CYS 25 -5.557 4.256 6.406
171 H LEU 26 H LEU 26 -4.803 1.562 1.995
172 HA LEU 26 HA LEU 26 -2.364 0.405 2.703
173 HB2 LEU 26 1HB LEU 26 -4.022 -0.967 1.731
174 HB3 LEU 26 2HB LEU 26 -4.141 0.062 0.305
175 HG LEU 26 HG LEU 26 -1.889 -0.682 -0.382
176 HD11 LEU 26 1HD1 LEU 26 -0.688 -2.340 0.745
177 HD12 LEU 26 2HD1 LEU 26 -2.064 -2.776 1.759
178 HD13 LEU 26 3HD1 LEU 26 -1.226 -1.246 2.021
179 HD21 LEU 26 3HD2 LEU 26 -3.842 -1.806 -1.275
180 HD22 LEU 26 1HD2 LEU 26 -3.887 -2.885 0.120
181 HD23 LEU 26 2HD2 LEU 26 -2.540 -2.968 -1.015
182 H SER 27 H SER 27 -3.193 2.137 -0.304
183 HA SER 27 HA SER 27 -0.670 2.110 -1.462
184 HB2 SER 27 1HB SER 27 -1.580 4.423 -2.439
185 HB3 SER 27 2HB SER 27 -2.239 2.870 -2.955
186 HG SER 27 HG SER 27 -3.321 4.325 -0.784
187 H LYS 28 H LYS 28 -2.109 4.540 0.692
188 HA LYS 28 HA LYS 28 0.087 6.301 0.709
189 HB2 LYS 28 1HB LYS 28 -2.094 7.025 1.470
190 HB3 LYS 28 2HB LYS 28 -2.079 5.835 2.765
191 HG2 LYS 28 1HG LYS 28 0.119 7.830 2.677
192 HG3 LYS 28 2HG LYS 28 -1.482 8.366 3.193
193 HD2 LYS 28 1HD LYS 28 -0.281 5.895 4.375
194 HD3 LYS 28 2HD LYS 28 0.223 7.484 4.956
195 HE2 LYS 28 1HE LYS 28 -2.663 6.656 4.777
196 HE3 LYS 28 2HE LYS 28 -1.678 6.363 6.209
197 HZ1 LYS 28 3HZ LYS 28 -1.504 8.605 6.654
198 HZ2 LYS 28 1HZ LYS 28 -3.089 8.495 6.071
199 HZ3 LYS 28 2HZ LYS 28 -1.857 9.072 5.066
200 H HIS 29 H HIS 29 -0.277 3.217 2.046
201 HA HIS 29 HA HIS 29 1.725 3.669 4.129
202 HB2 HIS 29 1HB HIS 29 0.165 2.304 5.097
203 HB3 HIS 29 2HB HIS 29 -0.293 1.563 3.567
204 HD1 HIS 29 1HD HIS 29 1.738 1.020 6.557
205 HD2 HIS 29 2HD HIS 29 1.561 -0.495 2.692
206 HE1 HIS 29 1HE HIS 29 3.051 -1.124 6.615
207 H GLN 30 H GLN 30 1.247 1.952 1.098
208 HA GLN 30 HA GLN 30 3.520 0.351 1.087
209 HB2 GLN 30 1HB GLN 30 2.136 1.718 -1.225
210 HB3 GLN 30 2HB GLN 30 3.344 0.452 -1.397
211 HG2 GLN 30 1HG GLN 30 1.710 -0.869 0.178
212 HG3 GLN 30 2HG GLN 30 0.532 0.278 -0.457
213 HE21 GLN 30 1HE2 GLN 30 1.270 -2.715 -0.818
214 HE22 GLN 30 2HE2 GLN 30 1.157 -2.930 -2.528
215 H ARG 31 H ARG 31 3.143 3.763 0.354
216 HA ARG 31 HA ARG 31 5.499 4.338 -0.943
217 HB2 ARG 31 1HB ARG 31 5.356 6.585 0.216
218 HB3 ARG 31 2HB ARG 31 3.916 6.081 -0.660
219 HG2 ARG 31 1HG ARG 31 2.680 5.825 1.235
220 HG3 ARG 31 2HG ARG 31 4.083 5.422 2.228
221 HD2 ARG 31 1HD ARG 31 4.725 7.933 1.660
222 HD3 ARG 31 2HD ARG 31 2.978 8.074 1.471
223 HE ARG 31 HE ARG 31 3.617 6.768 3.901
224 HH11 ARG 31 2HH1 ARG 31 3.599 9.903 2.387
225 HH12 ARG 31 1HH1 ARG 31 3.405 10.766 3.877
226 HH21 ARG 31 2HH2 ARG 31 3.362 7.893 5.869
227 HH22 ARG 31 1HH2 ARG 31 3.272 9.621 5.857
228 H ILE 32 H ILE 32 5.065 3.261 2.287
229 HA ILE 32 HA ILE 32 7.451 4.290 3.424
230 HB ILE 32 HB ILE 32 7.044 2.920 5.277
231 HG12 ILE 32 1HG1 ILE 32 5.376 1.138 3.487
232 HG13 ILE 32 2HG1 ILE 32 6.996 0.774 4.071
233 HG21 ILE 32 1HG2 ILE 32 4.304 2.820 5.095
234 HG22 ILE 32 2HG2 ILE 32 5.254 4.212 5.613
235 HG23 ILE 32 3HG2 ILE 32 4.733 4.076 3.934
236 HD11 ILE 32 3HD1 ILE 32 6.031 0.959 6.407
237 HD12 ILE 32 1HD1 ILE 32 4.445 0.933 5.635
238 HD13 ILE 32 2HD1 ILE 32 5.541 -0.436 5.446
239 H HIS 33 H HIS 33 6.688 1.405 1.584
240 HA HIS 33 HA HIS 33 9.324 0.268 2.016
241 HB2 HIS 33 1HB HIS 33 7.109 -0.699 0.198
242 HB3 HIS 33 2HB HIS 33 8.535 -1.608 0.692
243 HD1 HIS 33 1HD HIS 33 8.651 -1.812 3.502
244 HD2 HIS 33 2HD HIS 33 4.950 -1.348 1.672
245 HE1 HIS 33 1HE HIS 33 6.964 -2.620 5.183
246 H SER 34 H SER 34 7.439 1.639 -0.656
247 HA SER 34 HA SER 34 8.956 1.286 -2.832
248 HB2 SER 34 1HB SER 34 6.918 2.915 -2.356
249 HB3 SER 34 2HB SER 34 8.199 4.126 -2.292
250 HG SER 34 HG SER 34 8.583 3.859 -4.377
251 H GLY 35 H GLY 35 9.621 3.834 -0.426
252 HA2 GLY 35 1HA GLY 35 12.465 3.529 -0.851
253 HA3 GLY 35 2HA GLY 35 11.811 5.053 -1.432
254 H GLU 36 H GLU 36 13.708 4.370 0.785
255 HA GLU 36 HA GLU 36 12.397 6.011 2.819
256 HB2 GLU 36 1HB GLU 36 13.201 4.565 4.630
257 HB3 GLU 36 2HB GLU 36 12.079 3.714 3.577
258 HG2 GLU 36 1HG GLU 36 14.031 2.705 2.415
259 HG3 GLU 36 2HG GLU 36 15.074 3.453 3.623
260 H LYS 37 H LYS 37 14.047 6.689 4.530
261 HA LYS 37 HA LYS 37 16.148 8.058 3.280
262 HB2 LYS 37 1HB LYS 37 16.870 8.667 5.527
263 HB3 LYS 37 2HB LYS 37 15.120 8.784 5.394
264 HG2 LYS 37 1HG LYS 37 15.250 7.716 7.385
265 HG3 LYS 37 2HG LYS 37 15.264 6.304 6.324
266 HD2 LYS 37 1HD LYS 37 17.639 6.115 6.488
267 HD3 LYS 37 2HD LYS 37 17.762 7.668 7.318
268 HE2 LYS 37 1HE LYS 37 16.158 5.413 8.474
269 HE3 LYS 37 2HE LYS 37 17.903 5.502 8.711
270 HZ1 LYS 37 3HZ LYS 37 17.724 7.408 9.964
271 HZ2 LYS 37 1HZ LYS 37 16.333 6.569 10.437
272 HZ3 LYS 37 2HZ LYS 37 16.218 7.837 9.324
273 HA PRO 38 HA PRO 38 19.347 5.047 2.999
274 HB2 PRO 38 1HB PRO 38 21.495 6.705 2.938
275 HB3 PRO 38 2HB PRO 38 20.393 6.511 1.570
276 HG2 PRO 38 1HG PRO 38 20.481 8.672 3.639
277 HG3 PRO 38 2HG PRO 38 20.244 8.810 1.887
278 HD2 PRO 38 1HD PRO 38 18.190 8.925 3.648
279 HD3 PRO 38 2HD PRO 38 18.013 8.245 2.018
280 H SER 39 H SER 39 21.480 4.483 4.063
281 HA SER 39 HA SER 39 21.396 5.179 6.926
282 HB2 SER 39 1HB SER 39 21.648 2.546 5.553
283 HB3 SER 39 2HB SER 39 22.562 2.782 7.043
284 HG SER 39 HG SER 39 19.770 3.208 6.750
285 H GLY 40 H GLY 40 23.518 4.781 8.051
286 HA2 GLY 40 1HA GLY 40 25.535 6.336 6.900
287 HA3 GLY 40 2HA GLY 40 25.745 5.278 8.287
288 HA PRO 41 HA PRO 41 28.061 3.736 4.442
289 HB2 PRO 41 1HB PRO 41 30.581 4.289 5.286
290 HB3 PRO 41 2HB PRO 41 29.610 5.431 4.349
291 HG2 PRO 41 1HG PRO 41 30.090 5.331 7.302
292 HG3 PRO 41 2HG PRO 41 30.076 6.734 6.217
293 HD2 PRO 41 1HD PRO 41 27.971 6.091 7.795
294 HD3 PRO 41 2HD PRO 41 27.774 6.862 6.208
295 H SER 42 H SER 42 29.964 2.119 4.550
296 HA SER 42 HA SER 42 30.763 0.118 5.281
297 HB2 SER 42 1HB SER 42 30.315 1.477 7.940
298 HB3 SER 42 2HB SER 42 31.025 -0.131 7.804
299 HG SER 42 HG SER 42 32.041 2.146 6.455
300 H SER 43 H SER 43 28.091 0.195 4.522
301 HA SER 43 HA SER 43 26.457 -1.149 6.465
302 HB2 SER 43 1HB SER 43 25.412 0.303 4.809
303 HB3 SER 43 2HB SER 43 26.048 -0.692 3.500
304 HG SER 43 HG SER 43 24.798 -2.399 4.910
305 H GLY 44 H GLY 44 27.765 -2.136 3.291
306 HA2 GLY 44 1HA GLY 44 29.050 -4.324 3.457
307 HA3 GLY 44 2HA GLY 44 27.584 -4.934 4.210
Start of MODEL 3
1 H1 GLY 1 H GLY 1 -22.567 -19.447 2.570
2 HA2 GLY 1 1HA GLY 1 -20.646 -20.266 4.628
3 HA3 GLY 1 2HA GLY 1 -20.020 -19.538 3.156
4 H SER 2 H SER 2 -19.679 -17.426 3.229
5 HA SER 2 HA SER 2 -20.803 -15.888 5.431
6 HB2 SER 2 1HB SER 2 -18.412 -15.665 5.024
7 HB3 SER 2 2HB SER 2 -18.715 -15.173 3.358
8 HG SER 2 HG SER 2 -19.516 -13.771 5.694
9 H SER 3 H SER 3 -21.981 -13.977 5.173
10 HA SER 3 HA SER 3 -23.449 -13.827 2.641
11 HB2 SER 3 1HB SER 3 -24.056 -12.861 5.432
12 HB3 SER 3 2HB SER 3 -24.990 -12.321 4.037
13 HG SER 3 HG SER 3 -24.813 -14.873 5.189
14 H GLY 4 H GLY 4 -24.236 -11.495 2.138
15 HA2 GLY 4 1HA GLY 4 -23.614 -9.454 1.284
16 HA3 GLY 4 2HA GLY 4 -22.845 -9.215 2.846
17 H SER 5 H SER 5 -22.313 -10.767 -0.307
18 HA SER 5 HA SER 5 -19.600 -9.719 -0.330
19 HB2 SER 5 1HB SER 5 -19.106 -11.806 0.670
20 HB3 SER 5 2HB SER 5 -20.257 -12.662 -0.356
21 HG SER 5 HG SER 5 -18.191 -13.028 -1.132
22 H SER 6 H SER 6 -19.212 -8.887 -2.265
23 HA SER 6 HA SER 6 -20.966 -9.548 -4.486
24 HB2 SER 6 1HB SER 6 -18.811 -7.447 -4.170
25 HB3 SER 6 2HB SER 6 -19.789 -7.651 -5.624
26 HG SER 6 HG SER 6 -20.398 -6.362 -3.352
27 H GLY 7 H GLY 7 -17.461 -9.447 -3.850
28 HA2 GLY 7 1HA GLY 7 -16.466 -11.690 -4.701
29 HA3 GLY 7 2HA GLY 7 -17.030 -11.085 -6.251
30 H LYS 8 H LYS 8 -15.443 -9.439 -3.528
31 HA LYS 8 HA LYS 8 -13.220 -8.773 -5.341
32 HB2 LYS 8 1HB LYS 8 -14.995 -6.918 -4.715
33 HB3 LYS 8 2HB LYS 8 -14.062 -6.837 -3.226
34 HG2 LYS 8 1HG LYS 8 -13.160 -5.188 -4.625
35 HG3 LYS 8 2HG LYS 8 -12.016 -6.531 -4.690
36 HD2 LYS 8 1HD LYS 8 -12.841 -7.223 -6.823
37 HD3 LYS 8 2HD LYS 8 -14.192 -6.090 -6.730
38 HE2 LYS 8 1HE LYS 8 -11.292 -5.269 -6.781
39 HE3 LYS 8 2HE LYS 8 -12.319 -5.355 -8.211
40 HZ1 LYS 8 3HZ LYS 8 -13.466 -3.514 -7.613
41 HZ2 LYS 8 1HZ LYS 8 -12.016 -3.142 -6.823
42 HZ3 LYS 8 2HZ LYS 8 -13.310 -3.797 -5.952
43 H LYS 9 H LYS 9 -11.186 -8.349 -4.303
44 HA LYS 9 HA LYS 9 -10.920 -9.811 -1.770
45 HB2 LYS 9 1HB LYS 9 -8.977 -9.231 -4.000
46 HB3 LYS 9 2HB LYS 9 -8.452 -9.839 -2.436
47 HG2 LYS 9 1HG LYS 9 -9.928 -11.800 -2.751
48 HG3 LYS 9 2HG LYS 9 -10.316 -11.204 -4.366
49 HD2 LYS 9 1HD LYS 9 -8.606 -12.621 -4.893
50 HD3 LYS 9 2HD LYS 9 -7.674 -11.155 -4.579
51 HE2 LYS 9 1HE LYS 9 -8.249 -12.970 -2.296
52 HE3 LYS 9 2HE LYS 9 -7.045 -13.481 -3.478
53 HZ1 LYS 9 3HZ LYS 9 -6.543 -11.895 -1.366
54 HZ2 LYS 9 1HZ LYS 9 -6.757 -10.751 -2.594
55 HZ3 LYS 9 2HZ LYS 9 -5.590 -11.963 -2.762
56 HA PRO 10 HA PRO 10 -9.756 -6.228 0.483
57 HB2 PRO 10 1HB PRO 10 -7.931 -7.255 2.211
58 HB3 PRO 10 2HB PRO 10 -9.665 -7.571 2.345
59 HG2 PRO 10 1HG PRO 10 -7.513 -9.285 1.164
60 HG3 PRO 10 2HG PRO 10 -8.865 -9.750 2.214
61 HD2 PRO 10 1HD PRO 10 -8.907 -10.123 -0.468
62 HD3 PRO 10 2HD PRO 10 -10.373 -9.776 0.471
63 H LEU 11 H LEU 11 -7.958 -4.801 1.016
64 HA LEU 11 HA LEU 11 -5.847 -4.961 -1.009
65 HB2 LEU 11 1HB LEU 11 -6.606 -2.631 0.742
66 HB3 LEU 11 2HB LEU 11 -5.521 -2.603 -0.646
67 HG LEU 11 HG LEU 11 -8.491 -3.125 -0.757
68 HD11 LEU 11 1HD1 LEU 11 -8.492 -0.888 -0.385
69 HD12 LEU 11 2HD1 LEU 11 -8.173 -0.862 -2.119
70 HD13 LEU 11 3HD1 LEU 11 -6.844 -0.674 -0.975
71 HD21 LEU 11 3HD2 LEU 11 -6.326 -3.052 -2.826
72 HD22 LEU 11 1HD2 LEU 11 -7.994 -2.658 -3.241
73 HD23 LEU 11 2HD2 LEU 11 -7.601 -4.248 -2.588
74 H VAL 12 H VAL 12 -4.153 -6.087 -0.256
75 HA VAL 12 HA VAL 12 -3.067 -5.316 2.376
76 HB VAL 12 HB VAL 12 -3.667 -7.520 2.746
77 HG11 VAL 12 1HG1 VAL 12 -4.509 -8.397 0.817
78 HG12 VAL 12 2HG1 VAL 12 -3.138 -7.862 -0.157
79 HG13 VAL 12 3HG1 VAL 12 -2.982 -9.276 0.886
80 HG21 VAL 12 3HG2 VAL 12 -0.915 -7.879 1.573
81 HG22 VAL 12 1HG2 VAL 12 -1.226 -7.093 3.121
82 HG23 VAL 12 2HG2 VAL 12 -1.652 -8.789 2.891
83 H CYS 13 H CYS 13 -0.868 -4.995 2.552
84 HA CYS 13 HA CYS 13 0.490 -4.217 0.165
85 HB2 CYS 13 1HB CYS 13 0.846 -3.009 2.254
86 HB3 CYS 13 2HB CYS 13 1.484 -4.465 3.012
87 H ASN 14 H ASN 14 1.521 -5.522 -1.180
88 HA ASN 14 HA ASN 14 2.090 -8.240 -0.548
89 HB2 ASN 14 1HB ASN 14 1.516 -7.338 -2.839
90 HB3 ASN 14 2HB ASN 14 3.146 -6.673 -2.906
91 HD21 ASN 14 1HD2 ASN 14 1.196 -9.452 -3.246
92 HD22 ASN 14 2HD2 ASN 14 2.453 -10.564 -3.658
93 H GLU 15 H GLU 15 3.725 -5.376 0.092
94 HA GLU 15 HA GLU 15 6.405 -6.420 -0.097
95 HB2 GLU 15 1HB GLU 15 5.622 -3.959 1.442
96 HB3 GLU 15 2HB GLU 15 7.137 -4.305 0.620
97 HG2 GLU 15 1HG GLU 15 4.668 -4.147 -1.016
98 HG3 GLU 15 2HG GLU 15 5.349 -2.649 -0.384
99 H CYS 16 H CYS 16 4.137 -5.637 2.518
100 HA CYS 16 HA CYS 16 5.837 -7.197 4.352
101 HB2 CYS 16 1HB CYS 16 4.906 -5.876 6.183
102 HB3 CYS 16 2HB CYS 16 5.640 -4.822 4.979
103 H GLY 17 H GLY 17 2.537 -6.540 3.297
104 HA2 GLY 17 1HA GLY 17 0.952 -8.322 3.068
105 HA3 GLY 17 2HA GLY 17 1.762 -9.162 4.382
106 H LYS 18 H LYS 18 0.697 -5.788 4.258
107 HA LYS 18 HA LYS 18 -0.952 -6.316 6.633
108 HB2 LYS 18 1HB LYS 18 0.969 -4.537 6.526
109 HB3 LYS 18 2HB LYS 18 -0.235 -3.562 5.695
110 HG2 LYS 18 1HG LYS 18 -1.734 -3.779 7.615
111 HG3 LYS 18 2HG LYS 18 -0.515 -4.745 8.451
112 HD2 LYS 18 1HD LYS 18 1.030 -2.706 8.024
113 HD3 LYS 18 2HD LYS 18 -0.480 -1.829 7.766
114 HE2 LYS 18 1HE LYS 18 0.147 -3.446 10.232
115 HE3 LYS 18 2HE LYS 18 0.398 -1.706 10.099
116 HZ1 LYS 18 3HZ LYS 18 -1.684 -2.029 11.134
117 HZ2 LYS 18 1HZ LYS 18 -2.174 -3.174 9.989
118 HZ3 LYS 18 2HZ LYS 18 -2.024 -1.548 9.547
119 H THR 19 H THR 19 -3.063 -6.468 6.319
120 HA THR 19 HA THR 19 -4.307 -5.694 3.868
121 HB THR 19 HB THR 19 -6.408 -6.421 4.919
122 HG1 THR 19 1HG THR 19 -4.771 -6.647 7.239
123 HG21 THR 19 3HG2 THR 19 -4.019 -8.040 4.648
124 HG22 THR 19 1HG2 THR 19 -5.681 -8.404 4.186
125 HG23 THR 19 2HG2 THR 19 -5.135 -8.718 5.834
126 H PHE 20 H PHE 20 -6.201 -4.271 3.738
127 HA PHE 20 HA PHE 20 -6.400 -2.192 5.761
128 HB2 PHE 20 1HB PHE 20 -5.681 -1.561 2.890
129 HB3 PHE 20 2HB PHE 20 -6.070 -0.374 4.131
130 HD1 PHE 20 2HD PHE 20 -4.534 -0.034 6.037
131 HD2 PHE 20 1HD PHE 20 -3.532 -2.549 2.752
132 HE1 PHE 20 2HE PHE 20 -2.166 0.050 6.699
133 HE2 PHE 20 1HE PHE 20 -1.163 -2.469 3.409
134 HZ PHE 20 HZ PHE 20 -0.476 -1.168 5.384
135 H ARG 21 H ARG 21 -8.173 -0.619 5.206
136 HA ARG 21 HA ARG 21 -10.362 -2.079 3.892
137 HB2 ARG 21 1HB ARG 21 -10.410 -1.307 6.397
138 HB3 ARG 21 2HB ARG 21 -10.802 0.262 5.707
139 HG2 ARG 21 1HG ARG 21 -12.362 -2.137 4.871
140 HG3 ARG 21 2HG ARG 21 -12.694 -1.375 6.428
141 HD2 ARG 21 1HD ARG 21 -12.737 -0.008 3.739
142 HD3 ARG 21 2HD ARG 21 -14.151 -0.496 4.672
143 HE ARG 21 HE ARG 21 -12.444 1.789 5.154
144 HH11 ARG 21 2HH1 ARG 21 -14.869 -0.359 6.430
145 HH12 ARG 21 1HH1 ARG 21 -15.406 0.757 7.641
146 HH21 ARG 21 2HH2 ARG 21 -13.143 3.267 6.745
147 HH22 ARG 21 1HH2 ARG 21 -14.424 2.819 7.819
148 H GLN 22 H GLN 22 -8.760 1.051 4.117
149 HA GLN 22 HA GLN 22 -10.394 2.045 1.891
150 HB2 GLN 22 1HB GLN 22 -8.499 3.560 3.695
151 HB3 GLN 22 2HB GLN 22 -9.554 4.263 2.476
152 HG2 GLN 22 1HG GLN 22 -11.462 3.898 3.723
153 HG3 GLN 22 2HG GLN 22 -10.712 2.626 4.686
154 HE21 GLN 22 1HE2 GLN 22 -9.394 3.180 6.415
155 HE22 GLN 22 2HE2 GLN 22 -9.383 4.768 7.094
156 H SER 23 H SER 23 -9.539 2.529 -0.063
157 HA SER 23 HA SER 23 -7.257 1.282 -0.982
158 HB2 SER 23 1HB SER 23 -7.462 2.640 -2.984
159 HB3 SER 23 2HB SER 23 -9.074 2.196 -2.421
160 HG SER 23 HG SER 23 -9.358 4.288 -2.628
161 H SER 24 H SER 24 -7.624 4.523 0.343
162 HA SER 24 HA SER 24 -5.023 5.442 -0.299
163 HB2 SER 24 1HB SER 24 -6.796 6.358 1.977
164 HB3 SER 24 2HB SER 24 -5.472 7.261 1.242
165 HG SER 24 HG SER 24 -6.839 6.881 -0.780
166 H CYS 25 H CYS 25 -6.396 3.918 2.589
167 HA CYS 25 HA CYS 25 -4.324 4.122 4.363
168 HB2 CYS 25 1HB CYS 25 -6.388 2.024 3.867
169 HB3 CYS 25 2HB CYS 25 -5.090 1.663 4.998
170 HG CYS 25 HG CYS 25 -6.082 2.921 7.003
171 H LEU 26 H LEU 26 -4.746 1.499 1.985
172 HA LEU 26 HA LEU 26 -2.270 0.256 2.534
173 HB2 LEU 26 1HB LEU 26 -3.909 -1.052 1.475
174 HB3 LEU 26 2HB LEU 26 -4.169 0.149 0.212
175 HG LEU 26 HG LEU 26 -1.800 -0.395 -0.562
176 HD11 LEU 26 1HD1 LEU 26 -1.072 -1.550 1.462
177 HD12 LEU 26 2HD1 LEU 26 -0.953 -2.596 0.047
178 HD13 LEU 26 3HD1 LEU 26 -2.283 -2.803 1.186
179 HD21 LEU 26 3HD2 LEU 26 -4.130 -1.246 -1.434
180 HD22 LEU 26 1HD2 LEU 26 -3.541 -2.795 -0.830
181 HD23 LEU 26 2HD2 LEU 26 -2.624 -1.922 -2.058
182 H SER 27 H SER 27 -3.239 2.190 -0.307
183 HA SER 27 HA SER 27 -0.799 2.391 -1.548
184 HB2 SER 27 1HB SER 27 -3.132 4.282 -1.397
185 HB3 SER 27 2HB SER 27 -1.684 4.714 -2.306
186 HG SER 27 HG SER 27 -2.163 3.266 -3.780
187 H LYS 28 H LYS 28 -2.137 4.931 0.572
188 HA LYS 28 HA LYS 28 0.116 6.494 0.802
189 HB2 LYS 28 1HB LYS 28 -2.108 5.943 2.759
190 HB3 LYS 28 2HB LYS 28 -0.836 7.108 3.101
191 HG2 LYS 28 1HG LYS 28 -2.505 7.263 0.613
192 HG3 LYS 28 2HG LYS 28 -3.009 8.000 2.136
193 HD2 LYS 28 1HD LYS 28 -0.916 9.295 2.177
194 HD3 LYS 28 2HD LYS 28 -0.460 8.583 0.627
195 HE2 LYS 28 1HE LYS 28 -2.665 9.517 -0.254
196 HE3 LYS 28 2HE LYS 28 -2.723 10.468 1.230
197 HZ1 LYS 28 3HZ LYS 28 -0.704 10.594 -0.933
198 HZ2 LYS 28 1HZ LYS 28 -0.444 11.285 0.590
199 HZ3 LYS 28 2HZ LYS 28 -1.719 11.829 -0.379
200 H HIS 29 H HIS 29 -0.352 3.342 1.983
201 HA HIS 29 HA HIS 29 1.748 3.588 4.002
202 HB2 HIS 29 1HB HIS 29 0.143 2.248 4.942
203 HB3 HIS 29 2HB HIS 29 -0.370 1.589 3.392
204 HD1 HIS 29 1HD HIS 29 1.654 0.825 6.326
205 HD2 HIS 29 2HD HIS 29 1.444 -0.462 2.381
206 HE1 HIS 29 1HE HIS 29 2.906 -1.355 6.262
207 H GLN 30 H GLN 30 1.090 2.080 0.897
208 HA GLN 30 HA GLN 30 3.298 0.388 0.723
209 HB2 GLN 30 1HB GLN 30 1.816 1.892 -1.436
210 HB3 GLN 30 2HB GLN 30 3.029 0.662 -1.763
211 HG2 GLN 30 1HG GLN 30 1.494 -0.779 -0.177
212 HG3 GLN 30 2HG GLN 30 0.273 0.379 -0.702
213 HE21 GLN 30 1HE2 GLN 30 1.223 -2.581 -1.274
214 HE22 GLN 30 2HE2 GLN 30 0.972 -2.707 -2.979
215 H ARG 31 H ARG 31 3.044 3.841 0.336
216 HA ARG 31 HA ARG 31 5.387 4.369 -1.081
217 HB2 ARG 31 1HB ARG 31 5.316 6.597 0.134
218 HB3 ARG 31 2HB ARG 31 3.871 6.157 -0.766
219 HG2 ARG 31 1HG ARG 31 2.610 5.887 1.112
220 HG3 ARG 31 2HG ARG 31 3.994 5.432 2.109
221 HD2 ARG 31 1HD ARG 31 4.703 7.935 1.602
222 HD3 ARG 31 2HD ARG 31 2.963 8.124 1.390
223 HE ARG 31 HE ARG 31 3.073 6.877 3.745
224 HH11 ARG 31 2HH1 ARG 31 4.864 9.595 2.511
225 HH12 ARG 31 1HH1 ARG 31 5.075 10.328 4.066
226 HH21 ARG 31 2HH2 ARG 31 3.344 7.832 5.798
227 HH22 ARG 31 1HH2 ARG 31 4.211 9.324 5.936
228 H ILE 32 H ILE 32 4.948 3.231 2.122
229 HA ILE 32 HA ILE 32 7.353 4.180 3.280
230 HB ILE 32 HB ILE 32 6.923 2.774 5.092
231 HG12 ILE 32 1HG1 ILE 32 5.259 1.033 3.260
232 HG13 ILE 32 2HG1 ILE 32 6.885 0.661 3.821
233 HG21 ILE 32 1HG2 ILE 32 4.648 4.003 3.787
234 HG22 ILE 32 2HG2 ILE 32 4.168 2.669 4.835
235 HG23 ILE 32 3HG2 ILE 32 5.112 4.008 5.488
236 HD11 ILE 32 3HD1 ILE 32 6.170 -0.026 5.831
237 HD12 ILE 32 1HD1 ILE 32 4.923 1.217 5.933
238 HD13 ILE 32 2HD1 ILE 32 4.638 -0.243 4.986
239 H HIS 33 H HIS 33 6.544 1.366 1.351
240 HA HIS 33 HA HIS 33 9.220 0.254 1.695
241 HB2 HIS 33 1HB HIS 33 6.930 -0.825 0.041
242 HB3 HIS 33 2HB HIS 33 8.394 -1.684 0.509
243 HD1 HIS 33 1HD HIS 33 8.642 -1.960 3.242
244 HD2 HIS 33 2HD HIS 33 4.845 -1.257 1.709
245 HE1 HIS 33 1HE HIS 33 7.044 -2.679 5.047
246 H SER 34 H SER 34 7.089 1.210 -1.000
247 HA SER 34 HA SER 34 8.929 0.955 -3.060
248 HB2 SER 34 1HB SER 34 6.510 1.361 -3.395
249 HB3 SER 34 2HB SER 34 6.725 3.021 -2.840
250 HG SER 34 HG SER 34 6.775 2.567 -5.211
251 H GLY 35 H GLY 35 10.846 1.877 -3.317
252 HA2 GLY 35 1HA GLY 35 12.059 3.793 -1.851
253 HA3 GLY 35 2HA GLY 35 12.401 3.573 -3.560
254 H GLU 36 H GLU 36 11.095 5.633 -1.190
255 HA GLU 36 HA GLU 36 9.561 7.262 -3.013
256 HB2 GLU 36 1HB GLU 36 10.227 7.367 -0.102
257 HB3 GLU 36 2HB GLU 36 9.672 8.834 -0.895
258 HG2 GLU 36 1HG GLU 36 7.682 7.513 -1.692
259 HG3 GLU 36 2HG GLU 36 8.209 6.227 -0.608
260 H LYS 37 H LYS 37 10.030 9.484 -3.480
261 HA LYS 37 HA LYS 37 12.921 10.052 -3.524
262 HB2 LYS 37 1HB LYS 37 11.805 9.645 -5.746
263 HB3 LYS 37 2HB LYS 37 10.850 11.093 -5.460
264 HG2 LYS 37 1HG LYS 37 12.795 12.473 -5.496
265 HG3 LYS 37 2HG LYS 37 13.857 11.063 -5.526
266 HD2 LYS 37 1HD LYS 37 11.840 11.292 -7.687
267 HD3 LYS 37 2HD LYS 37 13.200 12.416 -7.729
268 HE2 LYS 37 1HE LYS 37 14.147 10.711 -8.888
269 HE3 LYS 37 2HE LYS 37 14.546 10.163 -7.261
270 HZ1 LYS 37 3HZ LYS 37 13.636 8.320 -8.368
271 HZ2 LYS 37 1HZ LYS 37 12.355 9.217 -9.013
272 HZ3 LYS 37 2HZ LYS 37 12.399 8.877 -7.357
273 HA PRO 38 HA PRO 38 12.002 13.550 -0.979
274 HB2 PRO 38 1HB PRO 38 14.379 14.828 -1.269
275 HB3 PRO 38 2HB PRO 38 14.177 13.392 -0.258
276 HG2 PRO 38 1HG PRO 38 15.254 13.614 -3.043
277 HG3 PRO 38 2HG PRO 38 15.862 12.654 -1.681
278 HD2 PRO 38 1HD PRO 38 14.378 11.578 -3.674
279 HD3 PRO 38 2HD PRO 38 14.310 10.981 -2.003
280 H SER 39 H SER 39 10.377 14.395 -2.435
281 HA SER 39 HA SER 39 11.383 16.639 -4.059
282 HB2 SER 39 1HB SER 39 9.455 16.301 -5.573
283 HB3 SER 39 2HB SER 39 10.517 14.894 -5.535
284 HG SER 39 HG SER 39 8.495 14.089 -5.311
285 H GLY 40 H GLY 40 10.790 18.538 -3.265
286 HA2 GLY 40 1HA GLY 40 8.097 19.076 -2.455
287 HA3 GLY 40 2HA GLY 40 9.189 18.991 -1.080
288 HA PRO 41 HA PRO 41 9.145 23.327 -2.834
289 HB2 PRO 41 1HB PRO 41 8.473 24.553 -0.507
290 HB3 PRO 41 2HB PRO 41 7.273 23.943 -1.652
291 HG2 PRO 41 1HG PRO 41 8.292 22.691 0.869
292 HG3 PRO 41 2HG PRO 41 6.629 22.790 0.261
293 HD2 PRO 41 1HD PRO 41 8.141 20.557 0.015
294 HD3 PRO 41 2HD PRO 41 6.921 21.021 -1.188
295 H SER 42 H SER 42 10.759 21.532 -0.454
296 HA SER 42 HA SER 42 12.413 23.449 0.742
297 HB2 SER 42 1HB SER 42 12.623 20.497 0.279
298 HB3 SER 42 2HB SER 42 14.029 21.374 0.882
299 HG SER 42 HG SER 42 12.658 20.537 2.554
300 H SER 43 H SER 43 14.211 24.491 0.113
301 HA SER 43 HA SER 43 15.686 23.611 -2.233
302 HB2 SER 43 1HB SER 43 14.489 26.389 -2.094
303 HB3 SER 43 2HB SER 43 15.514 25.755 -3.382
304 HG SER 43 HG SER 43 13.645 24.033 -3.288
305 H GLY 44 H GLY 44 17.805 24.324 -2.286
306 HA2 GLY 44 1HA GLY 44 19.323 26.174 -1.438
307 HA3 GLY 44 2HA GLY 44 18.677 25.758 0.142
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -16.215 -17.109 -8.429
2 HA2 GLY 1 1HA GLY 1 -17.590 -15.435 -7.473
3 HA3 GLY 1 2HA GLY 1 -17.709 -16.403 -6.011
4 H SER 2 H SER 2 -14.848 -15.331 -7.820
5 HA SER 2 HA SER 2 -13.649 -14.406 -5.348
6 HB2 SER 2 1HB SER 2 -12.425 -15.700 -7.189
7 HB3 SER 2 2HB SER 2 -12.439 -14.192 -8.104
8 HG SER 2 HG SER 2 -10.855 -13.515 -6.915
9 H SER 3 H SER 3 -14.569 -13.025 -8.488
10 HA SER 3 HA SER 3 -14.879 -10.422 -7.193
11 HB2 SER 3 1HB SER 3 -13.639 -9.255 -8.922
12 HB3 SER 3 2HB SER 3 -12.597 -10.479 -8.197
13 HG SER 3 HG SER 3 -13.939 -10.587 -10.689
14 H GLY 4 H GLY 4 -17.022 -10.191 -7.467
15 HA2 GLY 4 1HA GLY 4 -18.009 -9.982 -10.204
16 HA3 GLY 4 2HA GLY 4 -18.795 -11.174 -9.180
17 H SER 5 H SER 5 -20.759 -9.983 -9.483
18 HA SER 5 HA SER 5 -21.228 -7.332 -8.952
19 HB2 SER 5 1HB SER 5 -23.029 -8.619 -9.804
20 HB3 SER 5 2HB SER 5 -22.949 -9.761 -8.463
21 HG SER 5 HG SER 5 -24.440 -8.537 -7.631
22 H SER 6 H SER 6 -21.108 -10.005 -6.627
23 HA SER 6 HA SER 6 -20.924 -8.004 -4.470
24 HB2 SER 6 1HB SER 6 -23.052 -9.242 -4.362
25 HB3 SER 6 2HB SER 6 -22.162 -10.763 -4.308
26 HG SER 6 HG SER 6 -22.662 -8.956 -2.317
27 H GLY 7 H GLY 7 -19.134 -8.071 -3.270
28 HA2 GLY 7 1HA GLY 7 -17.493 -9.276 -1.995
29 HA3 GLY 7 2HA GLY 7 -17.594 -10.578 -3.172
30 H LYS 8 H LYS 8 -15.313 -8.926 -2.114
31 HA LYS 8 HA LYS 8 -13.988 -8.587 -4.651
32 HB2 LYS 8 1HB LYS 8 -13.412 -6.275 -4.421
33 HB3 LYS 8 2HB LYS 8 -15.161 -6.402 -4.278
34 HG2 LYS 8 1HG LYS 8 -14.691 -6.483 -1.728
35 HG3 LYS 8 2HG LYS 8 -13.131 -5.790 -2.176
36 HD2 LYS 8 1HD LYS 8 -15.749 -4.614 -3.082
37 HD3 LYS 8 2HD LYS 8 -14.971 -4.149 -1.567
38 HE2 LYS 8 1HE LYS 8 -12.887 -3.833 -3.176
39 HE3 LYS 8 2HE LYS 8 -14.160 -3.608 -4.374
40 HZ1 LYS 8 3HZ LYS 8 -15.105 -1.992 -2.602
41 HZ2 LYS 8 1HZ LYS 8 -13.844 -1.484 -3.608
42 HZ3 LYS 8 2HZ LYS 8 -13.517 -1.968 -2.021
43 H LYS 9 H LYS 9 -11.783 -8.764 -4.492
44 HA LYS 9 HA LYS 9 -10.734 -9.935 -2.137
45 HB2 LYS 9 1HB LYS 9 -9.659 -10.683 -4.041
46 HB3 LYS 9 2HB LYS 9 -9.609 -9.084 -4.770
47 HG2 LYS 9 1HG LYS 9 -7.914 -8.459 -3.020
48 HG3 LYS 9 2HG LYS 9 -7.855 -10.169 -2.585
49 HD2 LYS 9 1HD LYS 9 -6.109 -9.996 -4.090
50 HD3 LYS 9 2HD LYS 9 -7.435 -10.524 -5.130
51 HE2 LYS 9 1HE LYS 9 -7.656 -8.456 -6.121
52 HE3 LYS 9 2HE LYS 9 -6.954 -7.604 -4.747
53 HZ1 LYS 9 3HZ LYS 9 -5.012 -9.321 -5.795
54 HZ2 LYS 9 1HZ LYS 9 -5.012 -7.630 -5.777
55 HZ3 LYS 9 2HZ LYS 9 -5.681 -8.461 -7.088
56 HA PRO 10 HA PRO 10 -9.561 -6.355 0.153
57 HB2 PRO 10 1HB PRO 10 -7.723 -7.509 1.785
58 HB3 PRO 10 2HB PRO 10 -9.464 -7.747 1.979
59 HG2 PRO 10 1HG PRO 10 -7.443 -9.530 0.677
60 HG3 PRO 10 2HG PRO 10 -8.775 -9.957 1.766
61 HD2 PRO 10 1HD PRO 10 -8.936 -10.261 -0.920
62 HD3 PRO 10 2HD PRO 10 -10.347 -9.869 0.083
63 H LEU 11 H LEU 11 -7.593 -5.116 0.762
64 HA LEU 11 HA LEU 11 -5.551 -5.354 -1.343
65 HB2 LEU 11 1HB LEU 11 -6.212 -2.923 0.305
66 HB3 LEU 11 2HB LEU 11 -5.171 -2.999 -1.115
67 HG LEU 11 HG LEU 11 -8.156 -3.443 -1.122
68 HD11 LEU 11 1HD1 LEU 11 -8.289 -1.270 -2.202
69 HD12 LEU 11 2HD1 LEU 11 -6.545 -1.066 -2.042
70 HD13 LEU 11 3HD1 LEU 11 -7.561 -1.126 -0.601
71 HD21 LEU 11 3HD2 LEU 11 -6.223 -4.259 -2.951
72 HD22 LEU 11 1HD2 LEU 11 -6.908 -2.788 -3.641
73 HD23 LEU 11 2HD2 LEU 11 -7.962 -4.140 -3.225
74 H VAL 12 H VAL 12 -3.889 -6.489 -0.536
75 HA VAL 12 HA VAL 12 -2.897 -5.789 2.147
76 HB VAL 12 HB VAL 12 -3.238 -8.048 2.315
77 HG11 VAL 12 1HG1 VAL 12 -2.817 -8.052 -0.626
78 HG12 VAL 12 2HG1 VAL 12 -2.523 -9.552 0.257
79 HG13 VAL 12 3HG1 VAL 12 -4.106 -8.778 0.335
80 HG21 VAL 12 3HG2 VAL 12 -0.841 -7.532 2.688
81 HG22 VAL 12 1HG2 VAL 12 -1.124 -9.197 2.179
82 HG23 VAL 12 2HG2 VAL 12 -0.511 -8.014 1.024
83 H CYS 13 H CYS 13 -0.734 -5.325 2.465
84 HA CYS 13 HA CYS 13 0.629 -4.122 0.275
85 HB2 CYS 13 1HB CYS 13 0.761 -3.376 2.679
86 HB3 CYS 13 2HB CYS 13 1.772 -4.782 2.993
87 H ASN 14 H ASN 14 1.730 -5.161 -1.237
88 HA ASN 14 HA ASN 14 2.496 -7.885 -1.010
89 HB2 ASN 14 1HB ASN 14 3.610 -5.980 -3.057
90 HB3 ASN 14 2HB ASN 14 3.281 -7.702 -3.225
91 HD21 ASN 14 1HD2 ASN 14 2.338 -4.978 -4.443
92 HD22 ASN 14 2HD2 ASN 14 0.637 -5.224 -4.613
93 H GLU 15 H GLU 15 3.833 -5.209 0.357
94 HA GLU 15 HA GLU 15 6.604 -6.112 0.103
95 HB2 GLU 15 1HB GLU 15 5.473 -3.654 1.452
96 HB3 GLU 15 2HB GLU 15 7.181 -4.017 1.253
97 HG2 GLU 15 1HG GLU 15 6.126 -2.370 -0.372
98 HG3 GLU 15 2HG GLU 15 7.114 -3.663 -1.048
99 H CYS 16 H CYS 16 4.233 -5.338 2.641
100 HA CYS 16 HA CYS 16 5.821 -6.959 4.516
101 HB2 CYS 16 1HB CYS 16 4.793 -5.717 6.315
102 HB3 CYS 16 2HB CYS 16 5.456 -4.578 5.148
103 H GLY 17 H GLY 17 2.663 -6.499 3.086
104 HA2 GLY 17 1HA GLY 17 1.102 -8.236 2.764
105 HA3 GLY 17 2HA GLY 17 1.895 -9.153 4.036
106 H LYS 18 H LYS 18 0.623 -5.838 4.061
107 HA LYS 18 HA LYS 18 -1.055 -6.607 6.352
108 HB2 LYS 18 1HB LYS 18 0.788 -4.738 6.442
109 HB3 LYS 18 2HB LYS 18 -0.443 -3.760 5.654
110 HG2 LYS 18 1HG LYS 18 -1.982 -4.230 7.511
111 HG3 LYS 18 2HG LYS 18 -0.710 -5.159 8.308
112 HD2 LYS 18 1HD LYS 18 0.699 -3.139 8.360
113 HD3 LYS 18 2HD LYS 18 -0.611 -2.222 7.614
114 HE2 LYS 18 1HE LYS 18 -0.744 -1.790 9.933
115 HE3 LYS 18 2HE LYS 18 -2.045 -2.923 9.572
116 HZ1 LYS 18 3HZ LYS 18 -0.936 -4.652 10.601
117 HZ2 LYS 18 1HZ LYS 18 -0.567 -3.345 11.610
118 HZ3 LYS 18 2HZ LYS 18 0.577 -3.903 10.497
119 H THR 19 H THR 19 -3.146 -6.816 5.953
120 HA THR 19 HA THR 19 -4.323 -5.854 3.518
121 HB THR 19 HB THR 19 -6.370 -6.906 4.268
122 HG1 THR 19 1HG THR 19 -5.079 -6.795 6.757
123 HG21 THR 19 3HG2 THR 19 -4.994 -8.537 3.357
124 HG22 THR 19 1HG2 THR 19 -5.371 -9.213 4.941
125 HG23 THR 19 2HG2 THR 19 -3.819 -8.422 4.666
126 H PHE 20 H PHE 20 -5.603 -4.118 3.198
127 HA PHE 20 HA PHE 20 -6.288 -2.477 5.546
128 HB2 PHE 20 1HB PHE 20 -5.335 -1.540 2.833
129 HB3 PHE 20 2HB PHE 20 -5.973 -0.475 4.082
130 HD1 PHE 20 1HD PHE 20 -3.191 -2.692 3.159
131 HD2 PHE 20 2HD PHE 20 -4.656 0.156 5.962
132 HE1 PHE 20 1HE PHE 20 -0.940 -2.500 4.135
133 HE2 PHE 20 2HE PHE 20 -2.408 0.353 6.942
134 HZ PHE 20 HZ PHE 20 -0.546 -0.975 6.028
135 H ARG 21 H ARG 21 -8.238 -1.318 5.458
136 HA ARG 21 HA ARG 21 -10.319 -2.619 4.002
137 HB2 ARG 21 1HB ARG 21 -10.437 -0.069 5.622
138 HB3 ARG 21 2HB ARG 21 -11.812 -1.037 5.109
139 HG2 ARG 21 1HG ARG 21 -9.634 -2.077 6.902
140 HG3 ARG 21 2HG ARG 21 -11.118 -1.329 7.496
141 HD2 ARG 21 1HD ARG 21 -12.261 -3.086 5.919
142 HD3 ARG 21 2HD ARG 21 -10.726 -3.935 6.099
143 HE ARG 21 HE ARG 21 -11.976 -3.092 8.569
144 HH11 ARG 21 2HH1 ARG 21 -11.571 -5.631 6.222
145 HH12 ARG 21 1HH1 ARG 21 -12.034 -6.893 7.315
146 HH21 ARG 21 2HH2 ARG 21 -12.587 -4.745 10.017
147 HH22 ARG 21 1HH2 ARG 21 -12.613 -6.388 9.473
148 H GLN 22 H GLN 22 -9.279 0.797 4.035
149 HA GLN 22 HA GLN 22 -10.655 1.319 1.560
150 HB2 GLN 22 1HB GLN 22 -8.768 3.059 3.158
151 HB3 GLN 22 2HB GLN 22 -9.748 3.598 1.801
152 HG2 GLN 22 1HG GLN 22 -10.798 2.530 4.412
153 HG3 GLN 22 2HG GLN 22 -10.733 4.227 3.938
154 HE21 GLN 22 1HE2 GLN 22 -13.081 2.943 4.693
155 HE22 GLN 22 2HE2 GLN 22 -14.133 2.859 3.326
156 H SER 23 H SER 23 -9.433 2.515 -0.212
157 HA SER 23 HA SER 23 -7.232 0.823 -1.040
158 HB2 SER 23 1HB SER 23 -9.208 1.662 -2.506
159 HB3 SER 23 2HB SER 23 -8.277 3.155 -2.626
160 HG SER 23 HG SER 23 -7.493 2.030 -4.275
161 H SER 24 H SER 24 -7.791 4.304 -0.566
162 HA SER 24 HA SER 24 -5.236 5.211 -1.175
163 HB2 SER 24 1HB SER 24 -5.796 7.213 0.081
164 HB3 SER 24 2HB SER 24 -7.221 6.669 -0.803
165 HG SER 24 HG SER 24 -6.828 5.778 1.825
166 H CYS 25 H CYS 25 -6.487 3.784 1.772
167 HA CYS 25 HA CYS 25 -4.454 4.454 3.549
168 HB2 CYS 25 1HB CYS 25 -6.288 2.076 3.365
169 HB3 CYS 25 2HB CYS 25 -5.091 2.206 4.647
170 HG CYS 25 HG CYS 25 -6.232 4.151 6.030
171 H LEU 26 H LEU 26 -4.768 1.368 1.781
172 HA LEU 26 HA LEU 26 -2.319 0.285 2.417
173 HB2 LEU 26 1HB LEU 26 -3.844 -1.098 1.307
174 HB3 LEU 26 2HB LEU 26 -4.047 0.043 -0.020
175 HG LEU 26 HG LEU 26 -1.592 -0.495 -0.581
176 HD11 LEU 26 1HD1 LEU 26 -2.234 -2.987 0.979
177 HD12 LEU 26 2HD1 LEU 26 -1.221 -1.684 1.600
178 HD13 LEU 26 3HD1 LEU 26 -0.726 -2.575 0.162
179 HD21 LEU 26 3HD2 LEU 26 -3.148 -2.935 -1.071
180 HD22 LEU 26 1HD2 LEU 26 -2.390 -1.821 -2.208
181 HD23 LEU 26 2HD2 LEU 26 -3.963 -1.434 -1.511
182 H SER 27 H SER 27 -3.055 2.093 -0.572
183 HA SER 27 HA SER 27 -0.504 2.219 -1.611
184 HB2 SER 27 1HB SER 27 -2.940 3.911 -1.864
185 HB3 SER 27 2HB SER 27 -1.424 4.583 -2.463
186 HG SER 27 HG SER 27 -2.923 3.065 -3.816
187 H LYS 28 H LYS 28 -2.073 4.742 0.366
188 HA LYS 28 HA LYS 28 0.154 6.390 0.654
189 HB2 LYS 28 1HB LYS 28 -2.328 5.968 2.283
190 HB3 LYS 28 2HB LYS 28 -1.065 7.042 2.871
191 HG2 LYS 28 1HG LYS 28 -2.322 7.330 0.157
192 HG3 LYS 28 2HG LYS 28 -2.942 8.132 1.601
193 HD2 LYS 28 1HD LYS 28 -0.073 8.406 0.759
194 HD3 LYS 28 2HD LYS 28 -1.334 9.446 0.094
195 HE2 LYS 28 1HE LYS 28 -1.908 10.222 2.313
196 HE3 LYS 28 2HE LYS 28 -0.748 9.108 3.034
197 HZ1 LYS 28 3HZ LYS 28 -0.195 11.646 2.492
198 HZ2 LYS 28 1HZ LYS 28 0.312 10.937 1.042
199 HZ3 LYS 28 2HZ LYS 28 0.980 10.429 2.510
200 H HIS 29 H HIS 29 -0.375 3.299 1.908
201 HA HIS 29 HA HIS 29 1.432 3.679 4.172
202 HB2 HIS 29 1HB HIS 29 -0.237 2.302 4.932
203 HB3 HIS 29 2HB HIS 29 -0.511 1.581 3.349
204 HD1 HIS 29 1HD HIS 29 1.228 1.042 6.534
205 HD2 HIS 29 2HD HIS 29 1.393 -0.484 2.672
206 HE1 HIS 29 1HE HIS 29 2.531 -1.102 6.713
207 H GLN 30 H GLN 30 1.237 2.031 1.069
208 HA GLN 30 HA GLN 30 3.516 0.440 1.241
209 HB2 GLN 30 1HB GLN 30 2.330 1.822 -1.171
210 HB3 GLN 30 2HB GLN 30 3.550 0.557 -1.245
211 HG2 GLN 30 1HG GLN 30 1.861 -0.855 0.082
212 HG3 GLN 30 2HG GLN 30 0.684 0.359 -0.417
213 HE21 GLN 30 1HE2 GLN 30 1.774 -2.580 -1.145
214 HE22 GLN 30 2HE2 GLN 30 1.501 -2.612 -2.850
215 H ARG 31 H ARG 31 3.169 3.849 0.438
216 HA ARG 31 HA ARG 31 5.625 4.452 -0.619
217 HB2 ARG 31 1HB ARG 31 5.355 6.696 0.524
218 HB3 ARG 31 2HB ARG 31 4.006 6.179 -0.479
219 HG2 ARG 31 1HG ARG 31 2.605 5.915 1.293
220 HG3 ARG 31 2HG ARG 31 3.912 5.511 2.408
221 HD2 ARG 31 1HD ARG 31 4.595 8.027 1.917
222 HD3 ARG 31 2HD ARG 31 2.872 8.163 1.570
223 HE ARG 31 HE ARG 31 3.149 6.848 4.012
224 HH11 ARG 31 2HH1 ARG 31 3.784 9.978 2.627
225 HH12 ARG 31 1HH1 ARG 31 3.576 10.827 4.123
226 HH21 ARG 31 2HH2 ARG 31 2.874 7.954 5.988
227 HH22 ARG 31 1HH2 ARG 31 3.059 9.675 6.034
228 H ILE 32 H ILE 32 4.896 3.422 2.586
229 HA ILE 32 HA ILE 32 7.145 4.460 3.939
230 HB ILE 32 HB ILE 32 6.621 3.016 5.718
231 HG12 ILE 32 1HG1 ILE 32 5.241 1.280 3.664
232 HG13 ILE 32 2HG1 ILE 32 6.679 0.884 4.599
233 HG21 ILE 32 1HG2 ILE 32 3.910 2.923 5.328
234 HG22 ILE 32 2HG2 ILE 32 4.813 4.309 5.936
235 HG23 ILE 32 3HG2 ILE 32 4.416 4.200 4.222
236 HD11 ILE 32 3HD1 ILE 32 5.063 -0.288 5.716
237 HD12 ILE 32 1HD1 ILE 32 5.091 1.215 6.638
238 HD13 ILE 32 2HD1 ILE 32 3.826 0.938 5.440
239 H HIS 33 H HIS 33 6.633 1.543 2.045
240 HA HIS 33 HA HIS 33 9.268 0.509 2.688
241 HB2 HIS 33 1HB HIS 33 7.280 -0.550 0.672
242 HB3 HIS 33 2HB HIS 33 8.659 -1.407 1.354
243 HD1 HIS 33 1HD HIS 33 8.452 -1.634 4.130
244 HD2 HIS 33 2HD HIS 33 4.966 -1.145 1.923
245 HE1 HIS 33 1HE HIS 33 6.593 -2.434 5.623
246 H SER 34 H SER 34 7.548 1.650 -0.211
247 HA SER 34 HA SER 34 9.658 1.429 -2.017
248 HB2 SER 34 1HB SER 34 7.153 2.019 -2.412
249 HB3 SER 34 2HB SER 34 7.681 3.687 -2.191
250 HG SER 34 HG SER 34 8.336 3.612 -4.174
251 H GLY 35 H GLY 35 10.989 3.112 -2.971
252 HA2 GLY 35 1HA GLY 35 11.391 5.588 -1.577
253 HA3 GLY 35 2HA GLY 35 12.649 4.412 -1.227
254 H GLU 36 H GLU 36 14.103 5.972 -2.202
255 HA GLU 36 HA GLU 36 13.869 6.344 -5.079
256 HB2 GLU 36 1HB GLU 36 15.612 7.934 -4.891
257 HB3 GLU 36 2HB GLU 36 14.590 8.179 -3.482
258 HG2 GLU 36 1HG GLU 36 16.899 6.345 -3.200
259 HG3 GLU 36 2HG GLU 36 17.229 8.072 -3.323
260 H LYS 37 H LYS 37 15.406 5.642 -6.580
261 HA LYS 37 HA LYS 37 16.485 3.073 -6.115
262 HB2 LYS 37 1HB LYS 37 17.269 3.153 -8.351
263 HB3 LYS 37 2HB LYS 37 15.756 4.048 -8.338
264 HG2 LYS 37 1HG LYS 37 18.274 5.568 -7.945
265 HG3 LYS 37 2HG LYS 37 17.908 4.959 -9.561
266 HD2 LYS 37 1HD LYS 37 15.668 6.054 -9.378
267 HD3 LYS 37 2HD LYS 37 16.208 6.784 -7.865
268 HE2 LYS 37 1HE LYS 37 17.736 7.109 -10.431
269 HE3 LYS 37 2HE LYS 37 16.411 8.185 -9.991
270 HZ1 LYS 37 3HZ LYS 37 17.634 8.621 -7.882
271 HZ2 LYS 37 1HZ LYS 37 18.422 9.181 -9.271
272 HZ3 LYS 37 2HZ LYS 37 18.947 7.763 -8.515
273 HA PRO 38 HA PRO 38 20.458 3.885 -4.430
274 HB2 PRO 38 1HB PRO 38 21.889 1.836 -5.488
275 HB3 PRO 38 2HB PRO 38 20.690 1.610 -4.208
276 HG2 PRO 38 1HG PRO 38 20.421 1.164 -7.156
277 HG3 PRO 38 2HG PRO 38 19.847 0.156 -5.815
278 HD2 PRO 38 1HD PRO 38 18.217 1.833 -7.180
279 HD3 PRO 38 2HD PRO 38 17.989 1.472 -5.456
280 H SER 39 H SER 39 22.835 4.039 -5.107
281 HA SER 39 HA SER 39 22.979 5.805 -7.381
282 HB2 SER 39 1HB SER 39 25.133 4.871 -5.469
283 HB3 SER 39 2HB SER 39 25.325 6.143 -6.674
284 HG SER 39 HG SER 39 24.139 6.231 -4.214
285 H GLY 40 H GLY 40 23.487 5.230 -9.385
286 HA2 GLY 40 1HA GLY 40 24.829 2.630 -9.784
287 HA3 GLY 40 2HA GLY 40 23.690 3.341 -10.918
288 HA PRO 41 HA PRO 41 27.874 4.264 -12.569
289 HB2 PRO 41 1HB PRO 41 27.148 3.958 -15.167
290 HB3 PRO 41 2HB PRO 41 27.628 2.603 -14.138
291 HG2 PRO 41 1HG PRO 41 24.882 3.535 -14.884
292 HG3 PRO 41 2HG PRO 41 25.519 1.882 -14.799
293 HD2 PRO 41 1HD PRO 41 23.998 2.960 -12.835
294 HD3 PRO 41 2HD PRO 41 25.276 1.771 -12.509
295 H SER 42 H SER 42 27.464 6.446 -11.795
296 HA SER 42 HA SER 42 25.777 8.320 -12.906
297 HB2 SER 42 1HB SER 42 28.450 8.512 -11.566
298 HB3 SER 42 2HB SER 42 27.735 9.960 -12.276
299 HG SER 42 HG SER 42 27.141 9.702 -10.083
300 H SER 43 H SER 43 29.109 7.565 -13.897
301 HA SER 43 HA SER 43 29.464 9.396 -15.906
302 HB2 SER 43 1HB SER 43 30.471 6.630 -15.441
303 HB3 SER 43 2HB SER 43 30.747 7.345 -17.029
304 HG SER 43 HG SER 43 31.322 9.120 -15.089
305 H GLY 44 H GLY 44 27.828 6.255 -16.129
306 HA2 GLY 44 1HA GLY 44 26.159 7.216 -18.266
307 HA3 GLY 44 2HA GLY 44 27.346 6.037 -18.804
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -25.027 5.328 -11.855
2 HA2 GLY 1 1HA GLY 1 -24.427 3.454 -14.050
3 HA3 GLY 1 2HA GLY 1 -24.160 5.178 -14.261
4 H SER 2 H SER 2 -23.464 2.874 -11.630
5 HA SER 2 HA SER 2 -20.704 3.900 -11.612
6 HB2 SER 2 1HB SER 2 -21.939 4.287 -9.521
7 HB3 SER 2 2HB SER 2 -22.261 2.559 -9.386
8 HG SER 2 HG SER 2 -19.745 2.580 -9.616
9 H SER 3 H SER 3 -19.271 2.592 -12.511
10 HA SER 3 HA SER 3 -19.500 -0.298 -12.047
11 HB2 SER 3 1HB SER 3 -19.035 1.056 -14.710
12 HB3 SER 3 2HB SER 3 -18.714 -0.654 -14.423
13 HG SER 3 HG SER 3 -20.885 -0.966 -13.998
14 H GLY 4 H GLY 4 -17.478 -1.465 -12.312
15 HA2 GLY 4 1HA GLY 4 -14.994 -0.490 -12.881
16 HA3 GLY 4 2HA GLY 4 -15.274 0.024 -11.224
17 H SER 5 H SER 5 -15.079 -1.424 -9.583
18 HA SER 5 HA SER 5 -14.607 -4.236 -10.307
19 HB2 SER 5 1HB SER 5 -12.651 -4.381 -9.006
20 HB3 SER 5 2HB SER 5 -12.477 -2.848 -9.859
21 HG SER 5 HG SER 5 -12.143 -2.153 -7.886
22 H SER 6 H SER 6 -15.641 -5.674 -9.067
23 HA SER 6 HA SER 6 -17.637 -4.926 -7.278
24 HB2 SER 6 1HB SER 6 -17.753 -7.313 -6.669
25 HB3 SER 6 2HB SER 6 -17.615 -7.100 -8.414
26 HG SER 6 HG SER 6 -15.953 -8.364 -8.261
27 H GLY 7 H GLY 7 -14.387 -6.208 -6.597
28 HA2 GLY 7 1HA GLY 7 -13.011 -5.620 -4.800
29 HA3 GLY 7 2HA GLY 7 -14.362 -4.762 -4.076
30 H LYS 8 H LYS 8 -13.428 -8.097 -4.922
31 HA LYS 8 HA LYS 8 -14.911 -9.083 -2.612
32 HB2 LYS 8 1HB LYS 8 -13.493 -10.508 -4.867
33 HB3 LYS 8 2HB LYS 8 -14.293 -11.335 -3.536
34 HG2 LYS 8 1HG LYS 8 -16.421 -10.562 -4.208
35 HG3 LYS 8 2HG LYS 8 -15.721 -9.402 -5.340
36 HD2 LYS 8 1HD LYS 8 -14.975 -11.153 -6.784
37 HD3 LYS 8 2HD LYS 8 -15.391 -12.388 -5.593
38 HE2 LYS 8 1HE LYS 8 -17.761 -11.777 -5.815
39 HE3 LYS 8 2HE LYS 8 -17.329 -10.574 -7.029
40 HZ1 LYS 8 3HZ LYS 8 -16.187 -12.938 -7.871
41 HZ2 LYS 8 1HZ LYS 8 -17.544 -12.170 -8.531
42 HZ3 LYS 8 2HZ LYS 8 -17.739 -13.361 -7.346
43 H LYS 9 H LYS 9 -11.617 -9.299 -3.946
44 HA LYS 9 HA LYS 9 -10.582 -10.448 -1.515
45 HB2 LYS 9 1HB LYS 9 -9.328 -11.228 -3.261
46 HB3 LYS 9 2HB LYS 9 -9.506 -9.746 -4.192
47 HG2 LYS 9 1HG LYS 9 -7.692 -8.760 -3.236
48 HG3 LYS 9 2HG LYS 9 -7.878 -9.635 -1.714
49 HD2 LYS 9 1HD LYS 9 -7.067 -11.013 -4.260
50 HD3 LYS 9 2HD LYS 9 -5.887 -10.256 -3.188
51 HE2 LYS 9 1HE LYS 9 -5.879 -12.403 -2.380
52 HE3 LYS 9 2HE LYS 9 -7.114 -11.674 -1.354
53 HZ1 LYS 9 3HZ LYS 9 -8.772 -12.816 -2.377
54 HZ2 LYS 9 1HZ LYS 9 -7.521 -13.932 -2.607
55 HZ3 LYS 9 2HZ LYS 9 -7.975 -12.898 -3.866
56 HA PRO 10 HA PRO 10 -9.750 -6.668 0.597
57 HB2 PRO 10 1HB PRO 10 -7.898 -7.595 2.352
58 HB3 PRO 10 2HB PRO 10 -9.624 -7.944 2.503
59 HG2 PRO 10 1HG PRO 10 -7.438 -9.650 1.375
60 HG3 PRO 10 2HG PRO 10 -8.776 -10.108 2.444
61 HD2 PRO 10 1HD PRO 10 -8.818 -10.574 -0.223
62 HD3 PRO 10 2HD PRO 10 -10.289 -10.227 0.709
63 H LEU 11 H LEU 11 -8.017 -5.157 1.023
64 HA LEU 11 HA LEU 11 -5.888 -5.362 -0.976
65 HB2 LEU 11 1HB LEU 11 -6.585 -2.940 0.657
66 HB3 LEU 11 2HB LEU 11 -5.689 -3.012 -0.858
67 HG LEU 11 HG LEU 11 -8.651 -3.406 -0.466
68 HD11 LEU 11 1HD1 LEU 11 -8.701 -1.481 -2.094
69 HD12 LEU 11 2HD1 LEU 11 -6.972 -1.299 -1.801
70 HD13 LEU 11 3HD1 LEU 11 -8.115 -1.103 -0.474
71 HD21 LEU 11 3HD2 LEU 11 -8.853 -3.913 -2.766
72 HD22 LEU 11 1HD2 LEU 11 -7.591 -4.974 -2.140
73 HD23 LEU 11 2HD2 LEU 11 -7.155 -3.542 -3.073
74 H VAL 12 H VAL 12 -4.201 -6.447 -0.128
75 HA VAL 12 HA VAL 12 -3.144 -5.505 2.459
76 HB VAL 12 HB VAL 12 -3.673 -7.712 2.911
77 HG11 VAL 12 1HG1 VAL 12 -4.426 -8.831 1.114
78 HG12 VAL 12 2HG1 VAL 12 -3.254 -8.080 0.029
79 HG13 VAL 12 3HG1 VAL 12 -2.777 -9.452 1.031
80 HG21 VAL 12 3HG2 VAL 12 -1.223 -7.147 3.238
81 HG22 VAL 12 1HG2 VAL 12 -1.631 -8.863 3.192
82 HG23 VAL 12 2HG2 VAL 12 -0.912 -8.089 1.779
83 H CYS 13 H CYS 13 -0.937 -5.159 2.650
84 HA CYS 13 HA CYS 13 0.407 -4.352 0.275
85 HB2 CYS 13 1HB CYS 13 0.684 -3.294 2.542
86 HB3 CYS 13 2HB CYS 13 1.607 -4.713 3.026
87 H ASN 14 H ASN 14 1.217 -5.757 -1.133
88 HA ASN 14 HA ASN 14 1.936 -8.424 -0.471
89 HB2 ASN 14 1HB ASN 14 2.935 -7.086 -2.957
90 HB3 ASN 14 2HB ASN 14 2.337 -8.728 -2.737
91 HD21 ASN 14 1HD2 ASN 14 1.648 -5.852 -4.094
92 HD22 ASN 14 2HD2 ASN 14 -0.076 -5.952 -4.158
93 H GLU 15 H GLU 15 3.484 -5.611 0.219
94 HA GLU 15 HA GLU 15 6.190 -6.597 -0.229
95 HB2 GLU 15 1HB GLU 15 5.298 -4.008 1.049
96 HB3 GLU 15 2HB GLU 15 6.926 -4.411 0.521
97 HG2 GLU 15 1HG GLU 15 4.744 -4.507 -1.487
98 HG3 GLU 15 2HG GLU 15 5.309 -2.930 -0.941
99 H CYS 16 H CYS 16 4.032 -5.751 2.444
100 HA CYS 16 HA CYS 16 5.889 -7.123 4.277
101 HB2 CYS 16 1HB CYS 16 5.040 -5.705 6.072
102 HB3 CYS 16 2HB CYS 16 5.672 -4.715 4.760
103 H GLY 17 H GLY 17 2.541 -6.649 3.315
104 HA2 GLY 17 1HA GLY 17 0.998 -8.477 3.309
105 HA3 GLY 17 2HA GLY 17 1.882 -9.182 4.655
106 H LYS 18 H LYS 18 0.698 -5.864 4.280
107 HA LYS 18 HA LYS 18 -0.849 -6.238 6.753
108 HB2 LYS 18 1HB LYS 18 1.032 -4.443 6.468
109 HB3 LYS 18 2HB LYS 18 -0.203 -3.553 5.588
110 HG2 LYS 18 1HG LYS 18 -1.668 -3.687 7.567
111 HG3 LYS 18 2HG LYS 18 -0.366 -4.494 8.444
112 HD2 LYS 18 1HD LYS 18 -0.059 -1.783 7.167
113 HD3 LYS 18 2HD LYS 18 -0.584 -2.009 8.837
114 HE2 LYS 18 1HE LYS 18 1.921 -3.320 7.868
115 HE3 LYS 18 2HE LYS 18 1.937 -1.611 8.300
116 HZ1 LYS 18 3HZ LYS 18 2.138 -2.218 10.405
117 HZ2 LYS 18 1HZ LYS 18 2.009 -3.856 9.999
118 HZ3 LYS 18 2HZ LYS 18 0.618 -2.957 10.341
119 H THR 19 H THR 19 -2.970 -6.418 6.539
120 HA THR 19 HA THR 19 -4.279 -5.721 4.062
121 HB THR 19 HB THR 19 -6.314 -6.639 5.113
122 HG1 THR 19 1HG THR 19 -5.730 -7.754 7.250
123 HG21 THR 19 3HG2 THR 19 -3.781 -8.120 4.862
124 HG22 THR 19 1HG2 THR 19 -5.353 -8.430 4.127
125 HG23 THR 19 2HG2 THR 19 -5.041 -8.937 5.787
126 H PHE 20 H PHE 20 -5.839 -4.157 3.754
127 HA PHE 20 HA PHE 20 -6.252 -2.252 5.959
128 HB2 PHE 20 1HB PHE 20 -5.663 -1.596 3.066
129 HB3 PHE 20 2HB PHE 20 -6.185 -0.417 4.265
130 HD1 PHE 20 1HD PHE 20 -3.497 -2.856 3.502
131 HD2 PHE 20 2HD PHE 20 -4.634 0.646 5.637
132 HE1 PHE 20 1HE PHE 20 -1.154 -2.506 4.169
133 HE2 PHE 20 2HE PHE 20 -2.293 1.002 6.306
134 HZ PHE 20 HZ PHE 20 -0.550 -0.574 5.572
135 H ARG 21 H ARG 21 -8.112 -0.701 5.394
136 HA ARG 21 HA ARG 21 -10.375 -2.352 4.606
137 HB2 ARG 21 1HB ARG 21 -10.028 0.197 6.119
138 HB3 ARG 21 2HB ARG 21 -11.575 -0.108 5.341
139 HG2 ARG 21 1HG ARG 21 -11.822 -2.177 6.583
140 HG3 ARG 21 2HG ARG 21 -10.239 -1.936 7.326
141 HD2 ARG 21 1HD ARG 21 -12.506 0.028 7.586
142 HD3 ARG 21 2HD ARG 21 -12.227 -1.281 8.733
143 HE ARG 21 HE ARG 21 -10.672 1.141 8.435
144 HH11 ARG 21 2HH1 ARG 21 -10.826 -2.086 9.732
145 HH12 ARG 21 1HH1 ARG 21 -9.619 -1.797 10.941
146 HH21 ARG 21 2HH2 ARG 21 -9.083 1.534 10.022
147 HH22 ARG 21 1HH2 ARG 21 -8.629 0.262 11.106
148 H GLN 22 H GLN 22 -9.046 0.854 3.805
149 HA GLN 22 HA GLN 22 -10.606 0.807 1.315
150 HB2 GLN 22 1HB GLN 22 -9.232 3.140 2.659
151 HB3 GLN 22 2HB GLN 22 -10.237 3.223 1.218
152 HG2 GLN 22 1HG GLN 22 -11.350 2.117 3.757
153 HG3 GLN 22 2HG GLN 22 -11.228 3.860 3.522
154 HE21 GLN 22 1HE2 GLN 22 -13.364 4.315 3.376
155 HE22 GLN 22 2HE2 GLN 22 -14.390 3.743 2.109
156 H SER 23 H SER 23 -9.480 1.952 -0.556
157 HA SER 23 HA SER 23 -7.027 0.566 -1.075
158 HB2 SER 23 1HB SER 23 -7.214 1.379 -3.300
159 HB3 SER 23 2HB SER 23 -8.867 1.070 -2.769
160 HG SER 23 HG SER 23 -7.551 3.585 -2.823
161 H SER 24 H SER 24 -7.952 3.928 -0.504
162 HA SER 24 HA SER 24 -5.486 5.129 -1.054
163 HB2 SER 24 1HB SER 24 -7.578 5.987 0.961
164 HB3 SER 24 2HB SER 24 -6.294 7.008 0.313
165 HG SER 24 HG SER 24 -8.608 6.040 -0.934
166 H CYS 25 H CYS 25 -6.732 3.640 1.891
167 HA CYS 25 HA CYS 25 -4.714 4.434 3.654
168 HB2 CYS 25 1HB CYS 25 -6.419 1.939 3.612
169 HB3 CYS 25 2HB CYS 25 -5.364 2.375 4.951
170 HG CYS 25 HG CYS 25 -6.729 4.755 5.532
171 H LEU 26 H LEU 26 -5.007 1.331 1.915
172 HA LEU 26 HA LEU 26 -2.515 0.309 2.643
173 HB2 LEU 26 1HB LEU 26 -4.122 -1.154 1.705
174 HB3 LEU 26 2HB LEU 26 -4.265 -0.175 0.247
175 HG LEU 26 HG LEU 26 -2.081 -0.888 -0.496
176 HD11 LEU 26 1HD1 LEU 26 -1.168 -1.058 1.869
177 HD12 LEU 26 2HD1 LEU 26 -0.642 -2.289 0.720
178 HD13 LEU 26 3HD1 LEU 26 -1.884 -2.670 1.913
179 HD21 LEU 26 3HD2 LEU 26 -2.542 -3.453 -0.452
180 HD22 LEU 26 1HD2 LEU 26 -3.650 -2.373 -1.299
181 HD23 LEU 26 2HD2 LEU 26 -4.061 -2.974 0.308
182 H SER 27 H SER 27 -3.454 2.233 -0.183
183 HA SER 27 HA SER 27 -0.995 2.190 -1.513
184 HB2 SER 27 1HB SER 27 -3.321 4.088 -1.514
185 HB3 SER 27 2HB SER 27 -1.856 4.489 -2.410
186 HG SER 27 HG SER 27 -3.829 2.868 -3.131
187 H LYS 28 H LYS 28 -2.310 4.801 0.534
188 HA LYS 28 HA LYS 28 -0.046 6.390 0.630
189 HB2 LYS 28 1HB LYS 28 -2.220 5.953 2.678
190 HB3 LYS 28 2HB LYS 28 -0.974 7.181 2.855
191 HG2 LYS 28 1HG LYS 28 -1.813 7.851 0.433
192 HG3 LYS 28 2HG LYS 28 -3.290 7.076 1.011
193 HD2 LYS 28 1HD LYS 28 -1.836 9.195 2.579
194 HD3 LYS 28 2HD LYS 28 -3.103 9.571 1.409
195 HE2 LYS 28 1HE LYS 28 -3.505 7.650 3.690
196 HE3 LYS 28 2HE LYS 28 -3.817 9.379 3.836
197 HZ1 LYS 28 3HZ LYS 28 -5.761 9.130 2.830
198 HZ2 LYS 28 1HZ LYS 28 -5.542 7.453 2.879
199 HZ3 LYS 28 2HZ LYS 28 -5.061 8.329 1.515
200 H HIS 29 H HIS 29 -0.502 3.302 1.954
201 HA HIS 29 HA HIS 29 1.578 3.642 3.977
202 HB2 HIS 29 1HB HIS 29 -0.030 2.312 4.935
203 HB3 HIS 29 2HB HIS 29 -0.494 1.582 3.401
204 HD1 HIS 29 1HD HIS 29 1.544 1.016 6.388
205 HD2 HIS 29 2HD HIS 29 1.322 -0.504 2.528
206 HE1 HIS 29 1HE HIS 29 2.828 -1.145 6.442
207 H GLN 30 H GLN 30 0.990 2.062 0.899
208 HA GLN 30 HA GLN 30 3.227 0.390 0.811
209 HB2 GLN 30 1HB GLN 30 1.569 1.722 -1.309
210 HB3 GLN 30 2HB GLN 30 2.983 0.771 -1.745
211 HG2 GLN 30 1HG GLN 30 0.910 -0.409 0.042
212 HG3 GLN 30 2HG GLN 30 0.624 -0.321 -1.695
213 HE21 GLN 30 1HE2 GLN 30 0.615 -2.750 -0.811
214 HE22 GLN 30 2HE2 GLN 30 2.087 -3.595 -1.136
215 H ARG 31 H ARG 31 2.871 3.810 0.083
216 HA ARG 31 HA ARG 31 5.213 4.341 -1.263
217 HB2 ARG 31 1HB ARG 31 5.106 6.608 -0.147
218 HB3 ARG 31 2HB ARG 31 3.644 6.101 -0.982
219 HG2 ARG 31 1HG ARG 31 2.445 5.895 0.941
220 HG3 ARG 31 2HG ARG 31 3.863 5.491 1.912
221 HD2 ARG 31 1HD ARG 31 3.317 8.226 0.771
222 HD3 ARG 31 2HD ARG 31 2.867 7.731 2.402
223 HE ARG 31 HE ARG 31 5.508 8.384 1.447
224 HH11 ARG 31 2HH1 ARG 31 3.641 6.748 3.888
225 HH12 ARG 31 1HH1 ARG 31 4.906 6.794 5.071
226 HH21 ARG 31 2HH2 ARG 31 7.181 8.449 2.995
227 HH22 ARG 31 1HH2 ARG 31 6.919 7.762 4.563
228 H ILE 32 H ILE 32 4.823 3.278 1.966
229 HA ILE 32 HA ILE 32 7.209 4.318 3.088
230 HB ILE 32 HB ILE 32 6.845 2.903 4.926
231 HG12 ILE 32 1HG1 ILE 32 5.257 1.164 3.033
232 HG13 ILE 32 2HG1 ILE 32 6.761 0.757 3.853
233 HG21 ILE 32 1HG2 ILE 32 4.118 2.848 4.846
234 HG22 ILE 32 2HG2 ILE 32 5.092 4.248 5.289
235 HG23 ILE 32 3HG2 ILE 32 4.495 4.076 3.639
236 HD11 ILE 32 3HD1 ILE 32 3.984 0.781 4.872
237 HD12 ILE 32 1HD1 ILE 32 5.300 -0.351 5.181
238 HD13 ILE 32 2HD1 ILE 32 5.274 1.214 5.994
239 H HIS 33 H HIS 33 6.465 1.456 1.211
240 HA HIS 33 HA HIS 33 9.152 0.389 1.589
241 HB2 HIS 33 1HB HIS 33 6.930 -0.737 -0.120
242 HB3 HIS 33 2HB HIS 33 8.376 -1.574 0.438
243 HD1 HIS 33 1HD HIS 33 8.490 -1.851 3.160
244 HD2 HIS 33 2HD HIS 33 4.769 -1.084 1.479
245 HE1 HIS 33 1HE HIS 33 6.811 -2.526 4.907
246 H SER 34 H SER 34 7.082 1.631 -1.005
247 HA SER 34 HA SER 34 9.498 2.250 -2.544
248 HB2 SER 34 1HB SER 34 8.611 1.356 -4.581
249 HB3 SER 34 2HB SER 34 8.466 0.090 -3.362
250 HG SER 34 HG SER 34 6.565 0.815 -4.840
251 H GLY 35 H GLY 35 9.493 4.368 -2.872
252 HA2 GLY 35 1HA GLY 35 8.405 6.153 -4.189
253 HA3 GLY 35 2HA GLY 35 6.901 5.684 -3.410
254 H GLU 36 H GLU 36 10.134 6.180 -2.026
255 HA GLU 36 HA GLU 36 8.934 8.129 -0.181
256 HB2 GLU 36 1HB GLU 36 10.659 7.594 1.380
257 HB3 GLU 36 2HB GLU 36 10.017 6.074 0.774
258 HG2 GLU 36 1HG GLU 36 11.926 5.961 -0.807
259 HG3 GLU 36 2HG GLU 36 12.591 7.402 -0.038
260 H LYS 37 H LYS 37 9.981 10.089 0.260
261 HA LYS 37 HA LYS 37 11.219 11.325 -1.962
262 HB2 LYS 37 1HB LYS 37 10.957 12.225 0.912
263 HB3 LYS 37 2HB LYS 37 11.558 13.244 -0.390
264 HG2 LYS 37 1HG LYS 37 9.491 13.446 -1.372
265 HG3 LYS 37 2HG LYS 37 8.892 11.941 -0.671
266 HD2 LYS 37 1HD LYS 37 7.777 13.435 0.646
267 HD3 LYS 37 2HD LYS 37 9.262 13.279 1.587
268 HE2 LYS 37 1HE LYS 37 8.986 15.375 -0.538
269 HE3 LYS 37 2HE LYS 37 8.351 15.640 1.085
270 HZ1 LYS 37 3HZ LYS 37 10.527 16.529 1.024
271 HZ2 LYS 37 1HZ LYS 37 11.168 15.134 0.313
272 HZ3 LYS 37 2HZ LYS 37 10.627 15.095 1.915
273 HA PRO 38 HA PRO 38 15.434 10.186 -1.312
274 HB2 PRO 38 1HB PRO 38 16.582 12.082 -2.879
275 HB3 PRO 38 2HB PRO 38 15.741 10.673 -3.537
276 HG2 PRO 38 1HG PRO 38 14.755 13.479 -3.192
277 HG3 PRO 38 2HG PRO 38 14.542 12.379 -4.567
278 HD2 PRO 38 1HD PRO 38 12.605 12.795 -2.722
279 HD3 PRO 38 2HD PRO 38 12.816 11.239 -3.550
280 H SER 39 H SER 39 13.951 12.557 0.234
281 HA SER 39 HA SER 39 15.461 14.641 0.907
282 HB2 SER 39 1HB SER 39 13.974 12.741 2.700
283 HB3 SER 39 2HB SER 39 14.827 14.127 3.378
284 HG SER 39 HG SER 39 12.830 14.234 1.361
285 H GLY 40 H GLY 40 16.026 11.409 2.313
286 HA2 GLY 40 1HA GLY 40 18.867 12.130 2.578
287 HA3 GLY 40 2HA GLY 40 18.003 11.489 3.968
288 HA PRO 41 HA PRO 41 19.378 8.147 0.724
289 HB2 PRO 41 1HB PRO 41 22.069 7.977 1.038
290 HB3 PRO 41 2HB PRO 41 21.308 8.997 -0.188
291 HG2 PRO 41 1HG PRO 41 22.398 9.753 2.496
292 HG3 PRO 41 2HG PRO 41 22.567 10.592 0.943
293 HD2 PRO 41 1HD PRO 41 20.788 11.367 2.831
294 HD3 PRO 41 2HD PRO 41 20.479 11.556 1.093
295 H SER 42 H SER 42 20.828 8.924 3.861
296 HA SER 42 HA SER 42 21.030 6.114 4.569
297 HB2 SER 42 1HB SER 42 22.831 7.588 5.278
298 HB3 SER 42 2HB SER 42 21.686 8.625 6.130
299 HG SER 42 HG SER 42 21.854 5.891 6.765
300 H SER 43 H SER 43 19.624 5.011 5.787
301 HA SER 43 HA SER 43 17.773 6.338 7.559
302 HB2 SER 43 1HB SER 43 15.761 5.307 6.454
303 HB3 SER 43 2HB SER 43 16.516 6.601 5.524
304 HG SER 43 HG SER 43 16.383 5.090 4.025
305 H GLY 44 H GLY 44 16.647 4.877 8.948
306 HA2 GLY 44 1HA GLY 44 16.137 2.519 9.476
307 HA3 GLY 44 2HA GLY 44 17.757 2.138 8.910
Start of MODEL 6
1 H1 GLY 1 H GLY 1 -22.463 -4.561 -3.253
2 HA2 GLY 1 1HA GLY 1 -23.341 -1.805 -3.421
3 HA3 GLY 1 2HA GLY 1 -21.948 -2.510 -4.228
4 H SER 2 H SER 2 -24.428 -0.845 -5.039
5 HA SER 2 HA SER 2 -26.187 -2.085 -6.659
6 HB2 SER 2 1HB SER 2 -26.045 -0.087 -8.179
7 HB3 SER 2 2HB SER 2 -26.206 0.315 -6.469
8 HG SER 2 HG SER 2 -23.909 0.606 -6.442
9 H SER 3 H SER 3 -22.978 -1.024 -7.806
10 HA SER 3 HA SER 3 -23.213 -2.910 -10.038
11 HB2 SER 3 1HB SER 3 -21.233 -1.675 -10.954
12 HB3 SER 3 2HB SER 3 -22.657 -0.662 -10.717
13 HG SER 3 HG SER 3 -21.679 0.376 -9.128
14 H GLY 4 H GLY 4 -21.778 -4.561 -10.376
15 HA2 GLY 4 1HA GLY 4 -20.468 -5.648 -8.111
16 HA3 GLY 4 2HA GLY 4 -20.341 -6.244 -9.759
17 H SER 5 H SER 5 -18.612 -5.027 -7.248
18 HA SER 5 HA SER 5 -16.757 -3.375 -8.689
19 HB2 SER 5 1HB SER 5 -16.546 -4.634 -5.943
20 HB3 SER 5 2HB SER 5 -15.447 -3.417 -6.593
21 HG SER 5 HG SER 5 -17.161 -1.961 -6.658
22 H SER 6 H SER 6 -14.378 -3.909 -8.640
23 HA SER 6 HA SER 6 -14.014 -6.512 -9.858
24 HB2 SER 6 1HB SER 6 -12.965 -4.671 -10.984
25 HB3 SER 6 2HB SER 6 -12.169 -4.143 -9.501
26 HG SER 6 HG SER 6 -10.927 -6.036 -9.560
27 H GLY 7 H GLY 7 -13.697 -8.207 -8.570
28 HA2 GLY 7 1HA GLY 7 -12.826 -9.549 -6.925
29 HA3 GLY 7 2HA GLY 7 -11.435 -8.475 -6.940
30 H LYS 8 H LYS 8 -14.036 -9.601 -5.142
31 HA LYS 8 HA LYS 8 -14.345 -7.286 -3.450
32 HB2 LYS 8 1HB LYS 8 -15.342 -10.127 -3.176
33 HB3 LYS 8 2HB LYS 8 -15.751 -8.823 -2.068
34 HG2 LYS 8 1HG LYS 8 -16.705 -7.586 -4.031
35 HG3 LYS 8 2HG LYS 8 -16.481 -9.060 -4.975
36 HD2 LYS 8 1HD LYS 8 -18.050 -10.247 -3.710
37 HD3 LYS 8 2HD LYS 8 -17.990 -9.086 -2.382
38 HE2 LYS 8 1HE LYS 8 -20.052 -8.766 -3.543
39 HE3 LYS 8 2HE LYS 8 -19.005 -7.398 -3.917
40 HZ1 LYS 8 3HZ LYS 8 -18.414 -8.543 -6.008
41 HZ2 LYS 8 1HZ LYS 8 -20.054 -8.141 -5.913
42 HZ3 LYS 8 2HZ LYS 8 -19.560 -9.737 -5.657
43 H LYS 9 H LYS 9 -11.746 -8.958 -3.809
44 HA LYS 9 HA LYS 9 -11.169 -9.988 -1.210
45 HB2 LYS 9 1HB LYS 9 -9.479 -9.343 -3.617
46 HB3 LYS 9 2HB LYS 9 -8.760 -9.884 -2.106
47 HG2 LYS 9 1HG LYS 9 -10.474 -11.843 -2.332
48 HG3 LYS 9 2HG LYS 9 -10.470 -11.377 -4.035
49 HD2 LYS 9 1HD LYS 9 -8.193 -11.860 -4.280
50 HD3 LYS 9 2HD LYS 9 -7.911 -11.842 -2.538
51 HE2 LYS 9 1HE LYS 9 -9.167 -13.894 -2.281
52 HE3 LYS 9 2HE LYS 9 -9.583 -13.888 -3.994
53 HZ1 LYS 9 3HZ LYS 9 -7.401 -14.375 -4.598
54 HZ2 LYS 9 1HZ LYS 9 -7.670 -15.363 -3.252
55 HZ3 LYS 9 2HZ LYS 9 -6.770 -13.941 -3.090
56 HA PRO 10 HA PRO 10 -9.989 -6.353 0.955
57 HB2 PRO 10 1HB PRO 10 -8.068 -7.345 2.598
58 HB3 PRO 10 2HB PRO 10 -9.789 -7.682 2.819
59 HG2 PRO 10 1HG PRO 10 -7.676 -9.376 1.546
60 HG3 PRO 10 2HG PRO 10 -8.968 -9.852 2.663
61 HD2 PRO 10 1HD PRO 10 -9.136 -10.244 -0.011
62 HD3 PRO 10 2HD PRO 10 -10.559 -9.909 0.997
63 H LEU 11 H LEU 11 -8.099 -4.975 1.499
64 HA LEU 11 HA LEU 11 -6.104 -5.110 -0.653
65 HB2 LEU 11 1HB LEU 11 -6.642 -2.717 1.072
66 HB3 LEU 11 2HB LEU 11 -5.887 -2.780 -0.519
67 HG LEU 11 HG LEU 11 -8.811 -3.279 0.040
68 HD11 LEU 11 1HD1 LEU 11 -7.968 -0.960 -1.555
69 HD12 LEU 11 2HD1 LEU 11 -7.585 -0.873 0.163
70 HD13 LEU 11 3HD1 LEU 11 -9.253 -1.112 -0.357
71 HD21 LEU 11 3HD2 LEU 11 -7.513 -4.335 -1.998
72 HD22 LEU 11 1HD2 LEU 11 -7.693 -2.709 -2.657
73 HD23 LEU 11 2HD2 LEU 11 -9.121 -3.636 -2.197
74 H VAL 12 H VAL 12 -4.402 -6.244 0.095
75 HA VAL 12 HA VAL 12 -3.225 -5.388 2.660
76 HB VAL 12 HB VAL 12 -3.799 -7.592 3.087
77 HG11 VAL 12 1HG1 VAL 12 -3.504 -7.902 0.189
78 HG12 VAL 12 2HG1 VAL 12 -2.984 -9.303 1.129
79 HG13 VAL 12 3HG1 VAL 12 -4.625 -8.679 1.307
80 HG21 VAL 12 3HG2 VAL 12 -1.776 -8.781 3.298
81 HG22 VAL 12 1HG2 VAL 12 -1.089 -8.024 1.860
82 HG23 VAL 12 2HG2 VAL 12 -1.319 -7.078 3.330
83 H CYS 13 H CYS 13 -0.994 -5.128 2.773
84 HA CYS 13 HA CYS 13 0.270 -4.333 0.335
85 HB2 CYS 13 1HB CYS 13 0.631 -3.233 2.565
86 HB3 CYS 13 2HB CYS 13 1.540 -4.658 3.059
87 H ASN 14 H ASN 14 1.077 -5.738 -1.070
88 HA ASN 14 HA ASN 14 1.749 -8.417 -0.408
89 HB2 ASN 14 1HB ASN 14 2.755 -7.098 -2.902
90 HB3 ASN 14 2HB ASN 14 2.135 -8.731 -2.677
91 HD21 ASN 14 1HD2 ASN 14 -0.243 -8.650 -1.798
92 HD22 ASN 14 2HD2 ASN 14 -1.301 -7.639 -2.718
93 H GLU 15 H GLU 15 3.354 -5.625 0.255
94 HA GLU 15 HA GLU 15 6.039 -6.656 -0.208
95 HB2 GLU 15 1HB GLU 15 5.217 -4.064 1.108
96 HB3 GLU 15 2HB GLU 15 6.819 -4.489 0.523
97 HG2 GLU 15 1HG GLU 15 4.564 -4.516 -1.408
98 HG3 GLU 15 2HG GLU 15 5.194 -2.960 -0.871
99 H CYS 16 H CYS 16 3.943 -5.740 2.500
100 HA CYS 16 HA CYS 16 5.786 -7.163 4.307
101 HB2 CYS 16 1HB CYS 16 4.924 -5.746 6.118
102 HB3 CYS 16 2HB CYS 16 5.625 -4.775 4.828
103 H GLY 17 H GLY 17 2.441 -6.661 3.357
104 HA2 GLY 17 1HA GLY 17 0.863 -8.448 3.367
105 HA3 GLY 17 2HA GLY 17 1.764 -9.196 4.678
106 H LYS 18 H LYS 18 0.624 -5.853 4.400
107 HA LYS 18 HA LYS 18 -0.888 -6.263 6.890
108 HB2 LYS 18 1HB LYS 18 1.034 -4.497 6.608
109 HB3 LYS 18 2HB LYS 18 -0.216 -3.553 5.807
110 HG2 LYS 18 1HG LYS 18 -1.602 -3.673 7.809
111 HG3 LYS 18 2HG LYS 18 -0.361 -4.637 8.614
112 HD2 LYS 18 1HD LYS 18 1.221 -2.703 8.184
113 HD3 LYS 18 2HD LYS 18 -0.203 -1.764 7.730
114 HE2 LYS 18 1HE LYS 18 -1.169 -2.123 9.927
115 HE3 LYS 18 2HE LYS 18 0.193 -3.144 10.383
116 HZ1 LYS 18 3HZ LYS 18 1.453 -1.376 10.833
117 HZ2 LYS 18 1HZ LYS 18 0.013 -0.488 10.841
118 HZ3 LYS 18 2HZ LYS 18 0.968 -0.538 9.447
119 H THR 19 H THR 19 -3.016 -6.381 6.709
120 HA THR 19 HA THR 19 -4.346 -5.595 4.271
121 HB THR 19 HB THR 19 -6.391 -6.467 5.351
122 HG1 THR 19 1HG THR 19 -5.497 -5.885 7.550
123 HG21 THR 19 3HG2 THR 19 -5.296 -8.834 5.875
124 HG22 THR 19 1HG2 THR 19 -3.898 -8.067 5.123
125 HG23 THR 19 2HG2 THR 19 -5.414 -8.202 4.233
126 H PHE 20 H PHE 20 -5.956 -4.033 4.058
127 HA PHE 20 HA PHE 20 -6.272 -2.154 6.294
128 HB2 PHE 20 1HB PHE 20 -5.615 -1.440 3.431
129 HB3 PHE 20 2HB PHE 20 -6.154 -0.275 4.635
130 HD1 PHE 20 1HD PHE 20 -3.435 -2.569 3.691
131 HD2 PHE 20 2HD PHE 20 -4.674 0.570 6.284
132 HE1 PHE 20 1HE PHE 20 -1.108 -2.266 4.431
133 HE2 PHE 20 2HE PHE 20 -2.349 0.879 7.027
134 HZ PHE 20 HZ PHE 20 -0.562 -0.539 6.100
135 H ARG 21 H ARG 21 -8.125 -0.639 5.940
136 HA ARG 21 HA ARG 21 -10.382 -2.155 4.888
137 HB2 ARG 21 1HB ARG 21 -10.191 -0.900 7.207
138 HB3 ARG 21 2HB ARG 21 -10.702 0.484 6.249
139 HG2 ARG 21 1HG ARG 21 -12.651 -0.459 7.196
140 HG3 ARG 21 2HG ARG 21 -12.656 -0.892 5.485
141 HD2 ARG 21 1HD ARG 21 -13.287 -2.829 6.728
142 HD3 ARG 21 2HD ARG 21 -11.653 -3.089 6.120
143 HE ARG 21 HE ARG 21 -11.230 -2.080 8.590
144 HH11 ARG 21 2HH1 ARG 21 -13.192 -4.693 7.386
145 HH12 ARG 21 1HH1 ARG 21 -13.063 -5.630 8.838
146 HH21 ARG 21 2HH2 ARG 21 -11.054 -3.305 10.505
147 HH22 ARG 21 1HH2 ARG 21 -11.848 -4.840 10.611
148 H GLN 22 H GLN 22 -8.968 1.093 4.597
149 HA GLN 22 HA GLN 22 -10.681 1.657 2.306
150 HB2 GLN 22 1HB GLN 22 -8.642 3.410 3.688
151 HB3 GLN 22 2HB GLN 22 -9.758 3.925 2.430
152 HG2 GLN 22 1HG GLN 22 -10.719 2.764 5.021
153 HG3 GLN 22 2HG GLN 22 -10.352 4.479 4.840
154 HE21 GLN 22 1HE2 GLN 22 -12.441 1.872 3.848
155 HE22 GLN 22 2HE2 GLN 22 -13.700 2.862 3.200
156 H SER 23 H SER 23 -9.614 2.747 0.398
157 HA SER 23 HA SER 23 -7.537 1.006 -0.583
158 HB2 SER 23 1HB SER 23 -9.559 1.942 -1.901
159 HB3 SER 23 2HB SER 23 -8.597 3.412 -2.051
160 HG SER 23 HG SER 23 -8.166 0.873 -3.146
161 H SER 24 H SER 24 -7.864 4.452 0.167
162 HA SER 24 HA SER 24 -5.287 5.224 -0.672
163 HB2 SER 24 1HB SER 24 -5.668 7.248 0.684
164 HB3 SER 24 2HB SER 24 -7.083 6.851 -0.290
165 HG SER 24 HG SER 24 -7.832 7.271 1.737
166 H CYS 25 H CYS 25 -6.497 3.856 2.312
167 HA CYS 25 HA CYS 25 -4.371 4.432 4.018
168 HB2 CYS 25 1HB CYS 25 -6.448 2.290 3.905
169 HB3 CYS 25 2HB CYS 25 -5.103 2.089 5.022
170 HG CYS 25 HG CYS 25 -6.689 5.061 5.132
171 H LEU 26 H LEU 26 -4.891 1.477 2.089
172 HA LEU 26 HA LEU 26 -2.400 0.314 2.689
173 HB2 LEU 26 1HB LEU 26 -4.103 -1.093 1.864
174 HB3 LEU 26 2HB LEU 26 -4.356 -0.080 0.444
175 HG LEU 26 HG LEU 26 -2.175 -0.801 -0.437
176 HD11 LEU 26 1HD1 LEU 26 -2.105 -2.773 1.834
177 HD12 LEU 26 2HD1 LEU 26 -1.190 -1.265 1.828
178 HD13 LEU 26 3HD1 LEU 26 -0.877 -2.491 0.599
179 HD21 LEU 26 3HD2 LEU 26 -4.077 -3.021 0.303
180 HD22 LEU 26 1HD2 LEU 26 -2.818 -3.136 -0.927
181 HD23 LEU 26 2HD2 LEU 26 -4.150 -1.999 -1.133
182 H SER 27 H SER 27 -3.473 2.022 -0.252
183 HA SER 27 HA SER 27 -1.076 1.990 -1.634
184 HB2 SER 27 1HB SER 27 -3.113 2.737 -2.703
185 HB3 SER 27 2HB SER 27 -3.236 4.110 -1.603
186 HG SER 27 HG SER 27 -1.320 4.929 -2.522
187 H LYS 28 H LYS 28 -2.306 4.693 0.346
188 HA LYS 28 HA LYS 28 -0.035 6.278 0.272
189 HB2 LYS 28 1HB LYS 28 -2.054 5.964 2.500
190 HB3 LYS 28 2HB LYS 28 -0.877 7.267 2.399
191 HG2 LYS 28 1HG LYS 28 -2.698 6.818 0.093
192 HG3 LYS 28 2HG LYS 28 -3.340 7.580 1.550
193 HD2 LYS 28 1HD LYS 28 -1.658 9.316 1.425
194 HD3 LYS 28 2HD LYS 28 -0.902 8.523 0.041
195 HE2 LYS 28 1HE LYS 28 -2.556 9.167 -1.405
196 HE3 LYS 28 2HE LYS 28 -3.785 9.229 -0.142
197 HZ1 LYS 28 3HZ LYS 28 -2.832 11.407 -1.177
198 HZ2 LYS 28 1HZ LYS 28 -1.582 11.164 -0.063
199 HZ3 LYS 28 2HZ LYS 28 -3.176 11.327 0.478
200 H HIS 29 H HIS 29 -0.444 3.260 1.756
201 HA HIS 29 HA HIS 29 1.713 3.694 3.680
202 HB2 HIS 29 1HB HIS 29 0.165 2.430 4.794
203 HB3 HIS 29 2HB HIS 29 -0.419 1.655 3.324
204 HD1 HIS 29 1HD HIS 29 1.922 1.212 6.139
205 HD2 HIS 29 2HD HIS 29 1.151 -0.584 2.473
206 HE1 HIS 29 1HE HIS 29 3.115 -1.001 6.210
207 H GLN 30 H GLN 30 0.965 1.889 0.754
208 HA GLN 30 HA GLN 30 3.198 0.219 0.668
209 HB2 GLN 30 1HB GLN 30 1.442 1.406 -1.459
210 HB3 GLN 30 2HB GLN 30 2.829 0.415 -1.891
211 HG2 GLN 30 1HG GLN 30 0.845 -0.619 0.077
212 HG3 GLN 30 2HG GLN 30 0.466 -0.648 -1.644
213 HE21 GLN 30 1HE2 GLN 30 0.415 -3.001 -1.075
214 HE22 GLN 30 2HE2 GLN 30 1.892 -3.882 -1.235
215 H ARG 31 H ARG 31 2.814 3.586 -0.246
216 HA ARG 31 HA ARG 31 5.056 4.039 -1.766
217 HB2 ARG 31 1HB ARG 31 5.058 6.348 -0.712
218 HB3 ARG 31 2HB ARG 31 3.547 5.835 -1.449
219 HG2 ARG 31 1HG ARG 31 2.457 5.688 0.547
220 HG3 ARG 31 2HG ARG 31 3.929 5.323 1.449
221 HD2 ARG 31 1HD ARG 31 3.269 8.011 0.253
222 HD3 ARG 31 2HD ARG 31 2.994 7.569 1.938
223 HE ARG 31 HE ARG 31 5.710 7.235 1.001
224 HH11 ARG 31 2HH1 ARG 31 3.396 9.330 2.543
225 HH12 ARG 31 1HH1 ARG 31 4.600 10.304 3.319
226 HH21 ARG 31 2HH2 ARG 31 7.305 8.510 2.018
227 HH22 ARG 31 1HH2 ARG 31 6.823 9.838 3.019
228 H ILE 32 H ILE 32 4.890 3.166 1.553
229 HA ILE 32 HA ILE 32 7.392 4.193 2.406
230 HB ILE 32 HB ILE 32 7.122 2.952 4.369
231 HG12 ILE 32 1HG1 ILE 32 5.288 1.098 2.833
232 HG13 ILE 32 2HG1 ILE 32 6.936 0.736 3.333
233 HG21 ILE 32 1HG2 ILE 32 4.372 2.902 4.424
234 HG22 ILE 32 2HG2 ILE 32 5.390 4.294 4.787
235 HG23 ILE 32 3HG2 ILE 32 4.729 4.085 3.166
236 HD11 ILE 32 3HD1 ILE 32 6.278 0.116 5.357
237 HD12 ILE 32 1HD1 ILE 32 5.274 1.551 5.559
238 HD13 ILE 32 2HD1 ILE 32 4.635 0.139 4.717
239 H HIS 33 H HIS 33 6.399 1.212 0.843
240 HA HIS 33 HA HIS 33 9.065 0.070 1.076
241 HB2 HIS 33 1HB HIS 33 6.671 -1.044 -0.396
242 HB3 HIS 33 2HB HIS 33 8.127 -1.915 0.077
243 HD1 HIS 33 1HD HIS 33 8.471 -2.061 2.793
244 HD2 HIS 33 2HD HIS 33 4.647 -1.233 1.397
245 HE1 HIS 33 1HE HIS 33 6.928 -2.585 4.708
246 H SER 34 H SER 34 6.860 1.187 -1.471
247 HA SER 34 HA SER 34 8.147 0.625 -3.760
248 HB2 SER 34 1HB SER 34 7.252 2.659 -4.727
249 HB3 SER 34 2HB SER 34 6.084 2.019 -3.571
250 HG SER 34 HG SER 34 6.878 4.416 -3.588
251 H GLY 35 H GLY 35 9.061 3.233 -1.535
252 HA2 GLY 35 1HA GLY 35 11.307 4.035 -3.155
253 HA3 GLY 35 2HA GLY 35 10.904 4.638 -1.554
254 H GLU 36 H GLU 36 11.740 3.622 0.269
255 HA GLU 36 HA GLU 36 14.286 2.485 0.008
256 HB2 GLU 36 1HB GLU 36 12.354 2.586 2.320
257 HB3 GLU 36 2HB GLU 36 13.957 1.880 2.463
258 HG2 GLU 36 1HG GLU 36 13.603 4.666 1.440
259 HG3 GLU 36 2HG GLU 36 13.598 4.327 3.170
260 H LYS 37 H LYS 37 14.872 0.340 1.109
261 HA LYS 37 HA LYS 37 13.203 -1.742 -0.105
262 HB2 LYS 37 1HB LYS 37 15.165 -3.175 0.046
263 HB3 LYS 37 2HB LYS 37 15.576 -1.666 -0.759
264 HG2 LYS 37 1HG LYS 37 16.596 -0.829 1.278
265 HG3 LYS 37 2HG LYS 37 16.135 -2.304 2.131
266 HD2 LYS 37 1HD LYS 37 18.315 -2.783 1.576
267 HD3 LYS 37 2HD LYS 37 17.460 -3.472 0.194
268 HE2 LYS 37 1HE LYS 37 17.888 -1.429 -1.084
269 HE3 LYS 37 2HE LYS 37 18.736 -0.739 0.299
270 HZ1 LYS 37 3HZ LYS 37 19.774 -2.368 -1.713
271 HZ2 LYS 37 1HZ LYS 37 19.840 -3.254 -0.274
272 HZ3 LYS 37 2HZ LYS 37 20.579 -1.736 -0.367
273 HA PRO 38 HA PRO 38 11.791 -3.254 3.774
274 HB2 PRO 38 1HB PRO 38 11.421 -5.871 3.154
275 HB3 PRO 38 2HB PRO 38 10.354 -4.587 2.575
276 HG2 PRO 38 1HG PRO 38 12.603 -5.964 1.159
277 HG3 PRO 38 2HG PRO 38 10.998 -5.525 0.547
278 HD2 PRO 38 1HD PRO 38 13.211 -4.058 0.014
279 HD3 PRO 38 2HD PRO 38 11.600 -3.331 0.178
280 H SER 39 H SER 39 14.819 -3.665 2.748
281 HA SER 39 HA SER 39 15.973 -5.881 3.791
282 HB2 SER 39 1HB SER 39 17.973 -4.504 4.278
283 HB3 SER 39 2HB SER 39 17.270 -4.117 2.708
284 HG SER 39 HG SER 39 16.074 -2.457 4.140
285 H GLY 40 H GLY 40 14.842 -3.074 5.618
286 HA2 GLY 40 1HA GLY 40 15.553 -4.436 8.124
287 HA3 GLY 40 2HA GLY 40 15.150 -2.733 7.962
288 HA PRO 41 HA PRO 41 11.300 -5.653 8.565
289 HB2 PRO 41 1HB PRO 41 11.569 -6.738 11.040
290 HB3 PRO 41 2HB PRO 41 12.110 -7.555 9.568
291 HG2 PRO 41 1HG PRO 41 13.703 -5.985 11.558
292 HG3 PRO 41 2HG PRO 41 14.101 -7.523 10.769
293 HD2 PRO 41 1HD PRO 41 15.127 -5.156 9.947
294 HD3 PRO 41 2HD PRO 41 14.793 -6.493 8.827
295 H SER 42 H SER 42 10.580 -3.421 8.663
296 HA SER 42 HA SER 42 10.204 -2.445 11.418
297 HB2 SER 42 1HB SER 42 10.215 -0.215 10.618
298 HB3 SER 42 2HB SER 42 11.548 -1.008 9.778
299 HG SER 42 HG SER 42 10.122 0.288 8.431
300 H SER 43 H SER 43 8.213 -2.662 12.166
301 HA SER 43 HA SER 43 5.956 -2.372 10.304
302 HB2 SER 43 1HB SER 43 6.294 -4.769 10.752
303 HB3 SER 43 2HB SER 43 6.183 -4.462 12.485
304 HG SER 43 HG SER 43 4.200 -5.191 11.460
305 H GLY 44 H GLY 44 4.147 -1.348 11.105
306 HA2 GLY 44 1HA GLY 44 3.164 0.325 12.369
307 HA3 GLY 44 2HA GLY 44 3.277 -0.903 13.620
Start of MODEL 7
1 H1 GLY 1 H GLY 1 -20.926 -7.229 -4.794
2 HA2 GLY 1 1HA GLY 1 -22.680 -7.081 -2.868
3 HA3 GLY 1 2HA GLY 1 -22.066 -5.438 -2.767
4 H SER 2 H SER 2 -22.802 -3.919 -4.162
5 HA SER 2 HA SER 2 -24.989 -4.734 -5.917
6 HB2 SER 2 1HB SER 2 -25.483 -2.291 -6.022
7 HB3 SER 2 2HB SER 2 -25.487 -2.926 -4.377
8 HG SER 2 HG SER 2 -24.194 -1.264 -4.097
9 H SER 3 H SER 3 -25.191 -3.379 -7.987
10 HA SER 3 HA SER 3 -23.034 -4.013 -9.675
11 HB2 SER 3 1HB SER 3 -25.551 -3.593 -10.227
12 HB3 SER 3 2HB SER 3 -25.051 -1.911 -10.404
13 HG SER 3 HG SER 3 -24.186 -4.169 -11.869
14 H GLY 4 H GLY 4 -21.487 -2.738 -10.694
15 HA2 GLY 4 1HA GLY 4 -20.279 -0.772 -11.131
16 HA3 GLY 4 2HA GLY 4 -21.251 0.066 -9.931
17 H SER 5 H SER 5 -20.910 -1.528 -7.716
18 HA SER 5 HA SER 5 -18.444 -0.627 -6.724
19 HB2 SER 5 1HB SER 5 -20.220 -2.824 -5.632
20 HB3 SER 5 2HB SER 5 -18.951 -1.985 -4.739
21 HG SER 5 HG SER 5 -21.440 -1.022 -5.628
22 H SER 6 H SER 6 -16.531 -1.697 -6.223
23 HA SER 6 HA SER 6 -16.183 -4.419 -7.238
24 HB2 SER 6 1HB SER 6 -15.526 -2.607 -8.972
25 HB3 SER 6 2HB SER 6 -14.141 -2.317 -7.920
26 HG SER 6 HG SER 6 -13.257 -4.045 -8.701
27 H GLY 7 H GLY 7 -14.727 -5.632 -6.110
28 HA2 GLY 7 1HA GLY 7 -12.550 -5.344 -4.763
29 HA3 GLY 7 2HA GLY 7 -13.558 -4.331 -3.741
30 H LYS 8 H LYS 8 -13.177 -7.615 -4.991
31 HA LYS 8 HA LYS 8 -14.997 -8.687 -3.006
32 HB2 LYS 8 1HB LYS 8 -13.292 -10.003 -5.125
33 HB3 LYS 8 2HB LYS 8 -14.337 -10.891 -4.023
34 HG2 LYS 8 1HG LYS 8 -15.512 -8.689 -5.642
35 HG3 LYS 8 2HG LYS 8 -15.145 -10.228 -6.426
36 HD2 LYS 8 1HD LYS 8 -16.507 -11.397 -4.757
37 HD3 LYS 8 2HD LYS 8 -16.876 -9.855 -3.981
38 HE2 LYS 8 1HE LYS 8 -18.718 -10.507 -5.398
39 HE3 LYS 8 2HE LYS 8 -17.925 -9.088 -6.080
40 HZ1 LYS 8 3HZ LYS 8 -17.184 -11.799 -6.975
41 HZ2 LYS 8 1HZ LYS 8 -16.997 -10.324 -7.784
42 HZ3 LYS 8 2HZ LYS 8 -18.532 -11.016 -7.631
43 H LYS 9 H LYS 9 -11.549 -9.102 -3.813
44 HA LYS 9 HA LYS 9 -11.049 -10.383 -1.262
45 HB2 LYS 9 1HB LYS 9 -9.235 -9.666 -3.569
46 HB3 LYS 9 2HB LYS 9 -8.680 -10.463 -2.103
47 HG2 LYS 9 1HG LYS 9 -10.630 -12.145 -2.730
48 HG3 LYS 9 2HG LYS 9 -10.298 -11.521 -4.347
49 HD2 LYS 9 1HD LYS 9 -8.032 -12.406 -2.614
50 HD3 LYS 9 2HD LYS 9 -9.011 -13.614 -3.451
51 HE2 LYS 9 1HE LYS 9 -7.268 -13.186 -4.938
52 HE3 LYS 9 2HE LYS 9 -8.592 -12.198 -5.552
53 HZ1 LYS 9 3HZ LYS 9 -6.346 -11.234 -3.864
54 HZ2 LYS 9 1HZ LYS 9 -7.625 -10.282 -4.430
55 HZ3 LYS 9 2HZ LYS 9 -6.527 -10.960 -5.524
56 HA PRO 10 HA PRO 10 -9.737 -6.848 0.986
57 HB2 PRO 10 1HB PRO 10 -7.775 -7.907 2.536
58 HB3 PRO 10 2HB PRO 10 -9.491 -8.239 2.799
59 HG2 PRO 10 1HG PRO 10 -7.431 -9.905 1.407
60 HG3 PRO 10 2HG PRO 10 -8.692 -10.408 2.547
61 HD2 PRO 10 1HD PRO 10 -8.945 -10.711 -0.132
62 HD3 PRO 10 2HD PRO 10 -10.334 -10.399 0.929
63 H LEU 11 H LEU 11 -7.877 -5.451 1.453
64 HA LEU 11 HA LEU 11 -5.897 -5.584 -0.715
65 HB2 LEU 11 1HB LEU 11 -6.650 -3.215 0.987
66 HB3 LEU 11 2HB LEU 11 -5.623 -3.206 -0.445
67 HG LEU 11 HG LEU 11 -8.577 -3.823 -0.423
68 HD11 LEU 11 1HD1 LEU 11 -8.541 -1.559 -0.034
69 HD12 LEU 11 2HD1 LEU 11 -8.503 -1.604 -1.796
70 HD13 LEU 11 3HD1 LEU 11 -7.016 -1.325 -0.889
71 HD21 LEU 11 3HD2 LEU 11 -8.467 -3.951 -2.759
72 HD22 LEU 11 1HD2 LEU 11 -7.082 -4.890 -2.200
73 HD23 LEU 11 2HD2 LEU 11 -6.848 -3.252 -2.810
74 H VAL 12 H VAL 12 -4.164 -6.669 0.026
75 HA VAL 12 HA VAL 12 -3.016 -5.814 2.604
76 HB VAL 12 HB VAL 12 -3.414 -8.041 2.999
77 HG11 VAL 12 1HG1 VAL 12 -4.381 -8.987 1.181
78 HG12 VAL 12 2HG1 VAL 12 -3.204 -8.300 0.059
79 HG13 VAL 12 3HG1 VAL 12 -2.786 -9.721 1.017
80 HG21 VAL 12 3HG2 VAL 12 -0.979 -7.528 3.176
81 HG22 VAL 12 1HG2 VAL 12 -1.338 -9.233 2.905
82 HG23 VAL 12 2HG2 VAL 12 -0.764 -8.231 1.573
83 H CYS 13 H CYS 13 -0.846 -5.339 2.718
84 HA CYS 13 HA CYS 13 0.391 -4.423 0.326
85 HB2 CYS 13 1HB CYS 13 0.675 -3.440 2.647
86 HB3 CYS 13 2HB CYS 13 1.734 -4.800 3.003
87 H ASN 14 H ASN 14 1.226 -5.754 -1.138
88 HA ASN 14 HA ASN 14 2.017 -8.411 -0.637
89 HB2 ASN 14 1HB ASN 14 2.745 -6.608 -2.957
90 HB3 ASN 14 2HB ASN 14 2.937 -8.358 -2.925
91 HD21 ASN 14 1HD2 ASN 14 1.028 -5.943 -3.997
92 HD22 ASN 14 2HD2 ASN 14 -0.471 -6.789 -4.148
93 H GLU 15 H GLU 15 3.557 -5.521 0.085
94 HA GLU 15 HA GLU 15 6.267 -6.492 -0.229
95 HB2 GLU 15 1HB GLU 15 5.204 -3.976 1.068
96 HB3 GLU 15 2HB GLU 15 6.904 -4.335 0.802
97 HG2 GLU 15 1HG GLU 15 5.521 -2.833 -0.861
98 HG3 GLU 15 2HG GLU 15 6.795 -3.913 -1.423
99 H CYS 16 H CYS 16 4.187 -5.535 2.502
100 HA CYS 16 HA CYS 16 5.936 -7.094 4.282
101 HB2 CYS 16 1HB CYS 16 5.020 -5.762 6.118
102 HB3 CYS 16 2HB CYS 16 5.700 -4.717 4.874
103 H GLY 17 H GLY 17 2.584 -6.549 3.330
104 HA2 GLY 17 1HA GLY 17 1.048 -8.384 3.189
105 HA3 GLY 17 2HA GLY 17 1.920 -9.166 4.500
106 H LYS 18 H LYS 18 0.732 -5.833 4.302
107 HA LYS 18 HA LYS 18 -0.815 -6.338 6.750
108 HB2 LYS 18 1HB LYS 18 1.031 -4.505 6.547
109 HB3 LYS 18 2HB LYS 18 -0.206 -3.600 5.684
110 HG2 LYS 18 1HG LYS 18 -1.691 -3.843 7.649
111 HG3 LYS 18 2HG LYS 18 -0.363 -4.625 8.510
112 HD2 LYS 18 1HD LYS 18 0.956 -2.651 8.441
113 HD3 LYS 18 2HD LYS 18 -0.142 -1.878 7.296
114 HE2 LYS 18 1HE LYS 18 -0.691 -0.887 9.330
115 HE3 LYS 18 2HE LYS 18 -1.914 -2.143 9.142
116 HZ1 LYS 18 3HZ LYS 18 -0.369 -3.575 10.522
117 HZ2 LYS 18 1HZ LYS 18 -1.168 -2.325 11.335
118 HZ3 LYS 18 2HZ LYS 18 0.459 -2.151 10.908
119 H THR 19 H THR 19 -2.933 -6.549 6.534
120 HA THR 19 HA THR 19 -4.280 -5.891 4.094
121 HB THR 19 HB THR 19 -6.290 -6.746 5.156
122 HG1 THR 19 1HG THR 19 -5.055 -7.400 7.547
123 HG21 THR 19 3HG2 THR 19 -3.751 -8.228 5.224
124 HG22 THR 19 1HG2 THR 19 -5.291 -8.651 4.477
125 HG23 THR 19 2HG2 THR 19 -5.043 -8.924 6.201
126 H PHE 20 H PHE 20 -5.921 -4.369 3.773
127 HA PHE 20 HA PHE 20 -6.221 -2.307 5.842
128 HB2 PHE 20 1HB PHE 20 -5.552 -1.853 2.931
129 HB3 PHE 20 2HB PHE 20 -6.148 -0.584 3.997
130 HD1 PHE 20 1HD PHE 20 -3.326 -2.769 3.201
131 HD2 PHE 20 2HD PHE 20 -4.752 0.345 5.728
132 HE1 PHE 20 1HE PHE 20 -1.024 -2.328 3.951
133 HE2 PHE 20 2HE PHE 20 -2.453 0.791 6.481
134 HZ PHE 20 HZ PHE 20 -0.585 -0.545 5.592
135 H ARG 21 H ARG 21 -8.055 -0.770 5.256
136 HA ARG 21 HA ARG 21 -10.344 -2.397 4.488
137 HB2 ARG 21 1HB ARG 21 -10.117 0.335 5.754
138 HB3 ARG 21 2HB ARG 21 -11.651 -0.404 5.312
139 HG2 ARG 21 1HG ARG 21 -11.545 -0.998 7.505
140 HG3 ARG 21 2HG ARG 21 -10.731 -2.386 6.781
141 HD2 ARG 21 1HD ARG 21 -8.593 -1.546 7.351
142 HD3 ARG 21 2HD ARG 21 -9.248 0.039 7.761
143 HE ARG 21 HE ARG 21 -9.885 -0.777 9.822
144 HH11 ARG 21 2HH1 ARG 21 -8.818 -3.384 7.777
145 HH12 ARG 21 1HH1 ARG 21 -8.762 -4.544 9.062
146 HH21 ARG 21 2HH2 ARG 21 -9.816 -2.295 11.524
147 HH22 ARG 21 1HH2 ARG 21 -9.331 -3.923 11.193
148 H GLN 22 H GLN 22 -9.288 0.943 3.797
149 HA GLN 22 HA GLN 22 -10.729 0.827 1.257
150 HB2 GLN 22 1HB GLN 22 -9.370 3.180 2.581
151 HB3 GLN 22 2HB GLN 22 -10.417 3.242 1.169
152 HG2 GLN 22 1HG GLN 22 -11.335 2.251 3.853
153 HG3 GLN 22 2HG GLN 22 -11.457 3.935 3.347
154 HE21 GLN 22 1HE2 GLN 22 -12.729 0.756 3.033
155 HE22 GLN 22 2HE2 GLN 22 -14.074 1.156 2.027
156 H SER 23 H SER 23 -9.560 2.166 -0.544
157 HA SER 23 HA SER 23 -7.157 0.726 -1.158
158 HB2 SER 23 1HB SER 23 -8.449 3.001 -2.681
159 HB3 SER 23 2HB SER 23 -7.246 1.873 -3.305
160 HG SER 23 HG SER 23 -8.777 0.197 -2.974
161 H SER 24 H SER 24 -7.925 4.181 -0.745
162 HA SER 24 HA SER 24 -5.424 5.264 -1.067
163 HB2 SER 24 1HB SER 24 -7.375 6.670 -0.766
164 HB3 SER 24 2HB SER 24 -7.582 6.093 0.887
165 HG SER 24 HG SER 24 -6.515 8.146 0.739
166 H CYS 25 H CYS 25 -6.729 3.599 1.735
167 HA CYS 25 HA CYS 25 -4.746 4.270 3.597
168 HB2 CYS 25 1HB CYS 25 -6.593 1.908 3.333
169 HB3 CYS 25 2HB CYS 25 -5.430 2.017 4.649
170 HG CYS 25 HG CYS 25 -8.375 2.996 4.837
171 H LEU 26 H LEU 26 -5.057 1.177 1.842
172 HA LEU 26 HA LEU 26 -2.574 0.145 2.494
173 HB2 LEU 26 1HB LEU 26 -4.045 -1.352 1.510
174 HB3 LEU 26 2HB LEU 26 -4.423 -0.259 0.181
175 HG LEU 26 HG LEU 26 -1.975 -0.682 -0.549
176 HD11 LEU 26 1HD1 LEU 26 -0.865 -2.534 0.238
177 HD12 LEU 26 2HD1 LEU 26 -2.337 -3.299 0.834
178 HD13 LEU 26 3HD1 LEU 26 -1.631 -1.944 1.713
179 HD21 LEU 26 3HD2 LEU 26 -3.338 -3.195 -1.013
180 HD22 LEU 26 1HD2 LEU 26 -2.923 -1.908 -2.146
181 HD23 LEU 26 2HD2 LEU 26 -4.417 -1.813 -1.213
182 H SER 27 H SER 27 -3.455 1.920 -0.470
183 HA SER 27 HA SER 27 -0.947 1.986 -1.650
184 HB2 SER 27 1HB SER 27 -2.867 2.695 -2.905
185 HB3 SER 27 2HB SER 27 -3.205 3.994 -1.761
186 HG SER 27 HG SER 27 -0.740 3.900 -3.114
187 H LYS 28 H LYS 28 -2.431 4.541 0.349
188 HA LYS 28 HA LYS 28 -0.242 6.239 0.482
189 HB2 LYS 28 1HB LYS 28 -2.353 7.020 1.260
190 HB3 LYS 28 2HB LYS 28 -2.474 5.725 2.443
191 HG2 LYS 28 1HG LYS 28 -0.180 7.591 2.669
192 HG3 LYS 28 2HG LYS 28 -1.781 8.185 3.114
193 HD2 LYS 28 1HD LYS 28 -0.596 5.633 4.191
194 HD3 LYS 28 2HD LYS 28 -0.437 7.195 4.997
195 HE2 LYS 28 1HE LYS 28 -2.978 7.322 4.895
196 HE3 LYS 28 2HE LYS 28 -2.937 5.614 4.462
197 HZ1 LYS 28 3HZ LYS 28 -2.127 6.894 6.993
198 HZ2 LYS 28 1HZ LYS 28 -1.519 5.375 6.563
199 HZ3 LYS 28 2HZ LYS 28 -3.185 5.597 6.750
200 H HIS 29 H HIS 29 -0.593 3.141 1.806
201 HA HIS 29 HA HIS 29 1.405 3.586 3.891
202 HB2 HIS 29 1HB HIS 29 -0.168 2.193 4.813
203 HB3 HIS 29 2HB HIS 29 -0.560 1.437 3.272
204 HD1 HIS 29 1HD HIS 29 1.416 0.968 6.316
205 HD2 HIS 29 2HD HIS 29 1.368 -0.573 2.458
206 HE1 HIS 29 1HE HIS 29 2.787 -1.138 6.416
207 H GLN 30 H GLN 30 0.968 1.917 0.828
208 HA GLN 30 HA GLN 30 3.278 0.359 0.814
209 HB2 GLN 30 1HB GLN 30 1.697 1.640 -1.406
210 HB3 GLN 30 2HB GLN 30 3.102 0.632 -1.729
211 HG2 GLN 30 1HG GLN 30 0.961 -0.449 0.022
212 HG3 GLN 30 2HG GLN 30 0.667 -0.356 -1.713
213 HE21 GLN 30 1HE2 GLN 30 0.540 -2.764 -1.102
214 HE22 GLN 30 2HE2 GLN 30 1.998 -3.664 -1.327
215 H ARG 31 H ARG 31 2.802 3.754 0.031
216 HA ARG 31 HA ARG 31 5.153 4.380 -1.247
217 HB2 ARG 31 1HB ARG 31 4.932 6.640 -0.131
218 HB3 ARG 31 2HB ARG 31 3.512 6.077 -1.003
219 HG2 ARG 31 1HG ARG 31 2.275 5.821 0.889
220 HG3 ARG 31 2HG ARG 31 3.682 5.472 1.895
221 HD2 ARG 31 1HD ARG 31 3.294 8.193 0.710
222 HD3 ARG 31 2HD ARG 31 2.443 7.730 2.182
223 HE ARG 31 HE ARG 31 5.285 8.221 1.885
224 HH11 ARG 31 2HH1 ARG 31 2.724 6.926 3.857
225 HH12 ARG 31 1HH1 ARG 31 3.639 7.005 5.326
226 HH21 ARG 31 2HH2 ARG 31 6.499 8.330 3.813
227 HH22 ARG 31 1HH2 ARG 31 5.785 7.805 5.300
228 H ILE 32 H ILE 32 4.722 3.333 1.991
229 HA ILE 32 HA ILE 32 7.047 4.455 3.154
230 HB ILE 32 HB ILE 32 6.696 3.033 4.991
231 HG12 ILE 32 1HG1 ILE 32 5.199 1.235 3.077
232 HG13 ILE 32 2HG1 ILE 32 6.708 0.883 3.912
233 HG21 ILE 32 1HG2 ILE 32 4.340 4.127 3.651
234 HG22 ILE 32 2HG2 ILE 32 3.972 2.883 4.844
235 HG23 ILE 32 3HG2 ILE 32 4.888 4.314 5.317
236 HD11 ILE 32 3HD1 ILE 32 5.252 -0.284 5.207
237 HD12 ILE 32 1HD1 ILE 32 5.213 1.267 6.045
238 HD13 ILE 32 2HD1 ILE 32 3.922 0.839 4.922
239 H HIS 33 H HIS 33 6.442 1.529 1.315
240 HA HIS 33 HA HIS 33 9.134 0.534 1.767
241 HB2 HIS 33 1HB HIS 33 7.004 -0.572 -0.071
242 HB3 HIS 33 2HB HIS 33 8.453 -1.400 0.490
243 HD1 HIS 33 1HD HIS 33 8.499 -1.667 3.254
244 HD2 HIS 33 2HD HIS 33 4.816 -1.154 1.401
245 HE1 HIS 33 1HE HIS 33 6.793 -2.481 4.913
246 H SER 34 H SER 34 7.194 1.829 -0.898
247 HA SER 34 HA SER 34 9.173 1.569 -2.893
248 HB2 SER 34 1HB SER 34 6.588 2.132 -3.032
249 HB3 SER 34 2HB SER 34 7.180 3.793 -3.021
250 HG SER 34 HG SER 34 6.951 2.458 -5.118
251 H GLY 35 H GLY 35 9.904 3.687 -4.100
252 HA2 GLY 35 1HA GLY 35 10.411 6.108 -3.073
253 HA3 GLY 35 2HA GLY 35 11.556 5.115 -2.183
254 H GLU 36 H GLU 36 10.641 6.298 -5.358
255 HA GLU 36 HA GLU 36 13.025 5.199 -6.592
256 HB2 GLU 36 1HB GLU 36 10.816 6.953 -7.675
257 HB3 GLU 36 2HB GLU 36 12.170 6.371 -8.633
258 HG2 GLU 36 1HG GLU 36 10.468 4.883 -9.129
259 HG3 GLU 36 2HG GLU 36 11.420 4.029 -7.916
260 H LYS 37 H LYS 37 14.517 6.588 -7.799
261 HA LYS 37 HA LYS 37 15.597 8.621 -6.175
262 HB2 LYS 37 1HB LYS 37 16.603 7.104 -8.142
263 HB3 LYS 37 2HB LYS 37 16.292 8.570 -9.063
264 HG2 LYS 37 1HG LYS 37 18.387 9.062 -8.394
265 HG3 LYS 37 2HG LYS 37 17.538 9.650 -6.963
266 HD2 LYS 37 1HD LYS 37 18.266 6.784 -6.983
267 HD3 LYS 37 2HD LYS 37 19.598 7.934 -6.851
268 HE2 LYS 37 1HE LYS 37 17.165 8.116 -5.102
269 HE3 LYS 37 2HE LYS 37 18.533 7.087 -4.683
270 HZ1 LYS 37 3HZ LYS 37 18.398 10.021 -4.831
271 HZ2 LYS 37 1HZ LYS 37 19.881 9.244 -5.076
272 HZ3 LYS 37 2HZ LYS 37 19.050 9.038 -3.618
273 HA PRO 38 HA PRO 38 12.977 11.985 -7.420
274 HB2 PRO 38 1HB PRO 38 14.333 13.929 -6.096
275 HB3 PRO 38 2HB PRO 38 13.258 12.784 -5.284
276 HG2 PRO 38 1HG PRO 38 16.242 12.740 -5.521
277 HG3 PRO 38 2HG PRO 38 15.227 12.396 -4.109
278 HD2 PRO 38 1HD PRO 38 16.322 10.440 -5.627
279 HD3 PRO 38 2HD PRO 38 14.756 10.252 -4.812
280 H SER 39 H SER 39 13.470 12.033 -9.643
281 HA SER 39 HA SER 39 15.873 12.900 -10.773
282 HB2 SER 39 1HB SER 39 13.074 13.150 -11.902
283 HB3 SER 39 2HB SER 39 14.569 13.274 -12.829
284 HG SER 39 HG SER 39 13.361 11.029 -11.676
285 H GLY 40 H GLY 40 12.873 14.748 -10.210
286 HA2 GLY 40 1HA GLY 40 14.367 17.230 -10.676
287 HA3 GLY 40 2HA GLY 40 12.617 17.075 -10.621
288 HA PRO 41 HA PRO 41 14.604 18.377 -6.451
289 HB2 PRO 41 1HB PRO 41 14.399 21.077 -6.647
290 HB3 PRO 41 2HB PRO 41 15.842 20.185 -7.141
291 HG2 PRO 41 1HG PRO 41 13.602 21.244 -8.821
292 HG3 PRO 41 2HG PRO 41 15.348 21.289 -9.127
293 HD2 PRO 41 1HD PRO 41 13.711 19.477 -10.296
294 HD3 PRO 41 2HD PRO 41 15.399 19.113 -9.885
295 H SER 42 H SER 42 11.791 18.482 -8.155
296 HA SER 42 HA SER 42 9.955 20.094 -7.094
297 HB2 SER 42 1HB SER 42 9.802 17.136 -7.606
298 HB3 SER 42 2HB SER 42 8.402 18.006 -6.977
299 HG SER 42 HG SER 42 8.300 17.999 -9.212
300 H SER 43 H SER 43 10.753 17.018 -5.467
301 HA SER 43 HA SER 43 9.651 18.066 -2.981
302 HB2 SER 43 1HB SER 43 10.776 15.315 -3.554
303 HB3 SER 43 2HB SER 43 9.832 15.793 -2.143
304 HG SER 43 HG SER 43 8.860 14.776 -4.270
305 H GLY 44 H GLY 44 12.638 16.342 -3.917
306 HA2 GLY 44 1HA GLY 44 14.101 16.771 -1.619
307 HA3 GLY 44 2HA GLY 44 14.811 16.618 -3.220
Start of MODEL 8
1 H1 GLY 1 H GLY 1 -16.577 -12.355 -7.919
2 HA2 GLY 1 1HA GLY 1 -19.149 -12.735 -8.834
3 HA3 GLY 1 2HA GLY 1 -17.822 -12.178 -9.843
4 H SER 2 H SER 2 -17.628 -13.318 -11.639
5 HA SER 2 HA SER 2 -18.231 -16.202 -11.537
6 HB2 SER 2 1HB SER 2 -19.029 -16.090 -13.798
7 HB3 SER 2 2HB SER 2 -19.818 -14.793 -12.900
8 HG SER 2 HG SER 2 -17.961 -13.478 -13.737
9 H SER 3 H SER 3 -15.683 -14.497 -11.261
10 HA SER 3 HA SER 3 -14.113 -15.507 -13.502
11 HB2 SER 3 1HB SER 3 -13.807 -13.164 -12.690
12 HB3 SER 3 2HB SER 3 -13.209 -13.811 -11.163
13 HG SER 3 HG SER 3 -12.054 -14.016 -13.735
14 H GLY 4 H GLY 4 -13.807 -15.512 -9.941
15 HA2 GLY 4 1HA GLY 4 -13.556 -18.173 -9.460
16 HA3 GLY 4 2HA GLY 4 -11.954 -17.719 -10.023
17 H SER 5 H SER 5 -10.826 -16.018 -8.836
18 HA SER 5 HA SER 5 -11.553 -16.079 -5.983
19 HB2 SER 5 1HB SER 5 -9.122 -15.623 -5.577
20 HB3 SER 5 2HB SER 5 -9.432 -17.166 -6.373
21 HG SER 5 HG SER 5 -8.934 -14.886 -7.932
22 H SER 6 H SER 6 -10.496 -14.025 -8.633
23 HA SER 6 HA SER 6 -10.171 -11.642 -7.167
24 HB2 SER 6 1HB SER 6 -9.306 -11.953 -9.459
25 HB3 SER 6 2HB SER 6 -10.959 -11.971 -10.073
26 HG SER 6 HG SER 6 -11.105 -9.818 -9.012
27 H GLY 7 H GLY 7 -11.773 -10.996 -5.839
28 HA2 GLY 7 1HA GLY 7 -14.069 -9.751 -6.885
29 HA3 GLY 7 2HA GLY 7 -14.524 -11.336 -6.275
30 H LYS 8 H LYS 8 -14.563 -8.221 -5.474
31 HA LYS 8 HA LYS 8 -14.476 -6.997 -3.535
32 HB2 LYS 8 1HB LYS 8 -15.875 -7.882 -1.795
33 HB3 LYS 8 2HB LYS 8 -16.552 -8.372 -3.343
34 HG2 LYS 8 1HG LYS 8 -15.619 -10.591 -3.084
35 HG3 LYS 8 2HG LYS 8 -14.848 -10.111 -1.570
36 HD2 LYS 8 1HD LYS 8 -16.743 -11.123 -0.768
37 HD3 LYS 8 2HD LYS 8 -17.309 -9.457 -0.906
38 HE2 LYS 8 1HE LYS 8 -18.014 -10.194 -3.305
39 HE3 LYS 8 2HE LYS 8 -17.917 -11.821 -2.633
40 HZ1 LYS 8 3HZ LYS 8 -19.591 -11.352 -1.089
41 HZ2 LYS 8 1HZ LYS 8 -20.151 -10.670 -2.533
42 HZ3 LYS 8 2HZ LYS 8 -19.490 -9.681 -1.331
43 H LYS 9 H LYS 9 -12.046 -8.481 -4.094
44 HA LYS 9 HA LYS 9 -11.047 -9.685 -1.728
45 HB2 LYS 9 1HB LYS 9 -9.954 -10.248 -3.750
46 HB3 LYS 9 2HB LYS 9 -9.729 -8.561 -4.192
47 HG2 LYS 9 1HG LYS 9 -8.285 -8.485 -2.018
48 HG3 LYS 9 2HG LYS 9 -8.204 -10.233 -2.254
49 HD2 LYS 9 1HD LYS 9 -7.632 -8.418 -4.554
50 HD3 LYS 9 2HD LYS 9 -6.397 -8.659 -3.316
51 HE2 LYS 9 1HE LYS 9 -6.228 -10.946 -3.766
52 HE3 LYS 9 2HE LYS 9 -7.774 -10.986 -4.613
53 HZ1 LYS 9 3HZ LYS 9 -5.915 -11.119 -6.150
54 HZ2 LYS 9 1HZ LYS 9 -5.308 -9.645 -5.584
55 HZ3 LYS 9 2HZ LYS 9 -6.789 -9.692 -6.399
56 HA PRO 10 HA PRO 10 -10.121 -6.158 0.739
57 HB2 PRO 10 1HB PRO 10 -8.179 -7.228 2.305
58 HB3 PRO 10 2HB PRO 10 -9.890 -7.630 2.488
59 HG2 PRO 10 1HG PRO 10 -7.725 -9.154 1.091
60 HG3 PRO 10 2HG PRO 10 -9.007 -9.756 2.159
61 HD2 PRO 10 1HD PRO 10 -9.156 -9.931 -0.539
62 HD3 PRO 10 2HD PRO 10 -10.591 -9.720 0.484
63 H LEU 11 H LEU 11 -8.162 -4.890 1.520
64 HA LEU 11 HA LEU 11 -6.218 -4.721 -0.680
65 HB2 LEU 11 1HB LEU 11 -6.863 -2.581 1.332
66 HB3 LEU 11 2HB LEU 11 -5.959 -2.410 -0.171
67 HG LEU 11 HG LEU 11 -8.899 -3.066 -0.030
68 HD11 LEU 11 1HD1 LEU 11 -8.595 -0.530 -1.095
69 HD12 LEU 11 2HD1 LEU 11 -7.502 -0.550 0.289
70 HD13 LEU 11 3HD1 LEU 11 -9.210 -0.931 0.509
71 HD21 LEU 11 3HD2 LEU 11 -7.705 -1.845 -2.422
72 HD22 LEU 11 1HD2 LEU 11 -8.899 -3.135 -2.277
73 HD23 LEU 11 2HD2 LEU 11 -7.184 -3.496 -2.081
74 H VAL 12 H VAL 12 -4.485 -5.901 -0.106
75 HA VAL 12 HA VAL 12 -3.278 -5.346 2.527
76 HB VAL 12 HB VAL 12 -3.820 -7.579 2.744
77 HG11 VAL 12 1HG1 VAL 12 -3.636 -7.590 -0.188
78 HG12 VAL 12 2HG1 VAL 12 -3.144 -9.091 0.598
79 HG13 VAL 12 3HG1 VAL 12 -4.755 -8.431 0.884
80 HG21 VAL 12 3HG2 VAL 12 -1.380 -7.194 3.028
81 HG22 VAL 12 1HG2 VAL 12 -1.787 -8.852 2.587
82 HG23 VAL 12 2HG2 VAL 12 -1.139 -7.751 1.372
83 H CYS 13 H CYS 13 -1.056 -5.069 2.630
84 HA CYS 13 HA CYS 13 0.171 -4.046 0.257
85 HB2 CYS 13 1HB CYS 13 0.552 -3.108 2.540
86 HB3 CYS 13 2HB CYS 13 1.439 -4.572 2.951
87 H ASN 14 H ASN 14 1.022 -5.292 -1.264
88 HA ASN 14 HA ASN 14 1.703 -8.019 -0.858
89 HB2 ASN 14 1HB ASN 14 1.858 -6.085 -3.116
90 HB3 ASN 14 2HB ASN 14 2.876 -7.519 -3.209
91 HD21 ASN 14 1HD2 ASN 14 -0.445 -6.437 -2.748
92 HD22 ASN 14 2HD2 ASN 14 -1.187 -7.843 -3.425
93 H GLU 15 H GLU 15 3.284 -5.298 0.096
94 HA GLU 15 HA GLU 15 5.981 -6.262 -0.430
95 HB2 GLU 15 1HB GLU 15 5.175 -3.842 1.182
96 HB3 GLU 15 2HB GLU 15 6.746 -4.180 0.470
97 HG2 GLU 15 1HG GLU 15 4.402 -4.000 -1.340
98 HG3 GLU 15 2HG GLU 15 5.038 -2.511 -0.644
99 H CYS 16 H CYS 16 3.824 -5.686 2.317
100 HA CYS 16 HA CYS 16 5.656 -7.276 3.991
101 HB2 CYS 16 1HB CYS 16 4.749 -6.062 5.934
102 HB3 CYS 16 2HB CYS 16 5.503 -4.970 4.777
103 H GLY 17 H GLY 17 2.311 -6.649 3.098
104 HA2 GLY 17 1HA GLY 17 0.726 -8.420 2.890
105 HA3 GLY 17 2HA GLY 17 1.623 -9.322 4.102
106 H LYS 18 H LYS 18 0.482 -5.968 4.212
107 HA LYS 18 HA LYS 18 -1.064 -6.679 6.616
108 HB2 LYS 18 1HB LYS 18 0.909 -4.975 6.673
109 HB3 LYS 18 2HB LYS 18 -0.245 -3.874 5.930
110 HG2 LYS 18 1HG LYS 18 -1.769 -4.227 7.830
111 HG3 LYS 18 2HG LYS 18 -0.557 -5.266 8.582
112 HD2 LYS 18 1HD LYS 18 0.992 -3.432 8.742
113 HD3 LYS 18 2HD LYS 18 -0.092 -2.384 7.824
114 HE2 LYS 18 1HE LYS 18 -0.363 -1.793 10.099
115 HE3 LYS 18 2HE LYS 18 -1.788 -2.734 9.659
116 HZ1 LYS 18 3HZ LYS 18 0.584 -3.890 11.014
117 HZ2 LYS 18 1HZ LYS 18 -0.917 -4.629 10.764
118 HZ3 LYS 18 2HZ LYS 18 -0.783 -3.330 11.837
119 H THR 19 H THR 19 -3.194 -6.662 6.412
120 HA THR 19 HA THR 19 -4.466 -5.603 4.068
121 HB THR 19 HB THR 19 -6.550 -6.422 5.032
122 HG1 THR 19 1HG THR 19 -4.962 -6.948 7.343
123 HG21 THR 19 3HG2 THR 19 -4.135 -8.169 5.016
124 HG22 THR 19 1HG2 THR 19 -5.552 -8.195 3.967
125 HG23 THR 19 2HG2 THR 19 -5.656 -8.840 5.605
126 H PHE 20 H PHE 20 -6.054 -3.968 3.988
127 HA PHE 20 HA PHE 20 -6.133 -2.146 6.292
128 HB2 PHE 20 1HB PHE 20 -5.602 -1.399 3.413
129 HB3 PHE 20 2HB PHE 20 -6.042 -0.232 4.655
130 HD1 PHE 20 1HD PHE 20 -3.527 -2.867 3.898
131 HD2 PHE 20 2HD PHE 20 -4.388 0.786 5.906
132 HE1 PHE 20 1HE PHE 20 -1.159 -2.663 4.535
133 HE2 PHE 20 2HE PHE 20 -2.021 0.997 6.545
134 HZ PHE 20 HZ PHE 20 -0.403 -0.729 5.859
135 H ARG 21 H ARG 21 -7.854 -0.347 5.785
136 HA ARG 21 HA ARG 21 -10.315 -1.777 5.193
137 HB2 ARG 21 1HB ARG 21 -10.301 -0.457 7.210
138 HB3 ARG 21 2HB ARG 21 -9.783 0.972 6.325
139 HG2 ARG 21 1HG ARG 21 -11.996 1.433 6.521
140 HG3 ARG 21 2HG ARG 21 -12.027 0.531 5.005
141 HD2 ARG 21 1HD ARG 21 -12.510 -0.673 7.726
142 HD3 ARG 21 2HD ARG 21 -13.784 -0.159 6.621
143 HE ARG 21 HE ARG 21 -12.142 -2.526 6.409
144 HH11 ARG 21 2HH1 ARG 21 -14.261 -0.304 4.768
145 HH12 ARG 21 1HH1 ARG 21 -14.687 -1.428 3.520
146 HH21 ARG 21 2HH2 ARG 21 -12.695 -4.015 4.772
147 HH22 ARG 21 1HH2 ARG 21 -13.797 -3.539 3.524
148 H GLN 22 H GLN 22 -8.943 1.390 4.279
149 HA GLN 22 HA GLN 22 -10.503 1.258 1.793
150 HB2 GLN 22 1HB GLN 22 -10.033 3.712 1.649
151 HB3 GLN 22 2HB GLN 22 -10.990 3.239 3.047
152 HG2 GLN 22 1HG GLN 22 -9.105 3.452 4.497
153 HG3 GLN 22 2HG GLN 22 -8.020 3.702 3.130
154 HE21 GLN 22 1HE2 GLN 22 -10.984 5.070 4.523
155 HE22 GLN 22 2HE2 GLN 22 -10.550 6.721 4.257
156 H SER 23 H SER 23 -9.339 2.585 -0.032
157 HA SER 23 HA SER 23 -6.963 1.127 -0.662
158 HB2 SER 23 1HB SER 23 -8.153 3.481 -2.146
159 HB3 SER 23 2HB SER 23 -7.032 2.281 -2.789
160 HG SER 23 HG SER 23 -8.613 0.778 -2.777
161 H SER 24 H SER 24 -7.544 4.647 -0.537
162 HA SER 24 HA SER 24 -5.051 5.633 -0.724
163 HB2 SER 24 1HB SER 24 -7.088 7.005 -0.346
164 HB3 SER 24 2HB SER 24 -7.043 6.560 1.360
165 HG SER 24 HG SER 24 -5.864 8.591 0.307
166 H CYS 25 H CYS 25 -6.416 4.099 2.142
167 HA CYS 25 HA CYS 25 -4.338 4.664 3.935
168 HB2 CYS 25 1HB CYS 25 -6.487 2.598 3.780
169 HB3 CYS 25 2HB CYS 25 -5.188 2.362 4.943
170 HG CYS 25 HG CYS 25 -7.164 3.447 6.446
171 H LEU 26 H LEU 26 -4.927 1.603 2.195
172 HA LEU 26 HA LEU 26 -2.506 0.389 2.844
173 HB2 LEU 26 1HB LEU 26 -4.204 -0.972 1.960
174 HB3 LEU 26 2HB LEU 26 -4.395 0.049 0.537
175 HG LEU 26 HG LEU 26 -2.090 -0.719 -0.167
176 HD11 LEU 26 1HD1 LEU 26 -1.469 -1.528 2.123
177 HD12 LEU 26 2HD1 LEU 26 -1.157 -2.670 0.817
178 HD13 LEU 26 3HD1 LEU 26 -2.559 -2.891 1.864
179 HD21 LEU 26 3HD2 LEU 26 -4.057 -2.977 0.072
180 HD22 LEU 26 1HD2 LEU 26 -2.927 -2.634 -1.238
181 HD23 LEU 26 2HD2 LEU 26 -4.332 -1.597 -0.992
182 H SER 27 H SER 27 -3.369 2.123 -0.150
183 HA SER 27 HA SER 27 -0.898 1.965 -1.409
184 HB2 SER 27 1HB SER 27 -1.620 3.929 -2.715
185 HB3 SER 27 2HB SER 27 -2.923 2.753 -2.547
186 HG SER 27 HG SER 27 -2.604 5.243 -1.263
187 H LYS 28 H LYS 28 -2.157 4.671 0.543
188 HA LYS 28 HA LYS 28 0.122 6.252 0.527
189 HB2 LYS 28 1HB LYS 28 -2.147 6.889 1.402
190 HB3 LYS 28 2HB LYS 28 -1.783 5.965 2.854
191 HG2 LYS 28 1HG LYS 28 0.362 7.513 2.861
192 HG3 LYS 28 2HG LYS 28 -0.708 8.573 1.940
193 HD2 LYS 28 1HD LYS 28 -1.224 9.266 4.053
194 HD3 LYS 28 2HD LYS 28 -2.394 7.954 3.888
195 HE2 LYS 28 1HE LYS 28 -0.454 6.503 4.872
196 HE3 LYS 28 2HE LYS 28 0.146 8.054 5.456
197 HZ1 LYS 28 3HZ LYS 28 -2.421 6.732 6.107
198 HZ2 LYS 28 1HZ LYS 28 -2.145 8.370 6.426
199 HZ3 LYS 28 2HZ LYS 28 -1.184 7.191 7.165
200 H HIS 29 H HIS 29 -0.325 3.219 1.959
201 HA HIS 29 HA HIS 29 1.785 3.624 3.942
202 HB2 HIS 29 1HB HIS 29 0.201 2.348 4.995
203 HB3 HIS 29 2HB HIS 29 -0.334 1.584 3.501
204 HD1 HIS 29 1HD HIS 29 1.923 1.125 6.382
205 HD2 HIS 29 2HD HIS 29 1.270 -0.640 2.678
206 HE1 HIS 29 1HE HIS 29 3.123 -1.083 6.469
207 H GLN 30 H GLN 30 1.104 1.846 0.981
208 HA GLN 30 HA GLN 30 3.329 0.174 0.919
209 HB2 GLN 30 1HB GLN 30 1.880 1.493 -1.383
210 HB3 GLN 30 2HB GLN 30 3.017 0.161 -1.545
211 HG2 GLN 30 1HG GLN 30 1.438 -1.056 0.110
212 HG3 GLN 30 2HG GLN 30 0.269 0.168 -0.382
213 HE21 GLN 30 1HE2 GLN 30 1.193 -2.874 -0.947
214 HE22 GLN 30 2HE2 GLN 30 0.730 -3.044 -2.603
215 H ARG 31 H ARG 31 3.002 3.565 0.080
216 HA ARG 31 HA ARG 31 5.291 4.031 -1.367
217 HB2 ARG 31 1HB ARG 31 5.282 6.315 -0.248
218 HB3 ARG 31 2HB ARG 31 3.799 5.837 -1.063
219 HG2 ARG 31 1HG ARG 31 2.621 5.664 0.876
220 HG3 ARG 31 2HG ARG 31 4.041 5.232 1.830
221 HD2 ARG 31 1HD ARG 31 4.794 7.669 1.301
222 HD3 ARG 31 2HD ARG 31 3.083 7.928 0.963
223 HE ARG 31 HE ARG 31 3.054 6.746 3.393
224 HH11 ARG 31 2HH1 ARG 31 4.764 9.486 2.092
225 HH12 ARG 31 1HH1 ARG 31 4.839 10.323 3.607
226 HH21 ARG 31 2HH2 ARG 31 3.146 7.839 5.393
227 HH22 ARG 31 1HH2 ARG 31 3.920 9.385 5.484
228 H ILE 32 H ILE 32 5.013 3.110 1.937
229 HA ILE 32 HA ILE 32 7.488 4.091 2.895
230 HB ILE 32 HB ILE 32 7.159 2.779 4.805
231 HG12 ILE 32 1HG1 ILE 32 5.323 0.999 3.187
232 HG13 ILE 32 2HG1 ILE 32 6.980 0.608 3.635
233 HG21 ILE 32 1HG2 ILE 32 4.813 3.974 3.572
234 HG22 ILE 32 2HG2 ILE 32 4.406 2.745 4.768
235 HG23 ILE 32 3HG2 ILE 32 5.421 4.115 5.221
236 HD11 ILE 32 3HD1 ILE 32 6.266 0.809 6.031
237 HD12 ILE 32 1HD1 ILE 32 4.606 0.912 5.447
238 HD13 ILE 32 2HD1 ILE 32 5.562 -0.537 5.135
239 H HIS 33 H HIS 33 6.552 1.155 1.212
240 HA HIS 33 HA HIS 33 9.192 -0.015 1.513
241 HB2 HIS 33 1HB HIS 33 6.872 -1.014 -0.147
242 HB3 HIS 33 2HB HIS 33 8.292 -1.930 0.349
243 HD1 HIS 33 1HD HIS 33 8.497 -2.165 3.094
244 HD2 HIS 33 2HD HIS 33 4.750 -1.345 1.498
245 HE1 HIS 33 1HE HIS 33 6.850 -2.791 4.888
246 H SER 34 H SER 34 7.114 0.952 -1.221
247 HA SER 34 HA SER 34 7.602 1.598 -3.348
248 HB2 SER 34 1HB SER 34 8.783 3.384 -1.879
249 HB3 SER 34 2HB SER 34 10.272 2.577 -2.368
250 HG SER 34 HG SER 34 8.484 3.175 -4.399
251 H GLY 35 H GLY 35 8.200 -1.072 -2.756
252 HA2 GLY 35 1HA GLY 35 10.782 -1.605 -4.031
253 HA3 GLY 35 2HA GLY 35 9.764 -2.786 -3.222
254 H GLU 36 H GLU 36 10.330 -4.018 -5.217
255 HA GLU 36 HA GLU 36 8.654 -3.245 -7.505
256 HB2 GLU 36 1HB GLU 36 10.013 -4.820 -8.817
257 HB3 GLU 36 2HB GLU 36 11.002 -3.581 -8.055
258 HG2 GLU 36 1HG GLU 36 12.000 -5.053 -6.625
259 HG3 GLU 36 2HG GLU 36 10.627 -6.159 -6.629
260 H LYS 37 H LYS 37 7.598 -5.055 -8.681
261 HA LYS 37 HA LYS 37 6.002 -6.582 -6.881
262 HB2 LYS 37 1HB LYS 37 6.206 -6.415 -9.875
263 HB3 LYS 37 2HB LYS 37 5.185 -7.623 -9.107
264 HG2 LYS 37 1HG LYS 37 4.917 -4.730 -8.398
265 HG3 LYS 37 2HG LYS 37 4.143 -5.387 -9.842
266 HD2 LYS 37 1HD LYS 37 3.785 -6.727 -7.188
267 HD3 LYS 37 2HD LYS 37 2.820 -5.311 -7.610
268 HE2 LYS 37 1HE LYS 37 2.064 -6.465 -9.649
269 HE3 LYS 37 2HE LYS 37 2.993 -7.885 -9.174
270 HZ1 LYS 37 3HZ LYS 37 1.194 -8.543 -8.084
271 HZ2 LYS 37 1HZ LYS 37 0.409 -7.063 -8.321
272 HZ3 LYS 37 2HZ LYS 37 1.437 -7.272 -6.995
273 HA PRO 38 HA PRO 38 8.182 -10.381 -6.617
274 HB2 PRO 38 1HB PRO 38 6.155 -12.186 -6.624
275 HB3 PRO 38 2HB PRO 38 6.496 -11.130 -5.249
276 HG2 PRO 38 1HG PRO 38 4.438 -10.831 -7.402
277 HG3 PRO 38 2HG PRO 38 4.278 -10.562 -5.657
278 HD2 PRO 38 1HD PRO 38 4.613 -8.534 -7.419
279 HD3 PRO 38 2HD PRO 38 5.249 -8.474 -5.763
280 H SER 39 H SER 39 9.217 -10.242 -8.696
281 HA SER 39 HA SER 39 9.776 -10.988 -10.773
282 HB2 SER 39 1HB SER 39 9.707 -13.168 -9.610
283 HB3 SER 39 2HB SER 39 8.000 -13.324 -10.024
284 HG SER 39 HG SER 39 9.946 -12.914 -12.022
285 H GLY 40 H GLY 40 7.676 -9.152 -10.710
286 HA2 GLY 40 1HA GLY 40 5.612 -10.126 -12.518
287 HA3 GLY 40 2HA GLY 40 5.698 -8.525 -11.797
288 HA PRO 41 HA PRO 41 6.745 -7.438 -16.006
289 HB2 PRO 41 1HB PRO 41 6.657 -4.756 -15.596
290 HB3 PRO 41 2HB PRO 41 5.206 -5.744 -15.806
291 HG2 PRO 41 1HG PRO 41 6.459 -4.728 -13.283
292 HG3 PRO 41 2HG PRO 41 4.746 -4.780 -13.740
293 HD2 PRO 41 1HD PRO 41 5.869 -6.609 -12.089
294 HD3 PRO 41 2HD PRO 41 4.537 -7.009 -13.193
295 H SER 42 H SER 42 8.571 -7.342 -13.267
296 HA SER 42 HA SER 42 10.750 -6.892 -12.785
297 HB2 SER 42 1HB SER 42 10.784 -7.391 -15.738
298 HB3 SER 42 2HB SER 42 12.260 -6.848 -14.939
299 HG SER 42 HG SER 42 12.311 -9.035 -14.828
300 H SER 43 H SER 43 9.098 -4.654 -12.871
301 HA SER 43 HA SER 43 11.067 -2.590 -13.411
302 HB2 SER 43 1HB SER 43 9.605 -2.915 -15.499
303 HB3 SER 43 2HB SER 43 8.293 -2.233 -14.539
304 HG SER 43 HG SER 43 10.647 -1.019 -15.465
305 H GLY 44 H GLY 44 10.695 -0.651 -12.269
306 HA2 GLY 44 1HA GLY 44 8.397 -0.621 -10.443
307 HA3 GLY 44 2HA GLY 44 10.013 -0.564 -9.755
Start of MODEL 9
1 H1 GLY 1 H GLY 1 -11.508 7.520 -11.390
2 HA2 GLY 1 1HA GLY 1 -10.271 5.366 -11.203
3 HA3 GLY 1 2HA GLY 1 -10.649 6.044 -9.626
4 H SER 2 H SER 2 -13.222 5.474 -9.204
5 HA SER 2 HA SER 2 -13.692 2.663 -9.801
6 HB2 SER 2 1HB SER 2 -12.280 2.889 -7.661
7 HB3 SER 2 2HB SER 2 -13.734 3.558 -6.923
8 HG SER 2 HG SER 2 -14.467 1.367 -8.178
9 H SER 3 H SER 3 -15.845 1.979 -9.382
10 HA SER 3 HA SER 3 -17.754 4.164 -9.525
11 HB2 SER 3 1HB SER 3 -19.343 2.532 -10.259
12 HB3 SER 3 2HB SER 3 -17.821 2.160 -11.069
13 HG SER 3 HG SER 3 -18.177 0.242 -10.269
14 H GLY 4 H GLY 4 -16.303 3.191 -7.000
15 HA2 GLY 4 1HA GLY 4 -16.818 3.170 -4.760
16 HA3 GLY 4 2HA GLY 4 -18.437 3.691 -5.201
17 H SER 5 H SER 5 -16.630 0.718 -5.944
18 HA SER 5 HA SER 5 -18.872 -0.802 -4.786
19 HB2 SER 5 1HB SER 5 -17.029 -1.389 -7.094
20 HB3 SER 5 2HB SER 5 -17.922 -2.678 -6.287
21 HG SER 5 HG SER 5 -19.760 -1.007 -6.693
22 H SER 6 H SER 6 -18.090 -3.130 -4.182
23 HA SER 6 HA SER 6 -15.711 -2.805 -2.478
24 HB2 SER 6 1HB SER 6 -16.695 -4.336 -0.921
25 HB3 SER 6 2HB SER 6 -17.947 -3.171 -1.351
26 HG SER 6 HG SER 6 -17.786 -5.878 -1.876
27 H GLY 7 H GLY 7 -13.975 -3.845 -3.182
28 HA2 GLY 7 1HA GLY 7 -14.057 -5.827 -5.213
29 HA3 GLY 7 2HA GLY 7 -12.645 -5.372 -4.271
30 H LYS 8 H LYS 8 -14.007 -8.000 -5.147
31 HA LYS 8 HA LYS 8 -14.934 -9.401 -2.938
32 HB2 LYS 8 1HB LYS 8 -14.929 -10.171 -5.340
33 HB3 LYS 8 2HB LYS 8 -13.228 -10.571 -5.138
34 HG2 LYS 8 1HG LYS 8 -13.830 -12.136 -3.340
35 HG3 LYS 8 2HG LYS 8 -15.534 -11.764 -3.612
36 HD2 LYS 8 1HD LYS 8 -13.761 -12.759 -5.823
37 HD3 LYS 8 2HD LYS 8 -14.581 -13.868 -4.721
38 HE2 LYS 8 1HE LYS 8 -16.711 -13.155 -5.426
39 HE3 LYS 8 2HE LYS 8 -16.058 -11.722 -6.218
40 HZ1 LYS 8 3HZ LYS 8 -14.819 -13.459 -7.657
41 HZ2 LYS 8 1HZ LYS 8 -16.445 -13.120 -7.981
42 HZ3 LYS 8 2HZ LYS 8 -16.027 -14.519 -7.127
43 H LYS 9 H LYS 9 -11.600 -9.118 -4.143
44 HA LYS 9 HA LYS 9 -10.596 -10.441 -1.748
45 HB2 LYS 9 1HB LYS 9 -9.341 -11.237 -3.484
46 HB3 LYS 9 2HB LYS 9 -9.496 -9.755 -4.419
47 HG2 LYS 9 1HG LYS 9 -7.827 -8.668 -3.081
48 HG3 LYS 9 2HG LYS 9 -7.751 -10.049 -1.984
49 HD2 LYS 9 1HD LYS 9 -7.043 -11.438 -3.963
50 HD3 LYS 9 2HD LYS 9 -6.888 -9.931 -4.868
51 HE2 LYS 9 1HE LYS 9 -5.514 -10.231 -2.232
52 HE3 LYS 9 2HE LYS 9 -4.812 -10.967 -3.671
53 HZ1 LYS 9 3HZ LYS 9 -5.619 -8.247 -4.085
54 HZ2 LYS 9 1HZ LYS 9 -4.140 -8.997 -4.422
55 HZ3 LYS 9 2HZ LYS 9 -4.451 -8.400 -2.871
56 HA PRO 10 HA PRO 10 -9.755 -6.654 0.354
57 HB2 PRO 10 1HB PRO 10 -7.950 -7.598 2.148
58 HB3 PRO 10 2HB PRO 10 -9.683 -7.919 2.271
59 HG2 PRO 10 1HG PRO 10 -7.505 -9.667 1.193
60 HG3 PRO 10 2HG PRO 10 -8.869 -10.097 2.242
61 HD2 PRO 10 1HD PRO 10 -8.871 -10.580 -0.422
62 HD3 PRO 10 2HD PRO 10 -10.352 -10.204 0.481
63 H LEU 11 H LEU 11 -7.941 -5.224 0.901
64 HA LEU 11 HA LEU 11 -5.805 -5.452 -1.096
65 HB2 LEU 11 1HB LEU 11 -6.441 -3.011 0.529
66 HB3 LEU 11 2HB LEU 11 -5.573 -3.116 -1.002
67 HG LEU 11 HG LEU 11 -8.530 -3.603 -0.649
68 HD11 LEU 11 1HD1 LEU 11 -8.945 -1.445 -1.126
69 HD12 LEU 11 2HD1 LEU 11 -7.560 -1.305 -2.209
70 HD13 LEU 11 3HD1 LEU 11 -7.330 -1.193 -0.464
71 HD21 LEU 11 3HD2 LEU 11 -6.677 -3.658 -3.002
72 HD22 LEU 11 1HD2 LEU 11 -8.386 -3.272 -3.201
73 HD23 LEU 11 2HD2 LEU 11 -7.907 -4.828 -2.523
74 H VAL 12 H VAL 12 -4.148 -6.563 -0.228
75 HA VAL 12 HA VAL 12 -3.124 -5.657 2.385
76 HB VAL 12 HB VAL 12 -3.739 -7.869 2.778
77 HG11 VAL 12 1HG1 VAL 12 -3.051 -8.250 -0.069
78 HG12 VAL 12 2HG1 VAL 12 -2.784 -9.632 0.995
79 HG13 VAL 12 3HG1 VAL 12 -4.387 -8.907 0.875
80 HG21 VAL 12 3HG2 VAL 12 -0.855 -7.935 1.893
81 HG22 VAL 12 1HG2 VAL 12 -1.461 -7.496 3.490
82 HG23 VAL 12 2HG2 VAL 12 -1.628 -9.152 2.909
83 H CYS 13 H CYS 13 -1.073 -4.959 2.487
84 HA CYS 13 HA CYS 13 0.364 -4.292 0.191
85 HB2 CYS 13 1HB CYS 13 0.637 -3.226 2.431
86 HB3 CYS 13 2HB CYS 13 1.487 -4.669 2.974
87 H ASN 14 H ASN 14 1.309 -5.607 -1.210
88 HA ASN 14 HA ASN 14 1.982 -8.309 -0.583
89 HB2 ASN 14 1HB ASN 14 1.243 -7.370 -2.851
90 HB3 ASN 14 2HB ASN 14 2.902 -6.806 -3.029
91 HD21 ASN 14 1HD2 ASN 14 0.972 -9.695 -2.406
92 HD22 ASN 14 2HD2 ASN 14 2.056 -10.800 -3.175
93 H GLU 15 H GLU 15 3.471 -5.586 0.332
94 HA GLU 15 HA GLU 15 6.204 -6.520 -0.132
95 HB2 GLU 15 1HB GLU 15 5.340 -3.978 1.247
96 HB3 GLU 15 2HB GLU 15 6.930 -4.359 0.603
97 HG2 GLU 15 1HG GLU 15 5.936 -4.413 -1.669
98 HG3 GLU 15 2HG GLU 15 4.412 -3.871 -0.968
99 H CYS 16 H CYS 16 4.038 -5.636 2.538
100 HA CYS 16 HA CYS 16 5.857 -7.032 4.386
101 HB2 CYS 16 1HB CYS 16 4.783 -5.723 6.181
102 HB3 CYS 16 2HB CYS 16 5.523 -4.687 4.966
103 H GLY 17 H GLY 17 2.498 -6.685 3.371
104 HA2 GLY 17 1HA GLY 17 1.062 -8.601 3.246
105 HA3 GLY 17 2HA GLY 17 1.953 -9.309 4.585
106 H LYS 18 H LYS 18 0.618 -6.041 4.321
107 HA LYS 18 HA LYS 18 -1.040 -6.634 6.682
108 HB2 LYS 18 1HB LYS 18 0.576 -4.961 7.227
109 HB3 LYS 18 2HB LYS 18 0.244 -4.068 5.749
110 HG2 LYS 18 1HG LYS 18 -1.955 -3.471 6.567
111 HG3 LYS 18 2HG LYS 18 -1.695 -4.433 8.024
112 HD2 LYS 18 1HD LYS 18 0.181 -2.979 8.639
113 HD3 LYS 18 2HD LYS 18 -0.093 -2.015 7.186
114 HE2 LYS 18 1HE LYS 18 -2.517 -1.804 8.151
115 HE3 LYS 18 2HE LYS 18 -1.731 -2.216 9.674
116 HZ1 LYS 18 3HZ LYS 18 -0.256 -0.336 9.396
117 HZ2 LYS 18 1HZ LYS 18 -1.866 0.180 9.337
118 HZ3 LYS 18 2HZ LYS 18 -0.967 0.048 7.910
119 H THR 19 H THR 19 -3.176 -6.562 6.465
120 HA THR 19 HA THR 19 -4.328 -5.775 3.930
121 HB THR 19 HB THR 19 -6.431 -6.642 4.807
122 HG1 THR 19 1HG THR 19 -5.228 -7.475 7.195
123 HG21 THR 19 3HG2 THR 19 -5.291 -8.951 5.694
124 HG22 THR 19 1HG2 THR 19 -3.944 -8.207 4.833
125 HG23 THR 19 2HG2 THR 19 -5.467 -8.510 3.995
126 H PHE 20 H PHE 20 -5.901 -4.182 3.628
127 HA PHE 20 HA PHE 20 -6.215 -2.251 5.826
128 HB2 PHE 20 1HB PHE 20 -5.652 -1.622 2.921
129 HB3 PHE 20 2HB PHE 20 -6.089 -0.425 4.136
130 HD1 PHE 20 1HD PHE 20 -3.526 -2.942 3.239
131 HD2 PHE 20 2HD PHE 20 -4.468 0.519 5.531
132 HE1 PHE 20 1HE PHE 20 -1.154 -2.703 3.848
133 HE2 PHE 20 2HE PHE 20 -2.097 0.764 6.142
134 HZ PHE 20 HZ PHE 20 -0.436 -0.848 5.300
135 H ARG 21 H ARG 21 -8.095 -0.824 5.582
136 HA ARG 21 HA ARG 21 -10.377 -2.337 4.632
137 HB2 ARG 21 1HB ARG 21 -10.263 -1.092 6.854
138 HB3 ARG 21 2HB ARG 21 -10.425 0.388 5.919
139 HG2 ARG 21 1HG ARG 21 -12.579 -0.289 5.109
140 HG3 ARG 21 2HG ARG 21 -12.406 -1.875 5.863
141 HD2 ARG 21 1HD ARG 21 -12.195 0.568 7.557
142 HD3 ARG 21 2HD ARG 21 -13.788 0.033 7.025
143 HE ARG 21 HE ARG 21 -12.163 -1.167 9.035
144 HH11 ARG 21 2HH1 ARG 21 -14.520 -1.849 6.566
145 HH12 ARG 21 1HH1 ARG 21 -15.106 -3.285 7.339
146 HH21 ARG 21 2HH2 ARG 21 -12.925 -3.056 10.062
147 HH22 ARG 21 1HH2 ARG 21 -14.198 -3.970 9.328
148 H GLN 22 H GLN 22 -9.081 0.946 4.130
149 HA GLN 22 HA GLN 22 -10.766 1.242 1.765
150 HB2 GLN 22 1HB GLN 22 -9.043 3.161 3.325
151 HB3 GLN 22 2HB GLN 22 -9.757 3.589 1.775
152 HG2 GLN 22 1HG GLN 22 -11.990 2.938 2.815
153 HG3 GLN 22 2HG GLN 22 -11.140 2.966 4.359
154 HE21 GLN 22 1HE2 GLN 22 -9.843 5.013 4.725
155 HE22 GLN 22 2HE2 GLN 22 -10.618 6.498 4.300
156 H SER 23 H SER 23 -9.675 2.388 -0.140
157 HA SER 23 HA SER 23 -7.495 0.715 -1.003
158 HB2 SER 23 1HB SER 23 -9.487 1.542 -2.423
159 HB3 SER 23 2HB SER 23 -8.592 3.057 -2.547
160 HG SER 23 HG SER 23 -6.907 1.084 -3.071
161 H SER 24 H SER 24 -7.977 4.171 -0.377
162 HA SER 24 HA SER 24 -5.400 5.020 -1.110
163 HB2 SER 24 1HB SER 24 -5.915 7.017 0.334
164 HB3 SER 24 2HB SER 24 -7.154 6.648 -0.865
165 HG SER 24 HG SER 24 -8.345 5.623 0.793
166 H CYS 25 H CYS 25 -6.687 3.727 1.890
167 HA CYS 25 HA CYS 25 -4.641 4.384 3.645
168 HB2 CYS 25 1HB CYS 25 -6.929 3.077 3.959
169 HB3 CYS 25 2HB CYS 25 -5.876 1.674 3.835
170 HG CYS 25 HG CYS 25 -6.582 2.645 6.546
171 H LEU 26 H LEU 26 -4.980 1.379 1.753
172 HA LEU 26 HA LEU 26 -2.513 0.270 2.475
173 HB2 LEU 26 1HB LEU 26 -4.077 -1.171 1.494
174 HB3 LEU 26 2HB LEU 26 -4.323 -0.104 0.113
175 HG LEU 26 HG LEU 26 -1.958 -0.672 -0.583
176 HD11 LEU 26 1HD1 LEU 26 -1.138 -2.867 0.311
177 HD12 LEU 26 2HD1 LEU 26 -2.330 -2.709 1.601
178 HD13 LEU 26 3HD1 LEU 26 -1.042 -1.515 1.439
179 HD21 LEU 26 3HD2 LEU 26 -4.203 -1.716 -1.381
180 HD22 LEU 26 1HD2 LEU 26 -3.640 -3.141 -0.507
181 HD23 LEU 26 2HD2 LEU 26 -2.676 -2.480 -1.828
182 H SER 27 H SER 27 -3.380 1.981 -0.534
183 HA SER 27 HA SER 27 -0.890 2.039 -1.717
184 HB2 SER 27 1HB SER 27 -1.686 4.114 -2.877
185 HB3 SER 27 2HB SER 27 -2.841 2.782 -2.928
186 HG SER 27 HG SER 27 -3.733 4.881 -2.359
187 H LYS 28 H LYS 28 -2.305 4.683 0.218
188 HA LYS 28 HA LYS 28 -0.062 6.299 0.354
189 HB2 LYS 28 1HB LYS 28 -2.422 5.912 2.160
190 HB3 LYS 28 2HB LYS 28 -1.116 6.983 2.650
191 HG2 LYS 28 1HG LYS 28 -2.487 7.267 -0.002
192 HG3 LYS 28 2HG LYS 28 -3.109 8.025 1.466
193 HD2 LYS 28 1HD LYS 28 -1.118 9.313 1.733
194 HD3 LYS 28 2HD LYS 28 -0.295 8.411 0.458
195 HE2 LYS 28 1HE LYS 28 -2.359 9.287 -0.963
196 HE3 LYS 28 2HE LYS 28 -2.345 10.554 0.264
197 HZ1 LYS 28 3HZ LYS 28 0.105 9.791 -1.204
198 HZ2 LYS 28 1HZ LYS 28 -0.205 11.212 -0.340
199 HZ3 LYS 28 2HZ LYS 28 -0.976 10.937 -1.820
200 H HIS 29 H HIS 29 -0.521 3.237 1.724
201 HA HIS 29 HA HIS 29 1.472 3.654 3.820
202 HB2 HIS 29 1HB HIS 29 -0.122 2.319 4.772
203 HB3 HIS 29 2HB HIS 29 -0.579 1.586 3.237
204 HD1 HIS 29 1HD HIS 29 1.541 1.079 6.208
205 HD2 HIS 29 2HD HIS 29 1.112 -0.584 2.425
206 HE1 HIS 29 1HE HIS 29 2.776 -1.110 6.292
207 H GLN 30 H GLN 30 0.992 1.903 0.802
208 HA GLN 30 HA GLN 30 3.282 0.307 0.848
209 HB2 GLN 30 1HB GLN 30 1.817 1.539 -1.489
210 HB3 GLN 30 2HB GLN 30 3.075 0.321 -1.649
211 HG2 GLN 30 1HG GLN 30 1.581 -1.067 -0.050
212 HG3 GLN 30 2HG GLN 30 0.315 0.053 -0.550
213 HE21 GLN 30 1HE2 GLN 30 1.004 -2.894 -1.044
214 HE22 GLN 30 2HE2 GLN 30 0.799 -3.071 -2.750
215 H ARG 31 H ARG 31 2.881 3.697 0.203
216 HA ARG 31 HA ARG 31 5.238 4.218 -1.211
217 HB2 ARG 31 1HB ARG 31 5.014 6.539 -0.182
218 HB3 ARG 31 2HB ARG 31 3.643 5.954 -1.116
219 HG2 ARG 31 1HG ARG 31 2.311 5.698 0.739
220 HG3 ARG 31 2HG ARG 31 3.686 5.528 1.833
221 HD2 ARG 31 1HD ARG 31 3.167 8.103 0.390
222 HD3 ARG 31 2HD ARG 31 2.315 7.715 1.884
223 HE ARG 31 HE ARG 31 4.331 7.885 3.058
224 HH11 ARG 31 2HH1 ARG 31 4.763 8.418 -0.355
225 HH12 ARG 31 1HH1 ARG 31 6.335 9.125 -0.178
226 HH21 ARG 31 2HH2 ARG 31 6.400 8.813 3.304
227 HH22 ARG 31 1HH2 ARG 31 7.265 9.348 1.904
228 H ILE 32 H ILE 32 4.759 3.301 2.046
229 HA ILE 32 HA ILE 32 7.058 4.492 3.205
230 HB ILE 32 HB ILE 32 6.648 3.202 5.107
231 HG12 ILE 32 1HG1 ILE 32 5.124 1.235 3.385
232 HG13 ILE 32 2HG1 ILE 32 6.768 1.003 3.969
233 HG21 ILE 32 1HG2 ILE 32 4.346 4.178 3.637
234 HG22 ILE 32 2HG2 ILE 32 3.919 2.918 4.793
235 HG23 ILE 32 3HG2 ILE 32 4.763 4.366 5.340
236 HD11 ILE 32 3HD1 ILE 32 4.704 1.571 6.001
237 HD12 ILE 32 1HD1 ILE 32 4.632 0.003 5.199
238 HD13 ILE 32 2HD1 ILE 32 6.093 0.486 6.060
239 H HIS 33 H HIS 33 6.489 1.500 1.470
240 HA HIS 33 HA HIS 33 9.152 0.497 2.039
241 HB2 HIS 33 1HB HIS 33 7.085 -0.632 0.144
242 HB3 HIS 33 2HB HIS 33 8.499 -1.462 0.787
243 HD1 HIS 33 1HD HIS 33 8.428 -1.691 3.543
244 HD2 HIS 33 2HD HIS 33 4.828 -1.115 1.551
245 HE1 HIS 33 1HE HIS 33 6.643 -2.432 5.152
246 H SER 34 H SER 34 7.334 1.761 -0.723
247 HA SER 34 HA SER 34 8.963 1.380 -2.831
248 HB2 SER 34 1HB SER 34 6.955 2.653 -3.123
249 HB3 SER 34 2HB SER 34 7.534 3.927 -2.049
250 HG SER 34 HG SER 34 8.279 3.339 -4.688
251 H GLY 35 H GLY 35 9.318 4.230 -0.704
252 HA2 GLY 35 1HA GLY 35 12.003 4.087 -0.193
253 HA3 GLY 35 2HA GLY 35 11.907 4.849 -1.775
254 H GLU 36 H GLU 36 11.656 5.291 1.596
255 HA GLU 36 HA GLU 36 10.281 7.833 1.429
256 HB2 GLU 36 1HB GLU 36 10.363 7.881 3.791
257 HB3 GLU 36 2HB GLU 36 10.080 6.200 3.364
258 HG2 GLU 36 1HG GLU 36 12.892 7.046 3.717
259 HG3 GLU 36 2HG GLU 36 11.887 6.949 5.162
260 H LYS 37 H LYS 37 11.260 9.793 2.401
261 HA LYS 37 HA LYS 37 13.823 10.292 1.206
262 HB2 LYS 37 1HB LYS 37 11.894 11.984 2.783
263 HB3 LYS 37 2HB LYS 37 13.471 12.589 2.294
264 HG2 LYS 37 1HG LYS 37 12.230 13.343 0.552
265 HG3 LYS 37 2HG LYS 37 12.657 11.750 -0.077
266 HD2 LYS 37 1HD LYS 37 10.378 11.822 -0.457
267 HD3 LYS 37 2HD LYS 37 10.462 10.992 1.099
268 HE2 LYS 37 1HE LYS 37 8.743 12.652 1.227
269 HE3 LYS 37 2HE LYS 37 10.101 13.190 2.214
270 HZ1 LYS 37 3HZ LYS 37 10.537 14.910 0.841
271 HZ2 LYS 37 1HZ LYS 37 8.895 14.754 0.462
272 HZ3 LYS 37 2HZ LYS 37 10.066 14.083 -0.558
273 HA PRO 38 HA PRO 38 16.300 9.320 4.731
274 HB2 PRO 38 1HB PRO 38 18.574 10.574 3.939
275 HB3 PRO 38 2HB PRO 38 18.027 9.045 3.241
276 HG2 PRO 38 1HG PRO 38 17.727 11.827 2.178
277 HG3 PRO 38 2HG PRO 38 18.168 10.342 1.316
278 HD2 PRO 38 1HD PRO 38 15.668 11.380 1.245
279 HD3 PRO 38 2HD PRO 38 15.980 9.634 1.158
280 H SER 39 H SER 39 18.096 10.697 6.022
281 HA SER 39 HA SER 39 16.638 12.708 7.389
282 HB2 SER 39 1HB SER 39 18.510 12.872 8.841
283 HB3 SER 39 2HB SER 39 18.447 11.180 8.348
284 HG SER 39 HG SER 39 20.391 13.027 7.933
285 H GLY 40 H GLY 40 17.835 14.873 7.907
286 HA2 GLY 40 1HA GLY 40 19.094 16.013 5.525
287 HA3 GLY 40 2HA GLY 40 17.572 16.718 6.049
288 HA PRO 41 HA PRO 41 20.862 19.152 8.123
289 HB2 PRO 41 1HB PRO 41 19.520 21.506 7.950
290 HB3 PRO 41 2HB PRO 41 20.521 20.873 6.639
291 HG2 PRO 41 1HG PRO 41 17.550 20.754 6.980
292 HG3 PRO 41 2HG PRO 41 18.495 21.112 5.523
293 HD2 PRO 41 1HD PRO 41 17.396 18.681 5.985
294 HD3 PRO 41 2HD PRO 41 18.921 18.887 5.100
295 H SER 42 H SER 42 17.936 17.957 8.948
296 HA SER 42 HA SER 42 16.917 19.510 10.989
297 HB2 SER 42 1HB SER 42 16.119 17.217 10.004
298 HB3 SER 42 2HB SER 42 17.065 16.532 11.325
299 HG SER 42 HG SER 42 15.813 17.887 12.745
300 H SER 43 H SER 43 17.795 20.281 12.779
301 HA SER 43 HA SER 43 20.202 19.027 13.858
302 HB2 SER 43 1HB SER 43 20.600 21.076 15.014
303 HB3 SER 43 2HB SER 43 20.052 21.522 13.399
304 HG SER 43 HG SER 43 18.285 22.350 14.218
305 H GLY 44 H GLY 44 20.426 18.853 16.234
306 HA2 GLY 44 1HA GLY 44 19.266 18.777 18.391
307 HA3 GLY 44 2HA GLY 44 17.844 18.219 17.523
Start of MODEL 10
1 H1 GLY 1 H GLY 1 -15.820 -16.825 -18.296
2 HA2 GLY 1 1HA GLY 1 -14.817 -16.700 -20.832
3 HA3 GLY 1 2HA GLY 1 -16.465 -16.112 -21.005
4 H SER 2 H SER 2 -17.022 -14.108 -20.204
5 HA SER 2 HA SER 2 -14.768 -12.478 -19.229
6 HB2 SER 2 1HB SER 2 -15.823 -12.013 -21.564
7 HB3 SER 2 2HB SER 2 -17.149 -11.306 -20.640
8 HG SER 2 HG SER 2 -15.944 -9.635 -20.246
9 H SER 3 H SER 3 -14.971 -11.981 -17.158
10 HA SER 3 HA SER 3 -17.589 -11.137 -16.150
11 HB2 SER 3 1HB SER 3 -17.346 -13.490 -15.496
12 HB3 SER 3 2HB SER 3 -15.788 -13.131 -14.752
13 HG SER 3 HG SER 3 -17.754 -13.183 -13.358
14 H GLY 4 H GLY 4 -17.396 -9.185 -15.288
15 HA2 GLY 4 1HA GLY 4 -14.823 -8.058 -14.695
16 HA3 GLY 4 2HA GLY 4 -16.380 -7.267 -14.494
17 H SER 5 H SER 5 -13.993 -7.400 -12.730
18 HA SER 5 HA SER 5 -15.073 -8.833 -10.414
19 HB2 SER 5 1HB SER 5 -12.386 -7.476 -10.733
20 HB3 SER 5 2HB SER 5 -12.882 -8.515 -9.398
21 HG SER 5 HG SER 5 -12.793 -9.363 -12.102
22 H SER 6 H SER 6 -15.471 -7.817 -8.444
23 HA SER 6 HA SER 6 -15.975 -4.935 -8.664
24 HB2 SER 6 1HB SER 6 -17.475 -5.270 -6.712
25 HB3 SER 6 2HB SER 6 -17.927 -6.273 -8.090
26 HG SER 6 HG SER 6 -17.942 -7.496 -6.187
27 H GLY 7 H GLY 7 -14.382 -7.354 -6.655
28 HA2 GLY 7 1HA GLY 7 -12.201 -6.550 -5.735
29 HA3 GLY 7 2HA GLY 7 -13.094 -5.149 -5.165
30 H LYS 8 H LYS 8 -13.773 -8.642 -5.053
31 HA LYS 8 HA LYS 8 -14.849 -8.513 -2.436
32 HB2 LYS 8 1HB LYS 8 -13.813 -10.942 -3.909
33 HB3 LYS 8 2HB LYS 8 -14.915 -10.943 -2.538
34 HG2 LYS 8 1HG LYS 8 -15.718 -9.423 -4.955
35 HG3 LYS 8 2HG LYS 8 -15.766 -11.186 -5.027
36 HD2 LYS 8 1HD LYS 8 -17.861 -10.816 -4.219
37 HD3 LYS 8 2HD LYS 8 -16.987 -10.855 -2.685
38 HE2 LYS 8 1HE LYS 8 -16.713 -8.295 -3.104
39 HE3 LYS 8 2HE LYS 8 -18.084 -8.516 -4.190
40 HZ1 LYS 8 3HZ LYS 8 -18.301 -8.027 -1.568
41 HZ2 LYS 8 1HZ LYS 8 -18.394 -9.716 -1.577
42 HZ3 LYS 8 2HZ LYS 8 -19.489 -8.803 -2.487
43 H LYS 9 H LYS 9 -11.719 -9.615 -3.694
44 HA LYS 9 HA LYS 9 -10.648 -10.443 -1.224
45 HB2 LYS 9 1HB LYS 9 -9.431 -11.260 -3.000
46 HB3 LYS 9 2HB LYS 9 -9.530 -9.752 -3.900
47 HG2 LYS 9 1HG LYS 9 -7.941 -8.760 -2.241
48 HG3 LYS 9 2HG LYS 9 -7.739 -10.378 -1.567
49 HD2 LYS 9 1HD LYS 9 -6.871 -11.198 -3.653
50 HD3 LYS 9 2HD LYS 9 -7.235 -9.669 -4.455
51 HE2 LYS 9 1HE LYS 9 -5.573 -8.523 -3.197
52 HE3 LYS 9 2HE LYS 9 -5.349 -9.900 -2.120
53 HZ1 LYS 9 3HZ LYS 9 -4.743 -9.959 -5.024
54 HZ2 LYS 9 1HZ LYS 9 -4.369 -11.146 -3.878
55 HZ3 LYS 9 2HZ LYS 9 -3.590 -9.646 -3.826
56 HA PRO 10 HA PRO 10 -9.845 -6.598 0.779
57 HB2 PRO 10 1HB PRO 10 -7.977 -7.456 2.553
58 HB3 PRO 10 2HB PRO 10 -9.698 -7.819 2.720
59 HG2 PRO 10 1HG PRO 10 -7.498 -9.532 1.631
60 HG3 PRO 10 2HG PRO 10 -8.827 -9.975 2.718
61 HD2 PRO 10 1HD PRO 10 -8.872 -10.515 0.065
62 HD3 PRO 10 2HD PRO 10 -10.344 -10.159 0.992
63 H LEU 11 H LEU 11 -8.134 -5.052 1.147
64 HA LEU 11 HA LEU 11 -6.028 -5.268 -0.868
65 HB2 LEU 11 1HB LEU 11 -6.711 -2.851 0.782
66 HB3 LEU 11 2HB LEU 11 -5.819 -2.914 -0.737
67 HG LEU 11 HG LEU 11 -8.774 -3.415 -0.383
68 HD11 LEU 11 1HD1 LEU 11 -7.452 -1.183 -1.894
69 HD12 LEU 11 2HD1 LEU 11 -7.887 -1.039 -0.191
70 HD13 LEU 11 3HD1 LEU 11 -9.138 -1.332 -1.399
71 HD21 LEU 11 3HD2 LEU 11 -8.186 -4.776 -2.170
72 HD22 LEU 11 1HD2 LEU 11 -6.932 -3.669 -2.730
73 HD23 LEU 11 2HD2 LEU 11 -8.633 -3.261 -2.956
74 H VAL 12 H VAL 12 -4.311 -6.337 -0.067
75 HA VAL 12 HA VAL 12 -3.211 -5.408 2.507
76 HB VAL 12 HB VAL 12 -3.712 -7.623 2.954
77 HG11 VAL 12 1HG1 VAL 12 -3.367 -7.961 0.060
78 HG12 VAL 12 2HG1 VAL 12 -2.847 -9.338 1.033
79 HG13 VAL 12 3HG1 VAL 12 -4.499 -8.735 1.168
80 HG21 VAL 12 3HG2 VAL 12 -0.947 -7.833 1.767
81 HG22 VAL 12 1HG2 VAL 12 -1.314 -7.118 3.337
82 HG23 VAL 12 2HG2 VAL 12 -1.629 -8.830 3.052
83 H CYS 13 H CYS 13 -0.984 -5.103 2.670
84 HA CYS 13 HA CYS 13 0.303 -4.225 0.287
85 HB2 CYS 13 1HB CYS 13 0.634 -3.255 2.595
86 HB3 CYS 13 2HB CYS 13 1.592 -4.681 2.980
87 H ASN 14 H ASN 14 1.017 -5.623 -1.186
88 HA ASN 14 HA ASN 14 1.768 -8.297 -0.609
89 HB2 ASN 14 1HB ASN 14 1.774 -6.540 -3.010
90 HB3 ASN 14 2HB ASN 14 2.821 -7.956 -3.048
91 HD21 ASN 14 1HD2 ASN 14 1.755 -9.210 -4.458
92 HD22 ASN 14 2HD2 ASN 14 0.142 -9.787 -4.234
93 H GLU 15 H GLU 15 3.344 -5.508 0.089
94 HA GLU 15 HA GLU 15 6.029 -6.496 -0.486
95 HB2 GLU 15 1HB GLU 15 5.140 -3.900 0.786
96 HB3 GLU 15 2HB GLU 15 6.788 -4.307 0.326
97 HG2 GLU 15 1HG GLU 15 4.685 -4.430 -1.764
98 HG3 GLU 15 2HG GLU 15 5.226 -2.845 -1.214
99 H CYS 16 H CYS 16 3.964 -5.680 2.266
100 HA CYS 16 HA CYS 16 5.892 -7.053 4.024
101 HB2 CYS 16 1HB CYS 16 5.174 -5.641 5.845
102 HB3 CYS 16 2HB CYS 16 5.627 -4.616 4.487
103 H GLY 17 H GLY 17 2.495 -6.552 3.230
104 HA2 GLY 17 1HA GLY 17 0.977 -8.417 3.244
105 HA3 GLY 17 2HA GLY 17 1.898 -9.103 4.575
106 H LYS 18 H LYS 18 0.717 -5.786 4.225
107 HA LYS 18 HA LYS 18 -0.787 -6.156 6.725
108 HB2 LYS 18 1HB LYS 18 1.079 -4.370 6.435
109 HB3 LYS 18 2HB LYS 18 -0.133 -3.486 5.516
110 HG2 LYS 18 1HG LYS 18 -1.564 -3.318 7.400
111 HG3 LYS 18 2HG LYS 18 -0.585 -4.460 8.324
112 HD2 LYS 18 1HD LYS 18 0.750 -2.014 7.299
113 HD3 LYS 18 2HD LYS 18 -0.377 -1.828 8.645
114 HE2 LYS 18 1HE LYS 18 1.593 -2.207 9.766
115 HE3 LYS 18 2HE LYS 18 0.952 -3.845 9.647
116 HZ1 LYS 18 3HZ LYS 18 2.884 -2.696 7.711
117 HZ2 LYS 18 1HZ LYS 18 2.393 -4.310 7.836
118 HZ3 LYS 18 2HZ LYS 18 3.342 -3.618 9.053
119 H THR 19 H THR 19 -2.916 -6.312 6.576
120 HA THR 19 HA THR 19 -4.279 -5.643 4.119
121 HB THR 19 HB THR 19 -6.294 -6.537 5.238
122 HG1 THR 19 1HG THR 19 -6.229 -7.165 7.335
123 HG21 THR 19 3HG2 THR 19 -5.019 -8.842 5.872
124 HG22 THR 19 1HG2 THR 19 -3.780 -8.037 4.909
125 HG23 THR 19 2HG2 THR 19 -5.377 -8.334 4.222
126 H PHE 20 H PHE 20 -5.909 -4.117 3.863
127 HA PHE 20 HA PHE 20 -6.266 -2.189 6.051
128 HB2 PHE 20 1HB PHE 20 -5.648 -1.544 3.163
129 HB3 PHE 20 2HB PHE 20 -6.213 -0.357 4.335
130 HD1 PHE 20 1HD PHE 20 -3.445 -2.643 3.490
131 HD2 PHE 20 2HD PHE 20 -4.739 0.616 5.901
132 HE1 PHE 20 1HE PHE 20 -1.122 -2.254 4.204
133 HE2 PHE 20 2HE PHE 20 -2.419 1.011 6.618
134 HZ PHE 20 HZ PHE 20 -0.607 -0.424 5.769
135 H ARG 21 H ARG 21 -8.132 -0.656 5.542
136 HA ARG 21 HA ARG 21 -10.382 -2.288 4.654
137 HB2 ARG 21 1HB ARG 21 -10.168 0.265 6.236
138 HB3 ARG 21 2HB ARG 21 -11.708 -0.314 5.617
139 HG2 ARG 21 1HG ARG 21 -10.966 -2.535 6.832
140 HG3 ARG 21 2HG ARG 21 -9.999 -1.406 7.783
141 HD2 ARG 21 1HD ARG 21 -11.955 -0.167 8.410
142 HD3 ARG 21 2HD ARG 21 -12.960 -1.111 7.311
143 HE ARG 21 HE ARG 21 -13.002 -2.827 8.854
144 HH11 ARG 21 2HH1 ARG 21 -10.706 -0.396 9.823
145 HH12 ARG 21 1HH1 ARG 21 -10.492 -1.047 11.414
146 HH21 ARG 21 2HH2 ARG 21 -12.728 -3.694 10.946
147 HH22 ARG 21 1HH2 ARG 21 -11.641 -2.923 12.051
148 H GLN 22 H GLN 22 -9.042 0.960 4.094
149 HA GLN 22 HA GLN 22 -10.693 1.191 1.684
150 HB2 GLN 22 1HB GLN 22 -9.001 3.294 3.046
151 HB3 GLN 22 2HB GLN 22 -10.121 3.559 1.716
152 HG2 GLN 22 1HG GLN 22 -11.996 3.144 3.077
153 HG3 GLN 22 2HG GLN 22 -11.004 2.468 4.368
154 HE21 GLN 22 1HE2 GLN 22 -10.518 3.758 5.992
155 HE22 GLN 22 2HE2 GLN 22 -10.599 5.483 5.978
156 H SER 23 H SER 23 -9.632 2.237 -0.228
157 HA SER 23 HA SER 23 -7.329 0.711 -0.963
158 HB2 SER 23 1HB SER 23 -9.078 1.234 -2.601
159 HB3 SER 23 2HB SER 23 -8.736 2.956 -2.431
160 HG SER 23 HG SER 23 -6.908 2.725 -3.533
161 H SER 24 H SER 24 -7.928 4.203 -0.593
162 HA SER 24 HA SER 24 -5.377 5.128 -1.135
163 HB2 SER 24 1HB SER 24 -7.356 6.236 0.872
164 HB3 SER 24 2HB SER 24 -5.976 7.111 0.208
165 HG SER 24 HG SER 24 -8.320 6.246 -1.103
166 H CYS 25 H CYS 25 -6.657 3.705 1.802
167 HA CYS 25 HA CYS 25 -4.625 4.412 3.583
168 HB2 CYS 25 1HB CYS 25 -6.507 2.068 3.456
169 HB3 CYS 25 2HB CYS 25 -5.311 2.207 4.739
170 HG CYS 25 HG CYS 25 -8.251 3.283 4.893
171 H LEU 26 H LEU 26 -4.998 1.267 1.936
172 HA LEU 26 HA LEU 26 -2.530 0.210 2.600
173 HB2 LEU 26 1HB LEU 26 -4.121 -1.232 1.648
174 HB3 LEU 26 2HB LEU 26 -4.322 -0.207 0.229
175 HG LEU 26 HG LEU 26 -2.098 -0.864 -0.559
176 HD11 LEU 26 1HD1 LEU 26 -0.591 -1.907 0.702
177 HD12 LEU 26 2HD1 LEU 26 -1.757 -3.119 1.233
178 HD13 LEU 26 3HD1 LEU 26 -1.648 -1.572 2.073
179 HD21 LEU 26 3HD2 LEU 26 -2.626 -3.265 -1.002
180 HD22 LEU 26 1HD2 LEU 26 -3.942 -2.149 -1.369
181 HD23 LEU 26 2HD2 LEU 26 -3.989 -3.114 0.107
182 H SER 27 H SER 27 -3.398 1.971 -0.374
183 HA SER 27 HA SER 27 -0.902 1.950 -1.588
184 HB2 SER 27 1HB SER 27 -3.148 3.965 -1.705
185 HB3 SER 27 2HB SER 27 -1.703 4.096 -2.707
186 HG SER 27 HG SER 27 -2.730 1.604 -2.827
187 H LYS 28 H LYS 28 -2.297 4.617 0.330
188 HA LYS 28 HA LYS 28 -0.049 6.229 0.435
189 HB2 LYS 28 1HB LYS 28 -2.396 5.863 2.265
190 HB3 LYS 28 2HB LYS 28 -1.085 6.939 2.729
191 HG2 LYS 28 1HG LYS 28 -1.535 8.439 1.041
192 HG3 LYS 28 2HG LYS 28 -2.350 7.232 0.043
193 HD2 LYS 28 1HD LYS 28 -4.119 8.510 0.820
194 HD3 LYS 28 2HD LYS 28 -4.083 7.176 1.976
195 HE2 LYS 28 1HE LYS 28 -4.253 8.998 3.376
196 HE3 LYS 28 2HE LYS 28 -2.507 8.754 3.324
197 HZ1 LYS 28 3HZ LYS 28 -4.123 10.887 2.133
198 HZ2 LYS 28 1HZ LYS 28 -2.713 10.415 1.326
199 HZ3 LYS 28 2HZ LYS 28 -2.628 10.977 2.919
200 H HIS 29 H HIS 29 -0.517 3.183 1.845
201 HA HIS 29 HA HIS 29 1.504 3.613 3.913
202 HB2 HIS 29 1HB HIS 29 -0.107 2.316 4.897
203 HB3 HIS 29 2HB HIS 29 -0.565 1.545 3.381
204 HD1 HIS 29 1HD HIS 29 1.400 1.024 6.413
205 HD2 HIS 29 2HD HIS 29 1.277 -0.561 2.575
206 HE1 HIS 29 1HE HIS 29 2.671 -1.142 6.539
207 H GLN 30 H GLN 30 0.981 1.867 0.908
208 HA GLN 30 HA GLN 30 3.229 0.214 0.943
209 HB2 GLN 30 1HB GLN 30 1.844 1.510 -1.409
210 HB3 GLN 30 2HB GLN 30 3.020 0.210 -1.536
211 HG2 GLN 30 1HG GLN 30 1.404 -1.046 0.065
212 HG3 GLN 30 2HG GLN 30 0.227 0.140 -0.496
213 HE21 GLN 30 1HE2 GLN 30 1.297 -2.876 -0.994
214 HE22 GLN 30 2HE2 GLN 30 0.910 -3.072 -2.666
215 H ARG 31 H ARG 31 2.880 3.599 0.082
216 HA ARG 31 HA ARG 31 5.234 4.090 -1.259
217 HB2 ARG 31 1HB ARG 31 5.117 6.390 -0.204
218 HB3 ARG 31 2HB ARG 31 3.671 5.859 -1.052
219 HG2 ARG 31 1HG ARG 31 2.436 5.708 0.853
220 HG3 ARG 31 2HG ARG 31 3.834 5.327 1.860
221 HD2 ARG 31 1HD ARG 31 3.082 8.019 0.732
222 HD3 ARG 31 2HD ARG 31 3.029 7.525 2.423
223 HE ARG 31 HE ARG 31 5.624 7.157 1.743
224 HH11 ARG 31 2HH1 ARG 31 3.426 9.843 1.472
225 HH12 ARG 31 1HH1 ARG 31 4.666 11.043 1.626
226 HH21 ARG 31 2HH2 ARG 31 7.267 8.727 1.947
227 HH22 ARG 31 1HH2 ARG 31 6.851 10.407 1.895
228 H ILE 32 H ILE 32 4.808 3.160 2.015
229 HA ILE 32 HA ILE 32 7.193 4.225 3.110
230 HB ILE 32 HB ILE 32 6.803 2.895 5.002
231 HG12 ILE 32 1HG1 ILE 32 5.183 1.077 3.208
232 HG13 ILE 32 2HG1 ILE 32 6.738 0.711 3.947
233 HG21 ILE 32 1HG2 ILE 32 4.068 2.820 4.864
234 HG22 ILE 32 2HG2 ILE 32 5.034 4.226 5.306
235 HG23 ILE 32 3HG2 ILE 32 4.481 4.024 3.644
236 HD11 ILE 32 3HD1 ILE 32 5.702 -0.120 5.708
237 HD12 ILE 32 1HD1 ILE 32 4.937 1.440 6.009
238 HD13 ILE 32 2HD1 ILE 32 4.145 0.255 4.971
239 H HIS 33 H HIS 33 6.449 1.298 1.338
240 HA HIS 33 HA HIS 33 9.132 0.238 1.775
241 HB2 HIS 33 1HB HIS 33 6.916 -0.961 0.108
242 HB3 HIS 33 2HB HIS 33 8.355 -1.773 0.718
243 HD1 HIS 33 1HD HIS 33 8.443 -1.968 3.434
244 HD2 HIS 33 2HD HIS 33 4.742 -1.178 1.721
245 HE1 HIS 33 1HE HIS 33 6.748 -2.543 5.201
246 H SER 34 H SER 34 7.040 1.139 -0.962
247 HA SER 34 HA SER 34 7.514 1.700 -3.120
248 HB2 SER 34 1HB SER 34 8.506 3.635 -1.858
249 HB3 SER 34 2HB SER 34 10.070 2.825 -1.954
250 HG SER 34 HG SER 34 8.697 3.101 -4.343
251 H GLY 35 H GLY 35 8.138 -0.925 -2.560
252 HA2 GLY 35 1HA GLY 35 10.804 -1.558 -3.437
253 HA3 GLY 35 2HA GLY 35 9.497 -2.700 -3.158
254 H GLU 36 H GLU 36 7.594 -2.193 -4.864
255 HA GLU 36 HA GLU 36 8.811 -1.885 -7.518
256 HB2 GLU 36 1HB GLU 36 7.688 -3.840 -8.365
257 HB3 GLU 36 2HB GLU 36 8.637 -4.303 -6.960
258 HG2 GLU 36 1HG GLU 36 6.473 -4.017 -5.631
259 HG3 GLU 36 2HG GLU 36 5.666 -4.017 -7.198
260 H LYS 37 H LYS 37 7.512 -0.974 -9.069
261 HA LYS 37 HA LYS 37 5.274 0.542 -8.130
262 HB2 LYS 37 1HB LYS 37 6.467 0.182 -10.882
263 HB3 LYS 37 2HB LYS 37 5.126 1.266 -10.537
264 HG2 LYS 37 1HG LYS 37 7.666 1.516 -8.992
265 HG3 LYS 37 2HG LYS 37 7.552 2.183 -10.622
266 HD2 LYS 37 1HD LYS 37 5.572 3.475 -9.928
267 HD3 LYS 37 2HD LYS 37 5.749 2.839 -8.291
268 HE2 LYS 37 1HE LYS 37 6.718 5.041 -8.392
269 HE3 LYS 37 2HE LYS 37 8.005 3.854 -8.189
270 HZ1 LYS 37 3HZ LYS 37 8.319 5.703 -9.906
271 HZ2 LYS 37 1HZ LYS 37 7.248 4.819 -10.873
272 HZ3 LYS 37 2HZ LYS 37 8.704 4.122 -10.369
273 HA PRO 38 HA PRO 38 2.126 -2.450 -8.963
274 HB2 PRO 38 1HB PRO 38 -0.003 -0.773 -8.803
275 HB3 PRO 38 2HB PRO 38 0.882 -1.340 -7.382
276 HG2 PRO 38 1HG PRO 38 1.109 1.264 -8.841
277 HG3 PRO 38 2HG PRO 38 1.082 0.959 -7.094
278 HD2 PRO 38 1HD PRO 38 3.376 1.421 -8.457
279 HD3 PRO 38 2HD PRO 38 3.306 0.356 -7.038
280 H SER 39 H SER 39 3.332 -0.370 -11.108
281 HA SER 39 HA SER 39 1.165 -0.236 -13.004
282 HB2 SER 39 1HB SER 39 2.712 0.908 -14.441
283 HB3 SER 39 2HB SER 39 2.981 1.504 -12.803
284 HG SER 39 HG SER 39 4.515 -0.662 -13.315
285 H GLY 40 H GLY 40 0.810 -1.510 -14.754
286 HA2 GLY 40 1HA GLY 40 2.123 -4.086 -14.786
287 HA3 GLY 40 2HA GLY 40 0.778 -3.584 -15.801
288 HA PRO 41 HA PRO 41 4.444 -3.887 -18.560
289 HB2 PRO 41 1HB PRO 41 3.049 -4.903 -20.655
290 HB3 PRO 41 2HB PRO 41 3.696 -5.909 -19.353
291 HG2 PRO 41 1HG PRO 41 0.914 -4.875 -19.744
292 HG3 PRO 41 2HG PRO 41 1.447 -6.487 -19.233
293 HD2 PRO 41 1HD PRO 41 0.559 -4.623 -17.481
294 HD3 PRO 41 2HD PRO 41 1.802 -5.818 -17.056
295 H SER 42 H SER 42 4.838 -1.782 -19.043
296 HA SER 42 HA SER 42 3.512 -0.649 -21.323
297 HB2 SER 42 1HB SER 42 2.909 1.489 -20.124
298 HB3 SER 42 2HB SER 42 1.910 0.098 -19.700
299 HG SER 42 HG SER 42 4.193 0.811 -18.195
300 H SER 43 H SER 43 4.534 1.367 -22.036
301 HA SER 43 HA SER 43 7.259 1.682 -20.959
302 HB2 SER 43 1HB SER 43 6.394 1.695 -23.860
303 HB3 SER 43 2HB SER 43 8.005 2.142 -23.298
304 HG SER 43 HG SER 43 7.168 -0.254 -23.888
305 H GLY 44 H GLY 44 7.597 3.653 -20.189
306 HA2 GLY 44 1HA GLY 44 7.002 6.018 -21.626
307 HA3 GLY 44 2HA GLY 44 5.801 5.775 -20.367
Start of MODEL 11
1 H1 GLY 1 H GLY 1 -20.310 -10.023 -14.401
2 HA2 GLY 1 1HA GLY 1 -21.782 -8.159 -15.327
3 HA3 GLY 1 2HA GLY 1 -22.341 -8.872 -13.821
4 H SER 2 H SER 2 -19.863 -6.468 -14.723
5 HA SER 2 HA SER 2 -21.238 -4.409 -13.237
6 HB2 SER 2 1HB SER 2 -19.751 -5.860 -11.627
7 HB3 SER 2 2HB SER 2 -18.427 -4.937 -12.339
8 HG SER 2 HG SER 2 -20.327 -3.215 -11.735
9 H SER 3 H SER 3 -20.431 -2.316 -13.645
10 HA SER 3 HA SER 3 -19.552 -1.778 -16.184
11 HB2 SER 3 1HB SER 3 -19.529 -0.222 -13.635
12 HB3 SER 3 2HB SER 3 -18.651 0.431 -15.019
13 HG SER 3 HG SER 3 -20.814 -0.160 -16.117
14 H GLY 4 H GLY 4 -17.491 -1.506 -13.277
15 HA2 GLY 4 1HA GLY 4 -15.144 -1.852 -15.017
16 HA3 GLY 4 2HA GLY 4 -15.127 -1.141 -13.410
17 H SER 5 H SER 5 -14.635 -2.397 -11.710
18 HA SER 5 HA SER 5 -14.810 -5.303 -11.979
19 HB2 SER 5 1HB SER 5 -12.277 -3.859 -11.163
20 HB3 SER 5 2HB SER 5 -12.512 -5.607 -11.153
21 HG SER 5 HG SER 5 -11.711 -4.096 -13.162
22 H SER 6 H SER 6 -15.144 -6.386 -10.071
23 HA SER 6 HA SER 6 -16.083 -4.797 -7.866
24 HB2 SER 6 1HB SER 6 -15.821 -7.806 -8.058
25 HB3 SER 6 2HB SER 6 -16.789 -6.908 -6.890
26 HG SER 6 HG SER 6 -18.150 -6.272 -8.517
27 H GLY 7 H GLY 7 -15.403 -5.158 -5.631
28 HA2 GLY 7 1HA GLY 7 -12.522 -5.803 -5.459
29 HA3 GLY 7 2HA GLY 7 -13.252 -4.465 -4.583
30 H LYS 8 H LYS 8 -13.927 -7.941 -5.025
31 HA LYS 8 HA LYS 8 -14.992 -8.228 -2.401
32 HB2 LYS 8 1HB LYS 8 -15.417 -9.670 -4.511
33 HB3 LYS 8 2HB LYS 8 -13.944 -10.512 -4.050
34 HG2 LYS 8 1HG LYS 8 -14.885 -11.351 -2.098
35 HG3 LYS 8 2HG LYS 8 -16.181 -10.152 -2.095
36 HD2 LYS 8 1HD LYS 8 -17.015 -11.235 -4.221
37 HD3 LYS 8 2HD LYS 8 -15.862 -12.535 -3.910
38 HE2 LYS 8 1HE LYS 8 -17.889 -13.292 -3.001
39 HE3 LYS 8 2HE LYS 8 -16.952 -12.732 -1.617
40 HZ1 LYS 8 3HZ LYS 8 -19.494 -11.970 -2.264
41 HZ2 LYS 8 1HZ LYS 8 -18.549 -10.651 -2.745
42 HZ3 LYS 8 2HZ LYS 8 -18.477 -11.206 -1.149
43 H LYS 9 H LYS 9 -11.899 -9.133 -3.892
44 HA LYS 9 HA LYS 9 -10.784 -10.308 -1.578
45 HB2 LYS 9 1HB LYS 9 -9.610 -9.192 -4.111
46 HB3 LYS 9 2HB LYS 9 -8.575 -9.778 -2.815
47 HG2 LYS 9 1HG LYS 9 -9.447 -11.980 -3.004
48 HG3 LYS 9 2HG LYS 9 -10.729 -11.444 -4.092
49 HD2 LYS 9 1HD LYS 9 -8.859 -10.705 -5.661
50 HD3 LYS 9 2HD LYS 9 -7.779 -11.653 -4.636
51 HE2 LYS 9 1HE LYS 9 -10.274 -12.816 -5.842
52 HE3 LYS 9 2HE LYS 9 -8.738 -12.797 -6.707
53 HZ1 LYS 9 3HZ LYS 9 -7.857 -13.885 -4.549
54 HZ2 LYS 9 1HZ LYS 9 -8.694 -14.833 -5.673
55 HZ3 LYS 9 2HZ LYS 9 -9.479 -14.283 -4.279
56 HA PRO 10 HA PRO 10 -9.779 -6.784 0.865
57 HB2 PRO 10 1HB PRO 10 -7.794 -7.865 2.368
58 HB3 PRO 10 2HB PRO 10 -9.501 -8.258 2.604
59 HG2 PRO 10 1HG PRO 10 -7.389 -9.793 1.139
60 HG3 PRO 10 2HG PRO 10 -8.640 -10.389 2.245
61 HD2 PRO 10 1HD PRO 10 -8.874 -10.560 -0.447
62 HD3 PRO 10 2HD PRO 10 -10.275 -10.342 0.621
63 H LEU 11 H LEU 11 -7.881 -5.435 1.497
64 HA LEU 11 HA LEU 11 -5.921 -5.370 -0.696
65 HB2 LEU 11 1HB LEU 11 -6.595 -3.093 1.143
66 HB3 LEU 11 2HB LEU 11 -5.754 -3.031 -0.405
67 HG LEU 11 HG LEU 11 -8.675 -3.705 -0.061
68 HD11 LEU 11 1HD1 LEU 11 -8.221 -1.273 -1.461
69 HD12 LEU 11 2HD1 LEU 11 -7.374 -1.197 0.083
70 HD13 LEU 11 3HD1 LEU 11 -9.105 -1.536 0.043
71 HD21 LEU 11 3HD2 LEU 11 -7.081 -3.063 -2.539
72 HD22 LEU 11 1HD2 LEU 11 -8.796 -3.467 -2.461
73 HD23 LEU 11 2HD2 LEU 11 -7.584 -4.681 -2.049
74 H VAL 12 H VAL 12 -4.177 -6.475 -0.006
75 HA VAL 12 HA VAL 12 -3.028 -5.706 2.599
76 HB VAL 12 HB VAL 12 -3.492 -7.947 2.922
77 HG11 VAL 12 1HG1 VAL 12 -4.340 -8.930 1.085
78 HG12 VAL 12 2HG1 VAL 12 -3.217 -8.109 -0.001
79 HG13 VAL 12 3HG1 VAL 12 -2.699 -9.544 0.885
80 HG21 VAL 12 3HG2 VAL 12 -1.036 -7.376 3.157
81 HG22 VAL 12 1HG2 VAL 12 -1.424 -9.089 2.996
82 HG23 VAL 12 2HG2 VAL 12 -0.794 -8.194 1.613
83 H CYS 13 H CYS 13 -0.875 -5.202 2.702
84 HA CYS 13 HA CYS 13 0.369 -4.315 0.298
85 HB2 CYS 13 1HB CYS 13 0.643 -3.237 2.550
86 HB3 CYS 13 2HB CYS 13 1.635 -4.611 3.027
87 H ASN 14 H ASN 14 1.270 -5.640 -1.128
88 HA ASN 14 HA ASN 14 2.089 -8.286 -0.538
89 HB2 ASN 14 1HB ASN 14 3.082 -6.798 -2.946
90 HB3 ASN 14 2HB ASN 14 2.596 -8.485 -2.805
91 HD21 ASN 14 1HD2 ASN 14 1.736 -5.597 -4.049
92 HD22 ASN 14 2HD2 ASN 14 0.027 -5.819 -4.170
93 H GLU 15 H GLU 15 3.521 -5.437 0.272
94 HA GLU 15 HA GLU 15 6.269 -6.310 -0.130
95 HB2 GLU 15 1HB GLU 15 5.285 -3.816 1.259
96 HB3 GLU 15 2HB GLU 15 6.913 -4.135 0.679
97 HG2 GLU 15 1HG GLU 15 4.694 -4.208 -1.287
98 HG3 GLU 15 2HG GLU 15 5.215 -2.640 -0.673
99 H CYS 16 H CYS 16 4.033 -5.616 2.529
100 HA CYS 16 HA CYS 16 5.881 -7.022 4.345
101 HB2 CYS 16 1HB CYS 16 4.910 -5.697 6.178
102 HB3 CYS 16 2HB CYS 16 5.643 -4.667 4.953
103 H GLY 17 H GLY 17 2.533 -6.557 3.362
104 HA2 GLY 17 1HA GLY 17 1.017 -8.403 3.252
105 HA3 GLY 17 2HA GLY 17 1.903 -9.164 4.565
106 H LYS 18 H LYS 18 0.662 -5.852 4.348
107 HA LYS 18 HA LYS 18 -0.893 -6.378 6.789
108 HB2 LYS 18 1HB LYS 18 0.966 -4.543 6.613
109 HB3 LYS 18 2HB LYS 18 -0.279 -3.624 5.778
110 HG2 LYS 18 1HG LYS 18 -1.746 -3.866 7.734
111 HG3 LYS 18 2HG LYS 18 -0.459 -4.737 8.571
112 HD2 LYS 18 1HD LYS 18 0.992 -2.737 8.300
113 HD3 LYS 18 2HD LYS 18 -0.385 -1.879 7.606
114 HE2 LYS 18 1HE LYS 18 -1.493 -1.757 9.613
115 HE3 LYS 18 2HE LYS 18 -0.711 -3.201 10.255
116 HZ1 LYS 18 3HZ LYS 18 0.800 -1.940 11.239
117 HZ2 LYS 18 1HZ LYS 18 -0.022 -0.555 10.721
118 HZ3 LYS 18 2HZ LYS 18 1.222 -1.203 9.776
119 H THR 19 H THR 19 -3.004 -6.605 6.526
120 HA THR 19 HA THR 19 -4.313 -5.844 4.085
121 HB THR 19 HB THR 19 -6.331 -6.790 5.066
122 HG1 THR 19 1HG THR 19 -4.979 -7.480 7.427
123 HG21 THR 19 3HG2 THR 19 -3.764 -8.265 5.145
124 HG22 THR 19 1HG2 THR 19 -5.222 -8.579 4.205
125 HG23 THR 19 2HG2 THR 19 -5.152 -9.043 5.905
126 H PHE 20 H PHE 20 -5.978 -4.336 3.828
127 HA PHE 20 HA PHE 20 -6.336 -2.403 6.011
128 HB2 PHE 20 1HB PHE 20 -5.704 -1.766 3.125
129 HB3 PHE 20 2HB PHE 20 -6.286 -0.575 4.284
130 HD1 PHE 20 1HD PHE 20 -3.503 -2.874 3.507
131 HD2 PHE 20 2HD PHE 20 -4.826 0.440 5.827
132 HE1 PHE 20 1HE PHE 20 -1.189 -2.467 4.240
133 HE2 PHE 20 2HE PHE 20 -2.515 0.853 6.562
134 HZ PHE 20 HZ PHE 20 -0.693 -0.601 5.768
135 H ARG 21 H ARG 21 -8.198 -0.863 5.481
136 HA ARG 21 HA ARG 21 -10.463 -2.501 4.684
137 HB2 ARG 21 1HB ARG 21 -10.505 -1.143 6.777
138 HB3 ARG 21 2HB ARG 21 -10.439 0.312 5.790
139 HG2 ARG 21 1HG ARG 21 -12.683 0.166 6.167
140 HG3 ARG 21 2HG ARG 21 -12.558 -0.743 4.659
141 HD2 ARG 21 1HD ARG 21 -12.551 -1.966 7.416
142 HD3 ARG 21 2HD ARG 21 -13.966 -1.854 6.370
143 HE ARG 21 HE ARG 21 -12.249 -3.144 4.790
144 HH11 ARG 21 2HH1 ARG 21 -13.097 -3.638 8.130
145 HH12 ARG 21 1HH1 ARG 21 -12.805 -5.345 8.087
146 HH21 ARG 21 2HH2 ARG 21 -11.861 -5.391 4.721
147 HH22 ARG 21 1HH2 ARG 21 -12.102 -6.341 6.148
148 H GLN 22 H GLN 22 -9.015 0.623 3.809
149 HA GLN 22 HA GLN 22 -10.591 0.570 1.322
150 HB2 GLN 22 1HB GLN 22 -9.417 2.882 2.867
151 HB3 GLN 22 2HB GLN 22 -10.060 3.043 1.238
152 HG2 GLN 22 1HG GLN 22 -11.696 1.935 3.493
153 HG3 GLN 22 2HG GLN 22 -11.587 3.664 3.169
154 HE21 GLN 22 1HE2 GLN 22 -13.778 3.799 2.690
155 HE22 GLN 22 2HE2 GLN 22 -14.437 3.181 1.218
156 H SER 23 H SER 23 -9.443 1.772 -0.517
157 HA SER 23 HA SER 23 -6.931 0.444 -0.961
158 HB2 SER 23 1HB SER 23 -8.483 2.390 -2.685
159 HB3 SER 23 2HB SER 23 -7.049 1.507 -3.206
160 HG SER 23 HG SER 23 -9.607 0.683 -3.119
161 H SER 24 H SER 24 -7.998 3.823 -0.710
162 HA SER 24 HA SER 24 -5.617 5.120 -1.190
163 HB2 SER 24 1HB SER 24 -7.739 5.871 0.836
164 HB3 SER 24 2HB SER 24 -6.498 6.957 0.211
165 HG SER 24 HG SER 24 -7.718 7.281 -1.456
166 H CYS 25 H CYS 25 -6.742 3.637 1.812
167 HA CYS 25 HA CYS 25 -4.671 4.538 3.480
168 HB2 CYS 25 1HB CYS 25 -6.933 3.216 3.958
169 HB3 CYS 25 2HB CYS 25 -5.843 1.835 3.932
170 HG CYS 25 HG CYS 25 -4.495 2.380 6.147
171 H LEU 26 H LEU 26 -5.048 1.280 2.069
172 HA LEU 26 HA LEU 26 -2.561 0.283 2.712
173 HB2 LEU 26 1HB LEU 26 -4.147 -1.215 1.850
174 HB3 LEU 26 2HB LEU 26 -4.391 -0.250 0.396
175 HG LEU 26 HG LEU 26 -2.035 -0.879 -0.268
176 HD11 LEU 26 1HD1 LEU 26 -0.916 -2.633 0.801
177 HD12 LEU 26 2HD1 LEU 26 -2.338 -3.089 1.739
178 HD13 LEU 26 3HD1 LEU 26 -1.473 -1.599 2.116
179 HD21 LEU 26 3HD2 LEU 26 -3.821 -3.274 0.023
180 HD22 LEU 26 1HD2 LEU 26 -2.733 -2.859 -1.302
181 HD23 LEU 26 2HD2 LEU 26 -4.220 -1.941 -1.062
182 H SER 27 H SER 27 -3.486 1.899 -0.326
183 HA SER 27 HA SER 27 -0.997 1.848 -1.561
184 HB2 SER 27 1HB SER 27 -3.416 3.580 -1.808
185 HB3 SER 27 2HB SER 27 -1.934 4.100 -2.609
186 HG SER 27 HG SER 27 -3.630 2.464 -3.591
187 H LYS 28 H LYS 28 -2.425 4.501 0.345
188 HA LYS 28 HA LYS 28 -0.235 6.212 0.308
189 HB2 LYS 28 1HB LYS 28 -2.547 5.830 2.162
190 HB3 LYS 28 2HB LYS 28 -1.242 6.904 2.649
191 HG2 LYS 28 1HG LYS 28 -1.564 8.109 0.465
192 HG3 LYS 28 2HG LYS 28 -3.026 7.145 0.242
193 HD2 LYS 28 1HD LYS 28 -2.574 8.743 2.742
194 HD3 LYS 28 2HD LYS 28 -3.259 9.481 1.291
195 HE2 LYS 28 1HE LYS 28 -5.077 7.873 1.305
196 HE3 LYS 28 2HE LYS 28 -4.372 7.055 2.698
197 HZ1 LYS 28 3HZ LYS 28 -4.690 9.081 3.990
198 HZ2 LYS 28 1HZ LYS 28 -6.160 8.517 3.370
199 HZ3 LYS 28 2HZ LYS 28 -5.394 9.843 2.653
200 H HIS 29 H HIS 29 -0.509 3.183 1.765
201 HA HIS 29 HA HIS 29 1.528 3.746 3.788
202 HB2 HIS 29 1HB HIS 29 0.022 2.385 4.840
203 HB3 HIS 29 2HB HIS 29 -0.464 1.588 3.346
204 HD1 HIS 29 1HD HIS 29 1.675 1.186 6.290
205 HD2 HIS 29 2HD HIS 29 1.381 -0.480 2.495
206 HE1 HIS 29 1HE HIS 29 3.018 -0.938 6.382
207 H GLN 30 H GLN 30 1.008 1.867 0.853
208 HA GLN 30 HA GLN 30 3.305 0.320 0.836
209 HB2 GLN 30 1HB GLN 30 1.821 1.594 -1.465
210 HB3 GLN 30 2HB GLN 30 3.095 0.399 -1.668
211 HG2 GLN 30 1HG GLN 30 1.587 -0.999 -0.028
212 HG3 GLN 30 2HG GLN 30 0.327 0.069 -0.645
213 HE21 GLN 30 1HE2 GLN 30 1.381 -2.879 -1.007
214 HE22 GLN 30 2HE2 GLN 30 1.179 -3.122 -2.705
215 H ARG 31 H ARG 31 2.879 3.705 0.017
216 HA ARG 31 HA ARG 31 5.188 4.285 -1.345
217 HB2 ARG 31 1HB ARG 31 5.065 6.545 -0.238
218 HB3 ARG 31 2HB ARG 31 3.579 6.008 -1.011
219 HG2 ARG 31 1HG ARG 31 2.695 5.333 1.171
220 HG3 ARG 31 2HG ARG 31 4.180 5.900 1.938
221 HD2 ARG 31 1HD ARG 31 2.324 7.530 2.082
222 HD3 ARG 31 2HD ARG 31 3.737 8.160 1.237
223 HE ARG 31 HE ARG 31 1.130 7.587 0.100
224 HH11 ARG 31 2HH1 ARG 31 4.483 8.333 -0.466
225 HH12 ARG 31 1HH1 ARG 31 4.218 8.911 -2.078
226 HH21 ARG 31 2HH2 ARG 31 0.768 8.345 -2.021
227 HH22 ARG 31 1HH2 ARG 31 2.104 8.918 -2.961
228 H ILE 32 H ILE 32 4.837 3.375 1.975
229 HA ILE 32 HA ILE 32 7.249 4.392 3.006
230 HB ILE 32 HB ILE 32 6.929 3.009 4.872
231 HG12 ILE 32 1HG1 ILE 32 5.155 1.221 3.196
232 HG13 ILE 32 2HG1 ILE 32 6.837 0.877 3.584
233 HG21 ILE 32 1HG2 ILE 32 4.597 4.194 3.627
234 HG22 ILE 32 2HG2 ILE 32 4.167 2.884 4.726
235 HG23 ILE 32 3HG2 ILE 32 5.128 4.244 5.308
236 HD11 ILE 32 3HD1 ILE 32 6.292 0.767 5.942
237 HD12 ILE 32 1HD1 ILE 32 4.613 1.176 5.588
238 HD13 ILE 32 2HD1 ILE 32 5.289 -0.350 5.016
239 H HIS 33 H HIS 33 6.489 1.449 1.245
240 HA HIS 33 HA HIS 33 9.174 0.398 1.586
241 HB2 HIS 33 1HB HIS 33 6.939 -0.677 -0.143
242 HB3 HIS 33 2HB HIS 33 8.391 -1.535 0.367
243 HD1 HIS 33 1HD HIS 33 8.550 -1.773 3.128
244 HD2 HIS 33 2HD HIS 33 4.803 -1.179 1.433
245 HE1 HIS 33 1HE HIS 33 6.898 -2.521 4.870
246 H SER 34 H SER 34 7.297 2.124 -0.782
247 HA SER 34 HA SER 34 8.442 1.699 -3.170
248 HB2 SER 34 1HB SER 34 7.891 3.903 -3.796
249 HB3 SER 34 2HB SER 34 6.781 3.544 -2.474
250 HG SER 34 HG SER 34 9.007 5.242 -2.528
251 H GLY 35 H GLY 35 9.940 3.499 -0.517
252 HA2 GLY 35 1HA GLY 35 12.501 2.822 -0.733
253 HA3 GLY 35 2HA GLY 35 12.357 3.932 -2.088
254 H GLU 36 H GLU 36 10.807 4.133 1.091
255 HA GLU 36 HA GLU 36 11.732 6.858 1.368
256 HB2 GLU 36 1HB GLU 36 9.956 5.100 3.056
257 HB3 GLU 36 2HB GLU 36 10.425 6.722 3.545
258 HG2 GLU 36 1HG GLU 36 9.481 7.449 1.265
259 HG3 GLU 36 2HG GLU 36 8.692 5.873 1.262
260 H LYS 37 H LYS 37 13.514 4.372 1.584
261 HA LYS 37 HA LYS 37 14.545 4.699 4.299
262 HB2 LYS 37 1HB LYS 37 15.881 2.743 3.869
263 HB3 LYS 37 2HB LYS 37 14.234 2.418 3.345
264 HG2 LYS 37 1HG LYS 37 14.823 2.650 1.060
265 HG3 LYS 37 2HG LYS 37 16.412 3.300 1.470
266 HD2 LYS 37 1HD LYS 37 16.999 1.140 1.024
267 HD3 LYS 37 2HD LYS 37 16.620 0.983 2.741
268 HE2 LYS 37 1HE LYS 37 14.515 0.555 0.652
269 HE3 LYS 37 2HE LYS 37 15.638 -0.735 1.079
270 HZ1 LYS 37 3HZ LYS 37 13.641 0.596 2.808
271 HZ2 LYS 37 1HZ LYS 37 14.917 -0.310 3.452
272 HZ3 LYS 37 2HZ LYS 37 13.780 -1.049 2.441
273 HA PRO 38 HA PRO 38 17.711 7.482 2.997
274 HB2 PRO 38 1HB PRO 38 19.367 7.205 5.131
275 HB3 PRO 38 2HB PRO 38 17.848 8.107 5.204
276 HG2 PRO 38 1HG PRO 38 18.435 5.310 6.095
277 HG3 PRO 38 2HG PRO 38 17.489 6.569 6.910
278 HD2 PRO 38 1HD PRO 38 16.337 4.555 5.514
279 HD3 PRO 38 2HD PRO 38 15.619 6.175 5.621
280 H SER 39 H SER 39 18.514 6.336 1.189
281 HA SER 39 HA SER 39 20.125 4.061 1.266
282 HB2 SER 39 1HB SER 39 19.244 4.710 -0.841
283 HB3 SER 39 2HB SER 39 19.936 6.327 -0.719
284 HG SER 39 HG SER 39 21.590 4.046 -0.735
285 H GLY 40 H GLY 40 21.081 7.491 1.172
286 HA2 GLY 40 1HA GLY 40 23.041 7.673 2.931
287 HA3 GLY 40 2HA GLY 40 23.856 6.732 1.691
288 HA PRO 41 HA PRO 41 23.787 11.457 0.844
289 HB2 PRO 41 1HB PRO 41 26.160 12.178 1.947
290 HB3 PRO 41 2HB PRO 41 24.632 12.239 2.832
291 HG2 PRO 41 1HG PRO 41 26.774 10.150 2.895
292 HG3 PRO 41 2HG PRO 41 25.860 10.856 4.241
293 HD2 PRO 41 1HD PRO 41 25.264 8.435 3.186
294 HD3 PRO 41 2HD PRO 41 24.026 9.511 3.865
295 H SER 42 H SER 42 25.068 12.455 -0.762
296 HA SER 42 HA SER 42 27.269 10.857 -1.864
297 HB2 SER 42 1HB SER 42 24.847 11.847 -3.374
298 HB3 SER 42 2HB SER 42 26.339 11.355 -4.175
299 HG SER 42 HG SER 42 24.659 9.697 -3.922
300 H SER 43 H SER 43 29.006 12.078 -2.123
301 HA SER 43 HA SER 43 29.072 14.836 -1.684
302 HB2 SER 43 1HB SER 43 31.104 13.215 -3.234
303 HB3 SER 43 2HB SER 43 31.384 14.749 -2.410
304 HG SER 43 HG SER 43 32.076 12.955 -1.163
305 H GLY 44 H GLY 44 29.355 13.052 -4.760
306 HA2 GLY 44 1HA GLY 44 28.913 15.569 -6.205
307 HA3 GLY 44 2HA GLY 44 29.520 14.075 -6.903
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -19.408 -11.719 -21.934
2 HA2 GLY 1 1HA GLY 1 -18.078 -10.495 -20.484
3 HA3 GLY 1 2HA GLY 1 -19.433 -9.410 -20.210
4 H SER 2 H SER 2 -17.939 -12.437 -19.258
5 HA SER 2 HA SER 2 -19.805 -12.799 -17.060
6 HB2 SER 2 1HB SER 2 -17.351 -14.397 -17.832
7 HB3 SER 2 2HB SER 2 -18.525 -14.850 -16.597
8 HG SER 2 HG SER 2 -19.345 -15.865 -18.282
9 H SER 3 H SER 3 -18.663 -13.480 -14.904
10 HA SER 3 HA SER 3 -16.458 -11.635 -14.307
11 HB2 SER 3 1HB SER 3 -18.861 -10.798 -13.672
12 HB3 SER 3 2HB SER 3 -18.699 -11.937 -12.336
13 HG SER 3 HG SER 3 -17.861 -9.550 -12.275
14 H GLY 4 H GLY 4 -14.899 -12.502 -13.078
15 HA2 GLY 4 1HA GLY 4 -14.858 -15.247 -12.490
16 HA3 GLY 4 2HA GLY 4 -13.726 -14.057 -11.865
17 H SER 5 H SER 5 -14.513 -12.746 -9.996
18 HA SER 5 HA SER 5 -16.054 -14.480 -8.187
19 HB2 SER 5 1HB SER 5 -13.859 -14.154 -7.319
20 HB3 SER 5 2HB SER 5 -13.906 -12.423 -7.657
21 HG SER 5 HG SER 5 -14.807 -13.788 -5.487
22 H SER 6 H SER 6 -17.656 -13.608 -6.859
23 HA SER 6 HA SER 6 -19.102 -11.420 -8.006
24 HB2 SER 6 1HB SER 6 -19.948 -13.580 -6.723
25 HB3 SER 6 2HB SER 6 -19.812 -12.521 -5.320
26 HG SER 6 HG SER 6 -21.789 -12.627 -7.026
27 H GLY 7 H GLY 7 -17.408 -11.945 -4.924
28 HA2 GLY 7 1HA GLY 7 -17.879 -9.237 -4.051
29 HA3 GLY 7 2HA GLY 7 -16.893 -10.443 -3.235
30 H LYS 8 H LYS 8 -15.196 -9.037 -2.830
31 HA LYS 8 HA LYS 8 -13.446 -8.583 -5.111
32 HB2 LYS 8 1HB LYS 8 -14.488 -6.385 -3.331
33 HB3 LYS 8 2HB LYS 8 -12.995 -6.221 -4.246
34 HG2 LYS 8 1HG LYS 8 -14.102 -6.259 -6.294
35 HG3 LYS 8 2HG LYS 8 -15.562 -6.963 -5.597
36 HD2 LYS 8 1HD LYS 8 -16.161 -4.743 -5.925
37 HD3 LYS 8 2HD LYS 8 -15.680 -4.772 -4.227
38 HE2 LYS 8 1HE LYS 8 -13.522 -3.857 -4.774
39 HE3 LYS 8 2HE LYS 8 -13.867 -3.971 -6.499
40 HZ1 LYS 8 3HZ LYS 8 -14.157 -1.717 -5.670
41 HZ2 LYS 8 1HZ LYS 8 -15.322 -2.250 -4.565
42 HZ3 LYS 8 2HZ LYS 8 -15.625 -2.346 -6.226
43 H LYS 9 H LYS 9 -11.351 -8.893 -4.617
44 HA LYS 9 HA LYS 9 -10.640 -9.958 -2.095
45 HB2 LYS 9 1HB LYS 9 -9.555 -10.072 -4.581
46 HB3 LYS 9 2HB LYS 9 -8.462 -8.932 -3.806
47 HG2 LYS 9 1HG LYS 9 -7.683 -10.489 -2.303
48 HG3 LYS 9 2HG LYS 9 -9.132 -11.490 -2.427
49 HD2 LYS 9 1HD LYS 9 -7.327 -11.128 -4.790
50 HD3 LYS 9 2HD LYS 9 -6.930 -12.302 -3.532
51 HE2 LYS 9 1HE LYS 9 -8.191 -13.699 -4.759
52 HE3 LYS 9 2HE LYS 9 -9.543 -12.878 -3.980
53 HZ1 LYS 9 3HZ LYS 9 -8.520 -12.589 -6.714
54 HZ2 LYS 9 1HZ LYS 9 -9.259 -11.255 -5.982
55 HZ3 LYS 9 2HZ LYS 9 -10.117 -12.700 -6.170
56 HA PRO 10 HA PRO 10 -9.688 -6.335 0.217
57 HB2 PRO 10 1HB PRO 10 -7.942 -7.403 2.000
58 HB3 PRO 10 2HB PRO 10 -9.683 -7.697 2.067
59 HG2 PRO 10 1HG PRO 10 -7.511 -9.428 0.950
60 HG3 PRO 10 2HG PRO 10 -8.907 -9.885 1.944
61 HD2 PRO 10 1HD PRO 10 -8.854 -10.232 -0.741
62 HD3 PRO 10 2HD PRO 10 -10.350 -9.874 0.146
63 H LEU 11 H LEU 11 -7.887 -4.942 0.838
64 HA LEU 11 HA LEU 11 -5.712 -5.102 -1.117
65 HB2 LEU 11 1HB LEU 11 -6.536 -2.799 0.646
66 HB3 LEU 11 2HB LEU 11 -5.347 -2.749 -0.654
67 HG LEU 11 HG LEU 11 -8.326 -3.124 -0.938
68 HD11 LEU 11 1HD1 LEU 11 -6.665 -0.929 -2.112
69 HD12 LEU 11 2HD1 LEU 11 -7.276 -0.819 -0.461
70 HD13 LEU 11 3HD1 LEU 11 -8.402 -0.975 -1.809
71 HD21 LEU 11 3HD2 LEU 11 -7.499 -2.762 -3.444
72 HD22 LEU 11 1HD2 LEU 11 -7.657 -4.362 -2.719
73 HD23 LEU 11 2HD2 LEU 11 -6.075 -3.588 -2.809
74 H VAL 12 H VAL 12 -4.049 -6.252 -0.339
75 HA VAL 12 HA VAL 12 -3.020 -5.527 2.327
76 HB VAL 12 HB VAL 12 -3.788 -7.721 2.629
77 HG11 VAL 12 1HG1 VAL 12 -2.943 -8.083 -0.187
78 HG12 VAL 12 2HG1 VAL 12 -2.859 -9.494 0.869
79 HG13 VAL 12 3HG1 VAL 12 -4.391 -8.648 0.645
80 HG21 VAL 12 3HG2 VAL 12 -1.478 -7.386 3.391
81 HG22 VAL 12 1HG2 VAL 12 -1.776 -9.059 2.915
82 HG23 VAL 12 2HG2 VAL 12 -0.886 -7.981 1.839
83 H CYS 13 H CYS 13 -0.998 -4.791 2.369
84 HA CYS 13 HA CYS 13 0.484 -4.255 0.075
85 HB2 CYS 13 1HB CYS 13 0.763 -3.113 2.272
86 HB3 CYS 13 2HB CYS 13 1.563 -4.558 2.884
87 H ASN 14 H ASN 14 1.395 -5.649 -1.272
88 HA ASN 14 HA ASN 14 1.991 -8.340 -0.559
89 HB2 ASN 14 1HB ASN 14 1.309 -7.673 -2.841
90 HB3 ASN 14 2HB ASN 14 2.822 -6.790 -3.021
91 HD21 ASN 14 1HD2 ASN 14 1.375 -9.952 -2.684
92 HD22 ASN 14 2HD2 ASN 14 2.712 -10.844 -3.320
93 H GLU 15 H GLU 15 3.553 -5.611 0.272
94 HA GLU 15 HA GLU 15 6.262 -6.636 -0.092
95 HB2 GLU 15 1HB GLU 15 5.453 -4.059 1.250
96 HB3 GLU 15 2HB GLU 15 7.031 -4.487 0.604
97 HG2 GLU 15 1HG GLU 15 6.083 -4.494 -1.661
98 HG3 GLU 15 2HG GLU 15 4.526 -4.007 -0.993
99 H CYS 16 H CYS 16 4.041 -5.706 2.510
100 HA CYS 16 HA CYS 16 5.789 -7.123 4.412
101 HB2 CYS 16 1HB CYS 16 4.735 -5.748 6.174
102 HB3 CYS 16 2HB CYS 16 5.551 -4.763 4.964
103 H GLY 17 H GLY 17 2.464 -6.646 3.339
104 HA2 GLY 17 1HA GLY 17 0.944 -8.493 3.215
105 HA3 GLY 17 2HA GLY 17 1.789 -9.232 4.567
106 H LYS 18 H LYS 18 0.587 -5.915 4.258
107 HA LYS 18 HA LYS 18 -1.088 -6.406 6.629
108 HB2 LYS 18 1HB LYS 18 0.862 -4.628 6.534
109 HB3 LYS 18 2HB LYS 18 -0.359 -3.650 5.729
110 HG2 LYS 18 1HG LYS 18 -1.829 -3.866 7.649
111 HG3 LYS 18 2HG LYS 18 -0.649 -4.903 8.453
112 HD2 LYS 18 1HD LYS 18 0.982 -2.966 8.223
113 HD3 LYS 18 2HD LYS 18 -0.414 -1.979 7.786
114 HE2 LYS 18 1HE LYS 18 -1.478 -2.729 9.939
115 HE3 LYS 18 2HE LYS 18 0.074 -3.443 10.372
116 HZ1 LYS 18 3HZ LYS 18 0.883 -1.020 9.766
117 HZ2 LYS 18 1HZ LYS 18 0.324 -1.414 11.314
118 HZ3 LYS 18 2HZ LYS 18 -0.700 -0.633 10.217
119 H THR 19 H THR 19 -3.198 -6.494 6.283
120 HA THR 19 HA THR 19 -4.337 -5.651 3.778
121 HB THR 19 HB THR 19 -6.446 -6.523 4.636
122 HG1 THR 19 1HG THR 19 -6.734 -6.991 6.730
123 HG21 THR 19 3HG2 THR 19 -5.523 -8.420 3.871
124 HG22 THR 19 1HG2 THR 19 -5.246 -8.816 5.566
125 HG23 THR 19 2HG2 THR 19 -3.965 -8.065 4.615
126 H PHE 20 H PHE 20 -6.125 -4.182 3.570
127 HA PHE 20 HA PHE 20 -6.562 -2.297 5.746
128 HB2 PHE 20 1HB PHE 20 -5.604 -1.386 3.024
129 HB3 PHE 20 2HB PHE 20 -6.057 -0.343 4.368
130 HD1 PHE 20 2HD PHE 20 -4.617 -0.130 6.319
131 HD2 PHE 20 1HD PHE 20 -3.494 -2.527 2.986
132 HE1 PHE 20 2HE PHE 20 -2.297 -0.174 7.137
133 HE2 PHE 20 1HE PHE 20 -1.173 -2.576 3.799
134 HZ PHE 20 HZ PHE 20 -0.571 -1.398 5.876
135 H ARG 21 H ARG 21 -8.483 -1.116 5.568
136 HA ARG 21 HA ARG 21 -10.377 -2.228 3.628
137 HB2 ARG 21 1HB ARG 21 -12.114 -1.625 5.119
138 HB3 ARG 21 2HB ARG 21 -10.835 -2.295 6.122
139 HG2 ARG 21 1HG ARG 21 -10.280 -0.240 7.020
140 HG3 ARG 21 2HG ARG 21 -10.998 0.653 5.679
141 HD2 ARG 21 1HD ARG 21 -12.536 0.985 7.375
142 HD3 ARG 21 2HD ARG 21 -13.223 -0.386 6.505
143 HE ARG 21 HE ARG 21 -11.784 -1.621 8.381
144 HH11 ARG 21 2HH1 ARG 21 -13.995 1.060 8.589
145 HH12 ARG 21 1HH1 ARG 21 -14.495 0.691 10.206
146 HH21 ARG 21 2HH2 ARG 21 -12.434 -2.117 10.511
147 HH22 ARG 21 1HH2 ARG 21 -13.606 -1.116 11.299
148 H GLN 22 H GLN 22 -8.347 0.195 3.540
149 HA GLN 22 HA GLN 22 -10.196 1.922 2.060
150 HB2 GLN 22 1HB GLN 22 -8.049 3.078 3.828
151 HB3 GLN 22 2HB GLN 22 -9.380 3.918 3.042
152 HG2 GLN 22 1HG GLN 22 -10.208 3.833 5.144
153 HG3 GLN 22 2HG GLN 22 -10.816 2.288 4.550
154 HE21 GLN 22 1HE2 GLN 22 -10.237 3.122 7.274
155 HE22 GLN 22 2HE2 GLN 22 -9.072 2.002 7.886
156 H SER 23 H SER 23 -9.497 2.055 0.043
157 HA SER 23 HA SER 23 -7.106 1.115 -0.945
158 HB2 SER 23 1HB SER 23 -9.119 1.692 -2.310
159 HB3 SER 23 2HB SER 23 -8.700 3.396 -2.137
160 HG SER 23 HG SER 23 -6.760 2.974 -3.225
161 H SER 24 H SER 24 -7.813 4.217 0.474
162 HA SER 24 HA SER 24 -5.468 5.550 -0.444
163 HB2 SER 24 1HB SER 24 -6.063 7.301 1.107
164 HB3 SER 24 2HB SER 24 -7.545 6.706 0.357
165 HG SER 24 HG SER 24 -7.909 5.463 2.236
166 H CYS 25 H CYS 25 -6.319 3.812 2.517
167 HA CYS 25 HA CYS 25 -4.060 4.372 4.034
168 HB2 CYS 25 1HB CYS 25 -6.220 3.065 4.645
169 HB3 CYS 25 2HB CYS 25 -5.340 1.654 4.069
170 HG CYS 25 HG CYS 25 -5.212 1.703 6.858
171 H LEU 26 H LEU 26 -4.592 1.330 2.246
172 HA LEU 26 HA LEU 26 -2.090 0.261 2.424
173 HB2 LEU 26 1HB LEU 26 -3.825 -1.004 1.426
174 HB3 LEU 26 2HB LEU 26 -4.056 0.192 0.152
175 HG LEU 26 HG LEU 26 -1.704 -0.436 -0.625
176 HD11 LEU 26 1HD1 LEU 26 -2.194 -3.013 0.807
177 HD12 LEU 26 2HD1 LEU 26 -1.337 -1.698 1.611
178 HD13 LEU 26 3HD1 LEU 26 -0.701 -2.380 0.114
179 HD21 LEU 26 3HD2 LEU 26 -3.373 -2.835 -0.960
180 HD22 LEU 26 1HD2 LEU 26 -2.660 -1.766 -2.168
181 HD23 LEU 26 2HD2 LEU 26 -4.157 -1.305 -1.356
182 H SER 27 H SER 27 -3.181 2.152 -0.401
183 HA SER 27 HA SER 27 -0.759 2.403 -1.681
184 HB2 SER 27 1HB SER 27 -2.904 3.138 -2.651
185 HB3 SER 27 2HB SER 27 -2.942 4.498 -1.529
186 HG SER 27 HG SER 27 -2.056 4.824 -3.761
187 H LYS 28 H LYS 28 -2.177 4.839 0.509
188 HA LYS 28 HA LYS 28 0.064 6.500 0.636
189 HB2 LYS 28 1HB LYS 28 -2.179 6.036 2.600
190 HB3 LYS 28 2HB LYS 28 -0.954 7.278 2.824
191 HG2 LYS 28 1HG LYS 28 -1.633 8.197 0.584
192 HG3 LYS 28 2HG LYS 28 -2.998 7.079 0.629
193 HD2 LYS 28 1HD LYS 28 -4.031 8.199 2.353
194 HD3 LYS 28 2HD LYS 28 -2.516 8.865 2.969
195 HE2 LYS 28 1HE LYS 28 -3.396 10.747 2.030
196 HE3 LYS 28 2HE LYS 28 -2.538 10.105 0.631
197 HZ1 LYS 28 3HZ LYS 28 -5.200 10.727 0.761
198 HZ2 LYS 28 1HZ LYS 28 -5.173 9.037 0.837
199 HZ3 LYS 28 2HZ LYS 28 -4.437 9.837 -0.459
200 H HIS 29 H HIS 29 -0.321 3.383 1.828
201 HA HIS 29 HA HIS 29 1.621 3.735 3.986
202 HB2 HIS 29 1HB HIS 29 0.055 2.313 4.847
203 HB3 HIS 29 2HB HIS 29 -0.378 1.662 3.269
204 HD1 HIS 29 1HD HIS 29 1.563 0.919 6.266
205 HD2 HIS 29 2HD HIS 29 1.527 -0.323 2.301
206 HE1 HIS 29 1HE HIS 29 2.881 -1.222 6.220
207 H GLN 30 H GLN 30 1.220 2.121 0.880
208 HA GLN 30 HA GLN 30 3.501 0.548 0.842
209 HB2 GLN 30 1HB GLN 30 2.148 2.023 -1.420
210 HB3 GLN 30 2HB GLN 30 3.401 0.811 -1.649
211 HG2 GLN 30 1HG GLN 30 1.858 -0.737 -0.300
212 HG3 GLN 30 2HG GLN 30 0.609 0.460 -0.637
213 HE21 GLN 30 1HE2 GLN 30 1.691 -2.394 -1.612
214 HE22 GLN 30 2HE2 GLN 30 1.313 -2.331 -3.297
215 H ARG 31 H ARG 31 3.140 3.992 0.280
216 HA ARG 31 HA ARG 31 5.520 4.644 -0.925
217 HB2 ARG 31 1HB ARG 31 5.357 6.807 0.422
218 HB3 ARG 31 2HB ARG 31 3.978 6.390 -0.586
219 HG2 ARG 31 1HG ARG 31 2.653 5.832 1.236
220 HG3 ARG 31 2HG ARG 31 4.043 5.621 2.303
221 HD2 ARG 31 1HD ARG 31 4.390 8.188 1.726
222 HD3 ARG 31 2HD ARG 31 2.650 8.102 1.450
223 HE ARG 31 HE ARG 31 3.517 6.973 3.957
224 HH11 ARG 31 2HH1 ARG 31 2.471 9.846 2.293
225 HH12 ARG 31 1HH1 ARG 31 1.928 10.640 3.734
226 HH21 ARG 31 2HH2 ARG 31 2.806 8.007 5.861
227 HH22 ARG 31 1HH2 ARG 31 2.119 9.594 5.763
228 H ILE 32 H ILE 32 5.007 3.437 2.263
229 HA ILE 32 HA ILE 32 7.388 4.366 3.480
230 HB ILE 32 HB ILE 32 6.933 2.916 5.256
231 HG12 ILE 32 1HG1 ILE 32 5.227 1.231 3.411
232 HG13 ILE 32 2HG1 ILE 32 6.883 0.846 3.864
233 HG21 ILE 32 1HG2 ILE 32 5.126 4.157 5.652
234 HG22 ILE 32 2HG2 ILE 32 4.686 4.190 3.945
235 HG23 ILE 32 3HG2 ILE 32 4.181 2.839 4.960
236 HD11 ILE 32 3HD1 ILE 32 6.295 0.391 6.071
237 HD12 ILE 32 1HD1 ILE 32 4.749 1.227 5.928
238 HD13 ILE 32 2HD1 ILE 32 4.994 -0.320 5.115
239 H HIS 33 H HIS 33 6.622 1.558 1.516
240 HA HIS 33 HA HIS 33 9.270 0.420 1.908
241 HB2 HIS 33 1HB HIS 33 7.049 -0.537 0.093
242 HB3 HIS 33 2HB HIS 33 8.479 -1.443 0.579
243 HD1 HIS 33 1HD HIS 33 8.599 -1.764 3.349
244 HD2 HIS 33 2HD HIS 33 4.887 -1.121 1.598
245 HE1 HIS 33 1HE HIS 33 6.914 -2.573 5.030
246 H SER 34 H SER 34 7.333 1.810 -0.719
247 HA SER 34 HA SER 34 9.718 2.777 -2.017
248 HB2 SER 34 1HB SER 34 8.020 0.633 -3.306
249 HB3 SER 34 2HB SER 34 9.139 1.657 -4.206
250 HG SER 34 HG SER 34 9.722 -0.237 -2.189
251 H GLY 35 H GLY 35 9.020 4.836 -2.112
252 HA2 GLY 35 1HA GLY 35 6.323 5.582 -2.620
253 HA3 GLY 35 2HA GLY 35 7.712 6.659 -2.617
254 H GLU 36 H GLU 36 7.247 7.818 -4.433
255 HA GLU 36 HA GLU 36 6.514 6.507 -6.895
256 HB2 GLU 36 1HB GLU 36 6.978 9.355 -6.074
257 HB3 GLU 36 2HB GLU 36 6.864 8.932 -7.776
258 HG2 GLU 36 1HG GLU 36 4.755 8.354 -5.709
259 HG3 GLU 36 2HG GLU 36 4.734 9.713 -6.832
260 H LYS 37 H LYS 37 7.744 6.344 -8.760
261 HA LYS 37 HA LYS 37 10.645 6.657 -8.362
262 HB2 LYS 37 1HB LYS 37 9.007 4.646 -9.863
263 HB3 LYS 37 2HB LYS 37 10.659 4.973 -10.369
264 HG2 LYS 37 1HG LYS 37 9.954 4.219 -7.549
265 HG3 LYS 37 2HG LYS 37 10.318 3.025 -8.797
266 HD2 LYS 37 1HD LYS 37 12.196 5.292 -8.216
267 HD3 LYS 37 2HD LYS 37 12.228 3.810 -7.258
268 HE2 LYS 37 1HE LYS 37 13.790 3.342 -8.886
269 HE3 LYS 37 2HE LYS 37 12.331 2.640 -9.584
270 HZ1 LYS 37 3HZ LYS 37 12.529 3.976 -11.321
271 HZ2 LYS 37 1HZ LYS 37 13.984 4.573 -10.697
272 HZ3 LYS 37 2HZ LYS 37 12.527 5.350 -10.333
273 HA PRO 38 HA PRO 38 10.529 9.776 -11.499
274 HB2 PRO 38 1HB PRO 38 13.205 9.935 -11.924
275 HB3 PRO 38 2HB PRO 38 12.416 10.621 -10.499
276 HG2 PRO 38 1HG PRO 38 13.888 8.030 -10.787
277 HG3 PRO 38 2HG PRO 38 13.961 9.218 -9.472
278 HD2 PRO 38 1HD PRO 38 12.508 6.940 -9.298
279 HD3 PRO 38 2HD PRO 38 12.018 8.448 -8.500
280 H SER 39 H SER 39 9.505 8.561 -13.151
281 HA SER 39 HA SER 39 11.069 6.769 -14.793
282 HB2 SER 39 1HB SER 39 8.213 7.699 -14.800
283 HB3 SER 39 2HB SER 39 8.878 6.871 -16.208
284 HG SER 39 HG SER 39 8.310 5.896 -13.670
285 H GLY 40 H GLY 40 11.184 7.059 -17.162
286 HA2 GLY 40 1HA GLY 40 10.718 9.268 -18.657
287 HA3 GLY 40 2HA GLY 40 12.168 9.706 -17.766
288 HA PRO 41 HA PRO 41 13.001 6.981 -21.618
289 HB2 PRO 41 1HB PRO 41 13.601 8.913 -23.428
290 HB3 PRO 41 2HB PRO 41 11.971 8.260 -23.225
291 HG2 PRO 41 1HG PRO 41 13.143 10.794 -22.146
292 HG3 PRO 41 2HG PRO 41 11.549 10.519 -22.871
293 HD2 PRO 41 1HD PRO 41 11.925 10.670 -20.194
294 HD3 PRO 41 2HD PRO 41 10.676 9.643 -20.927
295 H SER 42 H SER 42 14.996 6.210 -21.395
296 HA SER 42 HA SER 42 17.152 7.974 -20.540
297 HB2 SER 42 1HB SER 42 16.579 5.573 -19.619
298 HB3 SER 42 2HB SER 42 17.530 5.040 -21.004
299 HG SER 42 HG SER 42 18.382 6.006 -18.658
300 H SER 43 H SER 43 16.483 5.646 -23.141
301 HA SER 43 HA SER 43 18.068 7.216 -24.982
302 HB2 SER 43 1HB SER 43 19.793 5.808 -23.965
303 HB3 SER 43 2HB SER 43 18.847 4.364 -24.324
304 HG SER 43 HG SER 43 19.298 4.568 -26.431
305 H GLY 44 H GLY 44 17.941 6.344 -27.218
306 HA2 GLY 44 1HA GLY 44 16.024 4.307 -27.826
307 HA3 GLY 44 2HA GLY 44 15.360 5.917 -28.055
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -16.239 -1.586 -13.674
2 HA2 GLY 1 1HA GLY 1 -14.265 -2.369 -12.480
3 HA3 GLY 1 2HA GLY 1 -14.986 -3.734 -13.319
4 H SER 2 H SER 2 -12.502 -1.233 -13.573
5 HA SER 2 HA SER 2 -11.231 -2.404 -15.846
6 HB2 SER 2 1HB SER 2 -9.505 -0.754 -15.517
7 HB3 SER 2 2HB SER 2 -11.059 0.018 -15.204
8 HG SER 2 HG SER 2 -9.431 -1.084 -13.163
9 H SER 3 H SER 3 -9.164 -3.420 -15.908
10 HA SER 3 HA SER 3 -8.833 -5.435 -13.943
11 HB2 SER 3 1HB SER 3 -8.186 -5.483 -16.447
12 HB3 SER 3 2HB SER 3 -6.705 -4.675 -15.934
13 HG SER 3 HG SER 3 -6.968 -7.174 -15.988
14 H GLY 4 H GLY 4 -7.057 -5.798 -12.534
15 HA2 GLY 4 1HA GLY 4 -4.888 -4.875 -11.709
16 HA3 GLY 4 2HA GLY 4 -5.681 -3.307 -11.732
17 H SER 5 H SER 5 -8.094 -3.810 -10.589
18 HA SER 5 HA SER 5 -7.317 -4.610 -7.866
19 HB2 SER 5 1HB SER 5 -9.555 -2.775 -8.758
20 HB3 SER 5 2HB SER 5 -9.147 -3.160 -7.086
21 HG SER 5 HG SER 5 -7.216 -2.081 -8.831
22 H SER 6 H SER 6 -8.444 -6.137 -6.776
23 HA SER 6 HA SER 6 -10.184 -7.845 -8.302
24 HB2 SER 6 1HB SER 6 -9.006 -7.940 -5.542
25 HB3 SER 6 2HB SER 6 -10.312 -9.041 -5.981
26 HG SER 6 HG SER 6 -8.196 -9.900 -6.372
27 H GLY 7 H GLY 7 -10.554 -6.030 -5.249
28 HA2 GLY 7 1HA GLY 7 -12.443 -4.716 -4.698
29 HA3 GLY 7 2HA GLY 7 -13.359 -5.553 -5.943
30 H LYS 8 H LYS 8 -13.123 -8.154 -5.346
31 HA LYS 8 HA LYS 8 -14.881 -8.463 -3.149
32 HB2 LYS 8 1HB LYS 8 -13.400 -10.364 -4.937
33 HB3 LYS 8 2HB LYS 8 -14.264 -10.968 -3.529
34 HG2 LYS 8 1HG LYS 8 -16.324 -9.893 -4.397
35 HG3 LYS 8 2HG LYS 8 -15.430 -9.453 -5.855
36 HD2 LYS 8 1HD LYS 8 -15.118 -11.726 -6.456
37 HD3 LYS 8 2HD LYS 8 -15.661 -12.291 -4.875
38 HE2 LYS 8 1HE LYS 8 -17.568 -12.651 -6.069
39 HE3 LYS 8 2HE LYS 8 -17.855 -10.984 -5.573
40 HZ1 LYS 8 3HZ LYS 8 -16.732 -11.847 -8.183
41 HZ2 LYS 8 1HZ LYS 8 -16.985 -10.243 -7.707
42 HZ3 LYS 8 2HZ LYS 8 -18.304 -11.281 -7.920
43 H LYS 9 H LYS 9 -11.484 -9.438 -3.601
44 HA LYS 9 HA LYS 9 -11.202 -10.250 -0.863
45 HB2 LYS 9 1HB LYS 9 -9.417 -10.080 -3.245
46 HB3 LYS 9 2HB LYS 9 -8.666 -10.139 -1.655
47 HG2 LYS 9 1HG LYS 9 -9.600 -12.254 -1.185
48 HG3 LYS 9 2HG LYS 9 -10.702 -12.154 -2.561
49 HD2 LYS 9 1HD LYS 9 -8.964 -13.619 -3.217
50 HD3 LYS 9 2HD LYS 9 -8.645 -12.087 -4.034
51 HE2 LYS 9 1HE LYS 9 -6.958 -11.516 -2.424
52 HE3 LYS 9 2HE LYS 9 -7.363 -12.919 -1.436
53 HZ1 LYS 9 3HZ LYS 9 -5.413 -13.414 -2.684
54 HZ2 LYS 9 1HZ LYS 9 -6.135 -12.932 -4.137
55 HZ3 LYS 9 2HZ LYS 9 -6.679 -14.323 -3.343
56 HA PRO 10 HA PRO 10 -9.976 -6.488 1.036
57 HB2 PRO 10 1HB PRO 10 -8.053 -7.328 2.759
58 HB3 PRO 10 2HB PRO 10 -9.772 -7.666 2.998
59 HG2 PRO 10 1HG PRO 10 -7.633 -9.430 1.869
60 HG3 PRO 10 2HG PRO 10 -8.926 -9.832 3.014
61 HD2 PRO 10 1HD PRO 10 -9.076 -10.432 0.378
62 HD3 PRO 10 2HD PRO 10 -10.508 -10.037 1.350
63 H LEU 11 H LEU 11 -8.223 -4.964 1.321
64 HA LEU 11 HA LEU 11 -6.199 -5.250 -0.770
65 HB2 LEU 11 1HB LEU 11 -7.029 -2.836 0.833
66 HB3 LEU 11 2HB LEU 11 -5.865 -2.838 -0.490
67 HG LEU 11 HG LEU 11 -8.793 -3.515 -0.767
68 HD11 LEU 11 1HD1 LEU 11 -7.739 -1.098 -2.042
69 HD12 LEU 11 2HD1 LEU 11 -7.783 -1.037 -0.281
70 HD13 LEU 11 3HD1 LEU 11 -9.259 -1.365 -1.189
71 HD21 LEU 11 3HD2 LEU 11 -8.370 -3.383 -3.151
72 HD22 LEU 11 1HD2 LEU 11 -7.323 -4.596 -2.415
73 HD23 LEU 11 2HD2 LEU 11 -6.670 -3.017 -2.852
74 H VAL 12 H VAL 12 -4.482 -6.340 0.009
75 HA VAL 12 HA VAL 12 -3.266 -5.346 2.505
76 HB VAL 12 HB VAL 12 -3.786 -7.526 3.062
77 HG11 VAL 12 1HG1 VAL 12 -3.226 -9.408 1.312
78 HG12 VAL 12 2HG1 VAL 12 -4.741 -8.507 1.224
79 HG13 VAL 12 3HG1 VAL 12 -3.397 -8.082 0.163
80 HG21 VAL 12 3HG2 VAL 12 -1.122 -7.976 1.737
81 HG22 VAL 12 1HG2 VAL 12 -1.316 -7.020 3.206
82 HG23 VAL 12 2HG2 VAL 12 -1.750 -8.730 3.203
83 H CYS 13 H CYS 13 -1.013 -5.128 2.581
84 HA CYS 13 HA CYS 13 0.196 -4.432 0.073
85 HB2 CYS 13 1HB CYS 13 0.640 -3.090 2.060
86 HB3 CYS 13 2HB CYS 13 1.331 -4.489 2.876
87 H ASN 14 H ASN 14 1.194 -5.800 -1.235
88 HA ASN 14 HA ASN 14 1.818 -8.472 -0.463
89 HB2 ASN 14 1HB ASN 14 1.131 -7.676 -2.782
90 HB3 ASN 14 2HB ASN 14 2.778 -7.076 -2.961
91 HD21 ASN 14 1HD2 ASN 14 1.218 -10.034 -1.762
92 HD22 ASN 14 2HD2 ASN 14 2.225 -11.124 -2.647
93 H GLU 15 H GLU 15 3.463 -5.543 -0.146
94 HA GLU 15 HA GLU 15 6.138 -6.540 -0.407
95 HB2 GLU 15 1HB GLU 15 5.357 -4.063 1.112
96 HB3 GLU 15 2HB GLU 15 6.854 -4.391 0.251
97 HG2 GLU 15 1HG GLU 15 4.337 -4.348 -1.315
98 HG3 GLU 15 2HG GLU 15 4.981 -2.813 -0.734
99 H CYS 16 H CYS 16 4.004 -5.760 2.320
100 HA CYS 16 HA CYS 16 5.826 -7.281 4.069
101 HB2 CYS 16 1HB CYS 16 5.070 -5.898 5.931
102 HB3 CYS 16 2HB CYS 16 5.722 -4.885 4.648
103 H GLY 17 H GLY 17 2.471 -6.571 3.247
104 HA2 GLY 17 1HA GLY 17 0.875 -8.382 3.166
105 HA3 GLY 17 2HA GLY 17 1.720 -9.123 4.517
106 H LYS 18 H LYS 18 0.828 -5.726 4.276
107 HA LYS 18 HA LYS 18 -0.752 -6.033 6.720
108 HB2 LYS 18 1HB LYS 18 1.126 -4.260 6.316
109 HB3 LYS 18 2HB LYS 18 -0.128 -3.394 5.439
110 HG2 LYS 18 1HG LYS 18 -1.488 -3.237 7.391
111 HG3 LYS 18 2HG LYS 18 -0.417 -4.317 8.288
112 HD2 LYS 18 1HD LYS 18 0.764 -1.854 7.120
113 HD3 LYS 18 2HD LYS 18 -0.285 -1.674 8.528
114 HE2 LYS 18 1HE LYS 18 2.004 -3.623 8.445
115 HE3 LYS 18 2HE LYS 18 2.197 -1.955 8.982
116 HZ1 LYS 18 3HZ LYS 18 0.474 -2.384 10.666
117 HZ2 LYS 18 1HZ LYS 18 1.835 -3.368 10.868
118 HZ3 LYS 18 2HZ LYS 18 0.423 -4.006 10.191
119 H THR 19 H THR 19 -2.884 -6.170 6.605
120 HA THR 19 HA THR 19 -4.281 -5.640 4.146
121 HB THR 19 HB THR 19 -6.307 -6.337 5.411
122 HG1 THR 19 1HG THR 19 -6.007 -5.872 7.499
123 HG21 THR 19 3HG2 THR 19 -5.563 -8.264 4.522
124 HG22 THR 19 1HG2 THR 19 -5.041 -8.641 6.164
125 HG23 THR 19 2HG2 THR 19 -3.896 -7.956 5.010
126 H PHE 20 H PHE 20 -6.193 -4.268 4.018
127 HA PHE 20 HA PHE 20 -6.450 -2.140 5.968
128 HB2 PHE 20 1HB PHE 20 -5.679 -1.532 3.106
129 HB3 PHE 20 2HB PHE 20 -6.107 -0.341 4.329
130 HD1 PHE 20 2HD PHE 20 -4.606 0.064 6.240
131 HD2 PHE 20 1HD PHE 20 -3.519 -2.516 3.034
132 HE1 PHE 20 2HE PHE 20 -2.251 0.189 6.942
133 HE2 PHE 20 1HE PHE 20 -1.162 -2.397 3.732
134 HZ PHE 20 HZ PHE 20 -0.526 -1.042 5.688
135 H ARG 21 H ARG 21 -8.335 -0.815 5.623
136 HA ARG 21 HA ARG 21 -10.452 -2.304 4.290
137 HB2 ARG 21 1HB ARG 21 -11.974 -0.776 5.472
138 HB3 ARG 21 2HB ARG 21 -10.851 -1.560 6.575
139 HG2 ARG 21 1HG ARG 21 -9.444 0.623 6.180
140 HG3 ARG 21 2HG ARG 21 -11.020 1.288 5.743
141 HD2 ARG 21 1HD ARG 21 -11.922 0.785 7.877
142 HD3 ARG 21 2HD ARG 21 -10.533 -0.215 8.303
143 HE ARG 21 HE ARG 21 -9.343 1.692 8.826
144 HH11 ARG 21 2HH1 ARG 21 -12.352 2.533 7.291
145 HH12 ARG 21 1HH1 ARG 21 -12.232 4.217 7.683
146 HH21 ARG 21 2HH2 ARG 21 -9.173 3.906 9.349
147 HH22 ARG 21 1HH2 ARG 21 -10.423 4.997 8.852
148 H GLN 22 H GLN 22 -9.194 1.026 4.342
149 HA GLN 22 HA GLN 22 -10.746 1.712 1.991
150 HB2 GLN 22 1HB GLN 22 -8.766 3.313 3.618
151 HB3 GLN 22 2HB GLN 22 -9.691 3.949 2.265
152 HG2 GLN 22 1HG GLN 22 -11.748 3.145 3.618
153 HG3 GLN 22 2HG GLN 22 -10.628 3.139 4.979
154 HE21 GLN 22 1HE2 GLN 22 -12.467 5.053 2.801
155 HE22 GLN 22 2HE2 GLN 22 -12.111 6.591 3.503
156 H SER 23 H SER 23 -9.850 2.413 0.011
157 HA SER 23 HA SER 23 -7.686 0.850 -0.915
158 HB2 SER 23 1HB SER 23 -9.691 1.903 -2.219
159 HB3 SER 23 2HB SER 23 -8.628 3.301 -2.371
160 HG SER 23 HG SER 23 -7.412 0.916 -2.963
161 H SER 24 H SER 24 -7.949 4.179 0.169
162 HA SER 24 HA SER 24 -5.366 4.994 -0.699
163 HB2 SER 24 1HB SER 24 -7.231 6.135 1.392
164 HB3 SER 24 2HB SER 24 -5.731 6.911 0.883
165 HG SER 24 HG SER 24 -7.415 6.166 -1.170
166 H CYS 25 H CYS 25 -6.572 3.334 2.099
167 HA CYS 25 HA CYS 25 -4.490 3.830 3.906
168 HB2 CYS 25 1HB CYS 25 -6.534 1.677 3.585
169 HB3 CYS 25 2HB CYS 25 -5.205 1.406 4.707
170 HG CYS 25 HG CYS 25 -6.707 4.371 5.091
171 H LEU 26 H LEU 26 -4.918 1.141 1.612
172 HA LEU 26 HA LEU 26 -2.433 -0.086 2.193
173 HB2 LEU 26 1HB LEU 26 -4.066 -1.446 1.201
174 HB3 LEU 26 2HB LEU 26 -4.368 -0.286 -0.091
175 HG LEU 26 HG LEU 26 -2.037 -0.820 -0.931
176 HD11 LEU 26 1HD1 LEU 26 -1.383 -3.222 -0.207
177 HD12 LEU 26 2HD1 LEU 26 -2.313 -2.851 1.244
178 HD13 LEU 26 3HD1 LEU 26 -0.924 -1.855 0.809
179 HD21 LEU 26 3HD2 LEU 26 -2.784 -2.707 -2.167
180 HD22 LEU 26 1HD2 LEU 26 -4.196 -1.692 -1.873
181 HD23 LEU 26 2HD2 LEU 26 -3.943 -3.151 -0.914
182 H SER 27 H SER 27 -3.450 1.759 -0.690
183 HA SER 27 HA SER 27 -0.982 1.930 -1.927
184 HB2 SER 27 1HB SER 27 -1.920 4.107 -2.916
185 HB3 SER 27 2HB SER 27 -2.856 2.636 -3.181
186 HG SER 27 HG SER 27 -3.378 4.794 -1.454
187 H LYS 28 H LYS 28 -2.467 4.395 0.181
188 HA LYS 28 HA LYS 28 -0.272 6.113 0.293
189 HB2 LYS 28 1HB LYS 28 -2.646 6.554 1.084
190 HB3 LYS 28 2HB LYS 28 -2.225 5.680 2.552
191 HG2 LYS 28 1HG LYS 28 -0.331 7.327 2.837
192 HG3 LYS 28 2HG LYS 28 -1.079 8.267 1.544
193 HD2 LYS 28 1HD LYS 28 -2.062 9.252 3.358
194 HD3 LYS 28 2HD LYS 28 -3.230 7.965 3.051
195 HE2 LYS 28 1HE LYS 28 -2.509 6.705 4.850
196 HE3 LYS 28 2HE LYS 28 -0.920 7.468 4.880
197 HZ1 LYS 28 3HZ LYS 28 -2.819 8.055 6.614
198 HZ2 LYS 28 1HZ LYS 28 -3.211 9.186 5.418
199 HZ3 LYS 28 2HZ LYS 28 -1.669 9.190 6.112
200 H HIS 29 H HIS 29 -0.579 3.003 1.533
201 HA HIS 29 HA HIS 29 1.362 3.437 3.678
202 HB2 HIS 29 1HB HIS 29 -0.208 2.007 4.547
203 HB3 HIS 29 2HB HIS 29 -0.564 1.275 2.985
204 HD1 HIS 29 1HD HIS 29 1.185 0.649 6.085
205 HD2 HIS 29 2HD HIS 29 1.584 -0.571 2.134
206 HE1 HIS 29 1HE HIS 29 2.627 -1.409 6.160
207 H GLN 30 H GLN 30 0.991 1.785 0.592
208 HA GLN 30 HA GLN 30 3.291 0.244 0.563
209 HB2 GLN 30 1HB GLN 30 1.870 1.680 -1.677
210 HB3 GLN 30 2HB GLN 30 3.206 0.569 -1.949
211 HG2 GLN 30 1HG GLN 30 0.908 -0.381 -0.330
212 HG3 GLN 30 2HG GLN 30 0.692 -0.212 -2.071
213 HE21 GLN 30 1HE2 GLN 30 0.484 -2.657 -0.881
214 HE22 GLN 30 2HE2 GLN 30 1.822 -3.649 -1.339
215 H ARG 31 H ARG 31 2.892 3.682 -0.019
216 HA ARG 31 HA ARG 31 5.285 4.344 -1.204
217 HB2 ARG 31 1HB ARG 31 5.068 6.536 0.040
218 HB3 ARG 31 2HB ARG 31 3.663 6.050 -0.899
219 HG2 ARG 31 1HG ARG 31 2.372 5.709 0.941
220 HG3 ARG 31 2HG ARG 31 3.745 5.265 1.958
221 HD2 ARG 31 1HD ARG 31 3.038 8.043 1.021
222 HD3 ARG 31 2HD ARG 31 2.816 7.404 2.649
223 HE ARG 31 HE ARG 31 5.516 7.149 1.925
224 HH11 ARG 31 2HH1 ARG 31 3.169 9.599 2.704
225 HH12 ARG 31 1HH1 ARG 31 4.343 10.708 3.332
226 HH21 ARG 31 2HH2 ARG 31 7.071 8.600 2.748
227 HH22 ARG 31 1HH2 ARG 31 6.562 10.140 3.355
228 H ILE 32 H ILE 32 4.737 3.153 1.976
229 HA ILE 32 HA ILE 32 7.063 4.150 3.244
230 HB ILE 32 HB ILE 32 6.620 2.667 5.006
231 HG12 ILE 32 1HG1 ILE 32 5.050 0.978 3.046
232 HG13 ILE 32 2HG1 ILE 32 6.631 0.586 3.712
233 HG21 ILE 32 1HG2 ILE 32 3.884 2.561 4.711
234 HG22 ILE 32 2HG2 ILE 32 4.806 3.913 5.367
235 HG23 ILE 32 3HG2 ILE 32 4.355 3.899 3.662
236 HD11 ILE 32 3HD1 ILE 32 5.498 0.678 5.992
237 HD12 ILE 32 1HD1 ILE 32 3.979 0.637 5.098
238 HD13 ILE 32 2HD1 ILE 32 5.128 -0.693 4.947
239 H HIS 33 H HIS 33 6.432 1.346 1.236
240 HA HIS 33 HA HIS 33 9.107 0.286 1.694
241 HB2 HIS 33 1HB HIS 33 6.930 -0.755 -0.129
242 HB3 HIS 33 2HB HIS 33 8.398 -1.605 0.344
243 HD1 HIS 33 1HD HIS 33 8.538 -1.815 3.162
244 HD2 HIS 33 2HD HIS 33 4.815 -1.547 1.337
245 HE1 HIS 33 1HE HIS 33 6.900 -2.728 4.838
246 H SER 34 H SER 34 7.166 1.626 -0.951
247 HA SER 34 HA SER 34 9.127 1.389 -2.958
248 HB2 SER 34 1HB SER 34 6.677 1.833 -3.330
249 HB3 SER 34 2HB SER 34 6.961 3.495 -2.812
250 HG SER 34 HG SER 34 7.063 2.962 -5.170
251 H GLY 35 H GLY 35 10.113 3.326 -4.082
252 HA2 GLY 35 1HA GLY 35 12.106 4.488 -2.712
253 HA3 GLY 35 2HA GLY 35 11.319 5.310 -4.052
254 H GLU 36 H GLU 36 12.532 6.533 -1.753
255 HA GLU 36 HA GLU 36 10.388 7.411 -0.030
256 HB2 GLU 36 1HB GLU 36 13.285 8.228 -0.265
257 HB3 GLU 36 2HB GLU 36 12.172 8.940 0.894
258 HG2 GLU 36 1HG GLU 36 11.762 6.478 1.612
259 HG3 GLU 36 2HG GLU 36 13.300 6.181 0.805
260 H LYS 37 H LYS 37 10.540 7.978 -3.040
261 HA LYS 37 HA LYS 37 10.904 10.730 -3.447
262 HB2 LYS 37 1HB LYS 37 10.718 8.959 -5.227
263 HB3 LYS 37 2HB LYS 37 8.982 8.945 -4.947
264 HG2 LYS 37 1HG LYS 37 8.905 11.341 -5.547
265 HG3 LYS 37 2HG LYS 37 10.628 11.269 -5.925
266 HD2 LYS 37 1HD LYS 37 8.834 9.276 -7.207
267 HD3 LYS 37 2HD LYS 37 8.767 10.942 -7.786
268 HE2 LYS 37 1HE LYS 37 10.417 10.154 -9.143
269 HE3 LYS 37 2HE LYS 37 11.402 10.655 -7.770
270 HZ1 LYS 37 3HZ LYS 37 11.143 8.298 -6.954
271 HZ2 LYS 37 1HZ LYS 37 12.111 8.504 -8.327
272 HZ3 LYS 37 2HZ LYS 37 10.532 7.917 -8.485
273 HA PRO 38 HA PRO 38 7.391 12.490 -1.446
274 HB2 PRO 38 1HB PRO 38 7.347 14.874 -2.744
275 HB3 PRO 38 2HB PRO 38 8.547 14.475 -1.509
276 HG2 PRO 38 1HG PRO 38 8.796 14.387 -4.490
277 HG3 PRO 38 2HG PRO 38 9.952 14.989 -3.288
278 HD2 PRO 38 1HD PRO 38 10.188 12.550 -4.441
279 HD3 PRO 38 2HD PRO 38 10.715 12.875 -2.778
280 H SER 39 H SER 39 5.324 13.689 -2.081
281 HA SER 39 HA SER 39 4.333 13.060 -4.741
282 HB2 SER 39 1HB SER 39 2.914 11.998 -2.288
283 HB3 SER 39 2HB SER 39 2.439 11.766 -3.970
284 HG SER 39 HG SER 39 3.598 10.020 -3.809
285 H GLY 40 H GLY 40 2.115 13.944 -5.084
286 HA2 GLY 40 1HA GLY 40 1.995 16.631 -4.187
287 HA3 GLY 40 2HA GLY 40 0.761 15.800 -5.122
288 HA PRO 41 HA PRO 41 -1.254 16.692 -1.130
289 HB2 PRO 41 1HB PRO 41 -3.744 16.878 -2.196
290 HB3 PRO 41 2HB PRO 41 -2.597 18.223 -2.196
291 HG2 PRO 41 1HG PRO 41 -3.265 16.303 -4.393
292 HG3 PRO 41 2HG PRO 41 -3.028 18.058 -4.475
293 HD2 PRO 41 1HD PRO 41 -1.109 16.294 -5.207
294 HD3 PRO 41 2HD PRO 41 -0.731 17.874 -4.492
295 H SER 42 H SER 42 -1.078 14.078 -3.122
296 HA SER 42 HA SER 42 -3.128 12.397 -2.867
297 HB2 SER 42 1HB SER 42 -0.913 11.747 -3.763
298 HB3 SER 42 2HB SER 42 -0.296 11.630 -2.115
299 HG SER 42 HG SER 42 -2.109 9.974 -3.466
300 H SER 43 H SER 43 -0.921 13.197 -0.213
301 HA SER 43 HA SER 43 -2.379 11.561 1.667
302 HB2 SER 43 1HB SER 43 0.095 11.902 1.809
303 HB3 SER 43 2HB SER 43 -0.204 13.591 2.221
304 HG SER 43 HG SER 43 -0.516 12.967 4.190
305 H GLY 44 H GLY 44 -1.713 15.055 1.365
306 HA2 GLY 44 1HA GLY 44 -3.097 16.852 1.814
307 HA3 GLY 44 2HA GLY 44 -4.401 15.718 2.131
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -20.306 -5.592 -16.991
2 HA2 GLY 1 1HA GLY 1 -19.504 -3.486 -17.687
3 HA3 GLY 1 2HA GLY 1 -20.488 -2.726 -16.446
4 H SER 2 H SER 2 -19.683 -4.146 -14.204
5 HA SER 2 HA SER 2 -16.879 -3.275 -13.975
6 HB2 SER 2 1HB SER 2 -19.021 -3.493 -11.846
7 HB3 SER 2 2HB SER 2 -17.346 -3.030 -11.546
8 HG SER 2 HG SER 2 -17.956 -1.087 -12.020
9 H SER 3 H SER 3 -15.551 -4.484 -12.396
10 HA SER 3 HA SER 3 -16.324 -7.318 -12.210
11 HB2 SER 3 1HB SER 3 -14.722 -6.981 -14.080
12 HB3 SER 3 2HB SER 3 -13.564 -6.304 -12.935
13 HG SER 3 HG SER 3 -14.633 -8.934 -12.898
14 H GLY 4 H GLY 4 -16.213 -8.088 -10.208
15 HA2 GLY 4 1HA GLY 4 -15.821 -8.163 -7.943
16 HA3 GLY 4 2HA GLY 4 -14.156 -7.837 -8.400
17 H SER 5 H SER 5 -17.071 -5.809 -8.582
18 HA SER 5 HA SER 5 -15.639 -3.553 -7.539
19 HB2 SER 5 1HB SER 5 -17.336 -3.147 -9.202
20 HB3 SER 5 2HB SER 5 -18.558 -3.959 -8.223
21 HG SER 5 HG SER 5 -18.024 -1.424 -8.217
22 H SER 6 H SER 6 -18.267 -5.627 -6.357
23 HA SER 6 HA SER 6 -18.843 -4.400 -3.967
24 HB2 SER 6 1HB SER 6 -19.899 -6.500 -5.006
25 HB3 SER 6 2HB SER 6 -18.624 -7.400 -4.185
26 HG SER 6 HG SER 6 -20.829 -6.072 -3.137
27 H GLY 7 H GLY 7 -16.317 -6.840 -4.559
28 HA2 GLY 7 1HA GLY 7 -14.192 -6.005 -3.294
29 HA3 GLY 7 2HA GLY 7 -15.215 -6.296 -1.894
30 H LYS 8 H LYS 8 -13.910 -7.896 -4.783
31 HA LYS 8 HA LYS 8 -14.417 -10.530 -3.850
32 HB2 LYS 8 1HB LYS 8 -13.959 -9.707 -6.258
33 HB3 LYS 8 2HB LYS 8 -12.259 -9.828 -5.823
34 HG2 LYS 8 1HG LYS 8 -12.314 -12.120 -5.686
35 HG3 LYS 8 2HG LYS 8 -14.049 -12.166 -5.361
36 HD2 LYS 8 1HD LYS 8 -14.442 -11.411 -7.701
37 HD3 LYS 8 2HD LYS 8 -12.707 -11.552 -7.993
38 HE2 LYS 8 1HE LYS 8 -13.683 -13.556 -8.786
39 HE3 LYS 8 2HE LYS 8 -12.900 -13.957 -7.259
40 HZ1 LYS 8 3HZ LYS 8 -15.201 -14.873 -7.601
41 HZ2 LYS 8 1HZ LYS 8 -15.779 -13.291 -7.443
42 HZ3 LYS 8 2HZ LYS 8 -14.960 -14.025 -6.158
43 H LYS 9 H LYS 9 -11.351 -8.731 -4.174
44 HA LYS 9 HA LYS 9 -10.276 -10.374 -1.975
45 HB2 LYS 9 1HB LYS 9 -8.928 -11.027 -3.723
46 HB3 LYS 9 2HB LYS 9 -9.071 -9.483 -4.553
47 HG2 LYS 9 1HG LYS 9 -7.624 -8.490 -2.766
48 HG3 LYS 9 2HG LYS 9 -7.356 -10.129 -2.169
49 HD2 LYS 9 1HD LYS 9 -5.538 -9.854 -3.555
50 HD3 LYS 9 2HD LYS 9 -6.694 -10.608 -4.655
51 HE2 LYS 9 1HE LYS 9 -7.363 -8.213 -5.279
52 HE3 LYS 9 2HE LYS 9 -5.872 -7.725 -4.476
53 HZ1 LYS 9 3HZ LYS 9 -5.311 -7.977 -6.715
54 HZ2 LYS 9 1HZ LYS 9 -6.185 -9.416 -6.881
55 HZ3 LYS 9 2HZ LYS 9 -4.749 -9.398 -5.989
56 HA PRO 10 HA PRO 10 -9.788 -6.606 0.263
57 HB2 PRO 10 1HB PRO 10 -7.973 -7.463 2.091
58 HB3 PRO 10 2HB PRO 10 -9.679 -7.921 2.144
59 HG2 PRO 10 1HG PRO 10 -7.336 -9.459 1.092
60 HG3 PRO 10 2HG PRO 10 -8.695 -10.027 2.080
61 HD2 PRO 10 1HD PRO 10 -8.573 -10.425 -0.596
62 HD3 PRO 10 2HD PRO 10 -10.108 -10.193 0.265
63 H LEU 11 H LEU 11 -8.059 -5.103 0.989
64 HA LEU 11 HA LEU 11 -5.931 -5.006 -1.018
65 HB2 LEU 11 1HB LEU 11 -6.664 -2.828 0.915
66 HB3 LEU 11 2HB LEU 11 -5.785 -2.688 -0.606
67 HG LEU 11 HG LEU 11 -7.873 -3.226 -1.819
68 HD11 LEU 11 1HD1 LEU 11 -8.907 -3.432 0.968
69 HD12 LEU 11 2HD1 LEU 11 -9.245 -4.440 -0.439
70 HD13 LEU 11 3HD1 LEU 11 -9.973 -2.839 -0.306
71 HD21 LEU 11 3HD2 LEU 11 -7.414 -0.840 -0.175
72 HD22 LEU 11 1HD2 LEU 11 -9.071 -1.037 -0.747
73 HD23 LEU 11 2HD2 LEU 11 -7.740 -0.987 -1.903
74 H VAL 12 H VAL 12 -4.220 -6.159 -0.318
75 HA VAL 12 HA VAL 12 -3.145 -5.495 2.347
76 HB VAL 12 HB VAL 12 -3.674 -7.726 2.616
77 HG11 VAL 12 1HG1 VAL 12 -3.043 -9.393 0.694
78 HG12 VAL 12 2HG1 VAL 12 -4.541 -8.463 0.620
79 HG13 VAL 12 3HG1 VAL 12 -3.133 -7.945 -0.308
80 HG21 VAL 12 3HG2 VAL 12 -1.263 -7.309 3.019
81 HG22 VAL 12 1HG2 VAL 12 -1.617 -8.983 2.590
82 HG23 VAL 12 2HG2 VAL 12 -0.922 -7.892 1.390
83 H CYS 13 H CYS 13 -0.988 -5.040 2.519
84 HA CYS 13 HA CYS 13 0.349 -4.125 0.185
85 HB2 CYS 13 1HB CYS 13 0.650 -3.085 2.405
86 HB3 CYS 13 2HB CYS 13 1.444 -4.549 2.974
87 H ASN 14 H ASN 14 1.423 -5.306 -1.240
88 HA ASN 14 HA ASN 14 2.056 -8.046 -0.789
89 HB2 ASN 14 1HB ASN 14 1.473 -6.938 -3.017
90 HB3 ASN 14 2HB ASN 14 3.130 -6.343 -3.035
91 HD21 ASN 14 1HD2 ASN 14 1.374 -8.489 -4.476
92 HD22 ASN 14 2HD2 ASN 14 2.461 -9.826 -4.604
93 H GLU 15 H GLU 15 3.608 -5.210 0.083
94 HA GLU 15 HA GLU 15 6.316 -6.190 -0.167
95 HB2 GLU 15 1HB GLU 15 5.406 -3.793 1.419
96 HB3 GLU 15 2HB GLU 15 7.001 -4.102 0.747
97 HG2 GLU 15 1HG GLU 15 4.708 -3.931 -1.127
98 HG3 GLU 15 2HG GLU 15 5.300 -2.442 -0.393
99 H CYS 16 H CYS 16 4.009 -5.577 2.456
100 HA CYS 16 HA CYS 16 5.727 -7.179 4.236
101 HB2 CYS 16 1HB CYS 16 4.704 -5.970 6.115
102 HB3 CYS 16 2HB CYS 16 5.493 -4.863 4.996
103 H GLY 17 H GLY 17 2.424 -6.550 3.174
104 HA2 GLY 17 1HA GLY 17 0.872 -8.340 2.850
105 HA3 GLY 17 2HA GLY 17 1.700 -9.241 4.111
106 H LYS 18 H LYS 18 0.557 -5.890 4.185
107 HA LYS 18 HA LYS 18 -1.093 -6.605 6.513
108 HB2 LYS 18 1HB LYS 18 0.817 -4.810 6.559
109 HB3 LYS 18 2HB LYS 18 -0.389 -3.783 5.795
110 HG2 LYS 18 1HG LYS 18 -1.911 -4.228 7.693
111 HG3 LYS 18 2HG LYS 18 -0.619 -5.145 8.470
112 HD2 LYS 18 1HD LYS 18 0.689 -3.248 8.808
113 HD3 LYS 18 2HD LYS 18 -0.169 -2.320 7.576
114 HE2 LYS 18 1HE LYS 18 -2.113 -2.156 8.983
115 HE3 LYS 18 2HE LYS 18 -1.391 -3.234 10.176
116 HZ1 LYS 18 3HZ LYS 18 -1.305 -0.717 10.578
117 HZ2 LYS 18 1HZ LYS 18 -0.056 -0.712 9.437
118 HZ3 LYS 18 2HZ LYS 18 0.098 -1.620 10.855
119 H THR 19 H THR 19 -3.211 -6.690 6.218
120 HA THR 19 HA THR 19 -4.442 -5.787 3.802
121 HB THR 19 HB THR 19 -6.527 -6.602 4.740
122 HG1 THR 19 1HG THR 19 -5.158 -7.178 7.159
123 HG21 THR 19 3HG2 THR 19 -4.143 -8.163 4.508
124 HG22 THR 19 1HG2 THR 19 -5.809 -8.632 4.170
125 HG23 THR 19 2HG2 THR 19 -5.147 -8.834 5.793
126 H PHE 20 H PHE 20 -6.187 -4.265 3.641
127 HA PHE 20 HA PHE 20 -6.330 -2.271 5.785
128 HB2 PHE 20 1HB PHE 20 -5.719 -1.699 2.882
129 HB3 PHE 20 2HB PHE 20 -6.237 -0.465 4.026
130 HD1 PHE 20 1HD PHE 20 -3.532 -2.761 3.100
131 HD2 PHE 20 2HD PHE 20 -4.751 0.380 5.700
132 HE1 PHE 20 1HE PHE 20 -1.196 -2.442 3.804
133 HE2 PHE 20 2HE PHE 20 -2.418 0.706 6.407
134 HZ PHE 20 HZ PHE 20 -0.636 -0.706 5.459
135 H ARG 21 H ARG 21 -8.127 -0.654 5.322
136 HA ARG 21 HA ARG 21 -10.485 -2.168 4.533
137 HB2 ARG 21 1HB ARG 21 -9.998 0.333 6.101
138 HB3 ARG 21 2HB ARG 21 -11.583 0.066 5.387
139 HG2 ARG 21 1HG ARG 21 -10.224 -1.915 7.195
140 HG3 ARG 21 2HG ARG 21 -11.341 -0.672 7.763
141 HD2 ARG 21 1HD ARG 21 -13.163 -1.676 6.802
142 HD3 ARG 21 2HD ARG 21 -12.206 -2.446 5.537
143 HE ARG 21 HE ARG 21 -11.396 -3.668 7.836
144 HH11 ARG 21 2HH1 ARG 21 -14.467 -3.162 6.275
145 HH12 ARG 21 1HH1 ARG 21 -15.168 -4.622 6.890
146 HH21 ARG 21 2HH2 ARG 21 -12.308 -5.594 8.652
147 HH22 ARG 21 1HH2 ARG 21 -13.939 -6.004 8.243
148 H GLN 22 H GLN 22 -8.950 0.948 3.774
149 HA GLN 22 HA GLN 22 -10.564 1.056 1.314
150 HB2 GLN 22 1HB GLN 22 -9.167 3.313 2.760
151 HB3 GLN 22 2HB GLN 22 -10.146 3.471 1.308
152 HG2 GLN 22 1HG GLN 22 -12.112 2.732 2.537
153 HG3 GLN 22 2HG GLN 22 -11.136 2.533 3.992
154 HE21 GLN 22 1HE2 GLN 22 -13.395 4.402 2.861
155 HE22 GLN 22 2HE2 GLN 22 -12.913 5.951 3.456
156 H SER 23 H SER 23 -9.401 2.305 -0.491
157 HA SER 23 HA SER 23 -6.988 0.880 -1.087
158 HB2 SER 23 1HB SER 23 -8.688 1.416 -2.815
159 HB3 SER 23 2HB SER 23 -8.308 3.128 -2.629
160 HG SER 23 HG SER 23 -7.145 2.276 -4.359
161 H SER 24 H SER 24 -7.808 4.264 -0.426
162 HA SER 24 HA SER 24 -5.326 5.422 -0.867
163 HB2 SER 24 1HB SER 24 -7.286 6.788 -0.468
164 HB3 SER 24 2HB SER 24 -7.444 6.151 1.169
165 HG SER 24 HG SER 24 -6.366 8.277 0.873
166 H CYS 25 H CYS 25 -6.591 3.883 2.062
167 HA CYS 25 HA CYS 25 -4.507 4.461 3.803
168 HB2 CYS 25 1HB CYS 25 -6.805 3.177 4.118
169 HB3 CYS 25 2HB CYS 25 -5.776 1.763 3.924
170 HG CYS 25 HG CYS 25 -6.430 2.733 6.680
171 H LEU 26 H LEU 26 -4.940 1.384 2.045
172 HA LEU 26 HA LEU 26 -2.495 0.253 2.616
173 HB2 LEU 26 1HB LEU 26 -4.113 -1.087 1.562
174 HB3 LEU 26 2HB LEU 26 -4.278 0.034 0.212
175 HG LEU 26 HG LEU 26 -1.873 -0.613 -0.382
176 HD11 LEU 26 1HD1 LEU 26 -2.542 -2.968 1.374
177 HD12 LEU 26 2HD1 LEU 26 -1.398 -1.695 1.798
178 HD13 LEU 26 3HD1 LEU 26 -1.082 -2.736 0.410
179 HD21 LEU 26 3HD2 LEU 26 -4.277 -1.530 -1.221
180 HD22 LEU 26 1HD2 LEU 26 -3.509 -3.033 -0.710
181 HD23 LEU 26 2HD2 LEU 26 -2.730 -2.013 -1.920
182 H SER 27 H SER 27 -3.259 1.922 -0.447
183 HA SER 27 HA SER 27 -0.736 2.026 -1.516
184 HB2 SER 27 1HB SER 27 -1.503 4.096 -2.711
185 HB3 SER 27 2HB SER 27 -2.642 2.753 -2.803
186 HG SER 27 HG SER 27 -3.283 5.094 -2.110
187 H LYS 28 H LYS 28 -2.238 4.612 0.430
188 HA LYS 28 HA LYS 28 -0.058 6.301 0.612
189 HB2 LYS 28 1HB LYS 28 -2.258 6.967 1.384
190 HB3 LYS 28 2HB LYS 28 -2.215 5.757 2.659
191 HG2 LYS 28 1HG LYS 28 -0.056 7.792 2.601
192 HG3 LYS 28 2HG LYS 28 -1.666 8.295 3.122
193 HD2 LYS 28 1HD LYS 28 -0.393 5.839 4.270
194 HD3 LYS 28 2HD LYS 28 0.027 7.438 4.889
195 HE2 LYS 28 1HE LYS 28 -2.514 7.788 5.097
196 HE3 LYS 28 2HE LYS 28 -2.626 6.037 4.926
197 HZ1 LYS 28 3HZ LYS 28 -1.332 7.589 7.082
198 HZ2 LYS 28 1HZ LYS 28 -0.955 5.960 6.819
199 HZ3 LYS 28 2HZ LYS 28 -2.538 6.410 7.210
200 H HIS 29 H HIS 29 -0.443 3.199 1.958
201 HA HIS 29 HA HIS 29 1.607 3.640 3.997
202 HB2 HIS 29 1HB HIS 29 0.047 2.313 5.014
203 HB3 HIS 29 2HB HIS 29 -0.461 1.567 3.502
204 HD1 HIS 29 1HD HIS 29 1.608 1.000 6.456
205 HD2 HIS 29 2HD HIS 29 1.351 -0.525 2.600
206 HE1 HIS 29 1HE HIS 29 2.883 -1.167 6.503
207 H GLN 30 H GLN 30 1.045 1.916 0.987
208 HA GLN 30 HA GLN 30 3.299 0.277 0.961
209 HB2 GLN 30 1HB GLN 30 1.899 1.611 -1.362
210 HB3 GLN 30 2HB GLN 30 3.051 0.290 -1.505
211 HG2 GLN 30 1HG GLN 30 1.421 -0.944 0.101
212 HG3 GLN 30 2HG GLN 30 0.264 0.266 -0.449
213 HE21 GLN 30 1HE2 GLN 30 1.502 -2.740 -1.029
214 HE22 GLN 30 2HE2 GLN 30 1.016 -2.933 -2.675
215 H ARG 31 H ARG 31 2.973 3.690 0.401
216 HA ARG 31 HA ARG 31 5.324 4.189 -1.029
217 HB2 ARG 31 1HB ARG 31 5.170 6.489 0.034
218 HB3 ARG 31 2HB ARG 31 3.752 5.950 -0.857
219 HG2 ARG 31 1HG ARG 31 2.466 5.782 1.012
220 HG3 ARG 31 2HG ARG 31 3.838 5.409 2.057
221 HD2 ARG 31 1HD ARG 31 3.047 8.093 0.942
222 HD3 ARG 31 2HD ARG 31 3.046 7.589 2.631
223 HE ARG 31 HE ARG 31 5.328 8.422 1.058
224 HH11 ARG 31 2HH1 ARG 31 4.194 6.831 3.940
225 HH12 ARG 31 1HH1 ARG 31 5.678 7.055 4.805
226 HH21 ARG 31 2HH2 ARG 31 7.287 8.723 2.187
227 HH22 ARG 31 1HH2 ARG 31 7.437 8.132 3.807
228 H ILE 32 H ILE 32 4.866 3.196 2.207
229 HA ILE 32 HA ILE 32 7.202 4.304 3.372
230 HB ILE 32 HB ILE 32 6.794 2.955 5.237
231 HG12 ILE 32 1HG1 ILE 32 5.175 1.091 3.488
232 HG13 ILE 32 2HG1 ILE 32 6.834 0.798 3.999
233 HG21 ILE 32 1HG2 ILE 32 4.056 2.755 4.968
234 HG22 ILE 32 2HG2 ILE 32 4.947 4.166 5.534
235 HG23 ILE 32 3HG2 ILE 32 4.492 4.035 3.836
236 HD11 ILE 32 3HD1 ILE 32 4.419 1.008 5.780
237 HD12 ILE 32 1HD1 ILE 32 5.313 -0.457 5.375
238 HD13 ILE 32 2HD1 ILE 32 6.078 0.806 6.341
239 H HIS 33 H HIS 33 6.557 1.382 1.550
240 HA HIS 33 HA HIS 33 9.211 0.317 2.052
241 HB2 HIS 33 1HB HIS 33 7.081 -0.727 0.177
242 HB3 HIS 33 2HB HIS 33 8.504 -1.595 0.748
243 HD1 HIS 33 1HD HIS 33 8.515 -1.873 3.512
244 HD2 HIS 33 2HD HIS 33 4.865 -1.267 1.622
245 HE1 HIS 33 1HE HIS 33 6.772 -2.655 5.149
246 H SER 34 H SER 34 7.335 1.347 -0.799
247 HA SER 34 HA SER 34 9.460 1.174 -2.629
248 HB2 SER 34 1HB SER 34 6.857 1.511 -2.969
249 HB3 SER 34 2HB SER 34 7.309 3.215 -3.017
250 HG SER 34 HG SER 34 8.869 2.573 -4.661
251 H GLY 35 H GLY 35 10.841 2.732 -3.492
252 HA2 GLY 35 1HA GLY 35 11.380 4.973 -1.673
253 HA3 GLY 35 2HA GLY 35 12.517 4.287 -2.823
254 H GLU 36 H GLU 36 9.472 6.105 -2.641
255 HA GLU 36 HA GLU 36 10.152 7.350 -5.219
256 HB2 GLU 36 1HB GLU 36 7.826 7.833 -5.517
257 HB3 GLU 36 2HB GLU 36 7.966 6.142 -5.057
258 HG2 GLU 36 1HG GLU 36 7.098 6.511 -2.940
259 HG3 GLU 36 2HG GLU 36 7.445 8.238 -2.992
260 H LYS 37 H LYS 37 9.096 9.655 -5.350
261 HA LYS 37 HA LYS 37 10.464 11.261 -3.429
262 HB2 LYS 37 1HB LYS 37 8.499 12.069 -5.581
263 HB3 LYS 37 2HB LYS 37 9.545 13.166 -4.687
264 HG2 LYS 37 1HG LYS 37 11.479 12.347 -5.724
265 HG3 LYS 37 2HG LYS 37 10.651 10.906 -6.319
266 HD2 LYS 37 1HD LYS 37 9.609 12.048 -8.029
267 HD3 LYS 37 2HD LYS 37 9.702 13.599 -7.190
268 HE2 LYS 37 1HE LYS 37 11.318 13.913 -8.775
269 HE3 LYS 37 2HE LYS 37 12.294 13.209 -7.486
270 HZ1 LYS 37 3HZ LYS 37 12.859 12.092 -9.472
271 HZ2 LYS 37 1HZ LYS 37 11.240 11.852 -9.900
272 HZ3 LYS 37 2HZ LYS 37 11.901 11.013 -8.589
273 HA PRO 38 HA PRO 38 7.288 11.733 -0.413
274 HB2 PRO 38 1HB PRO 38 8.135 14.048 0.724
275 HB3 PRO 38 2HB PRO 38 8.942 12.498 0.986
276 HG2 PRO 38 1HG PRO 38 9.673 14.722 -0.880
277 HG3 PRO 38 2HG PRO 38 10.723 13.748 0.166
278 HD2 PRO 38 1HD PRO 38 10.468 13.276 -2.488
279 HD3 PRO 38 2HD PRO 38 10.767 11.980 -1.311
280 H SER 39 H SER 39 5.372 12.147 -1.439
281 HA SER 39 HA SER 39 4.580 14.931 -1.626
282 HB2 SER 39 1HB SER 39 5.477 14.468 -3.874
283 HB3 SER 39 2HB SER 39 4.381 13.095 -4.027
284 HG SER 39 HG SER 39 3.562 14.996 -5.026
285 H GLY 40 H GLY 40 2.664 15.097 -0.680
286 HA2 GLY 40 1HA GLY 40 0.273 14.210 -1.093
287 HA3 GLY 40 2HA GLY 40 0.967 12.699 -0.524
288 HA PRO 41 HA PRO 41 -0.570 15.538 2.994
289 HB2 PRO 41 1HB PRO 41 -2.940 14.320 3.515
290 HB3 PRO 41 2HB PRO 41 -2.783 15.673 2.388
291 HG2 PRO 41 1HG PRO 41 -2.940 12.739 1.815
292 HG3 PRO 41 2HG PRO 41 -3.740 14.085 0.985
293 HD2 PRO 41 1HD PRO 41 -1.514 12.890 0.012
294 HD3 PRO 41 2HD PRO 41 -1.860 14.614 -0.239
295 H SER 42 H SER 42 0.441 12.492 2.374
296 HA SER 42 HA SER 42 -0.191 11.218 4.871
297 HB2 SER 42 1HB SER 42 1.310 9.435 4.095
298 HB3 SER 42 2HB SER 42 0.177 9.897 2.825
299 HG SER 42 HG SER 42 2.190 11.444 2.425
300 H SER 43 H SER 43 1.565 13.810 4.424
301 HA SER 43 HA SER 43 4.097 13.220 5.536
302 HB2 SER 43 1HB SER 43 2.515 15.688 5.018
303 HB3 SER 43 2HB SER 43 3.844 15.806 6.170
304 HG SER 43 HG SER 43 4.815 14.479 4.158
305 H GLY 44 H GLY 44 4.624 12.694 7.547
306 HA2 GLY 44 1HA GLY 44 4.367 13.637 9.911
307 HA3 GLY 44 2HA GLY 44 2.669 13.244 9.685
Start of MODEL 15
1 H1 GLY 1 H GLY 1 -14.692 -15.889 -16.551
2 HA2 GLY 1 1HA GLY 1 -13.646 -15.811 -14.489
3 HA3 GLY 1 2HA GLY 1 -12.213 -15.661 -15.495
4 H SER 2 H SER 2 -14.886 -13.442 -14.703
5 HA SER 2 HA SER 2 -12.854 -11.455 -13.927
6 HB2 SER 2 1HB SER 2 -15.666 -10.962 -14.936
7 HB3 SER 2 2HB SER 2 -14.470 -9.726 -14.550
8 HG SER 2 HG SER 2 -13.154 -10.639 -16.218
9 H SER 3 H SER 3 -13.108 -10.290 -12.040
10 HA SER 3 HA SER 3 -14.786 -11.552 -10.036
11 HB2 SER 3 1HB SER 3 -12.293 -10.725 -9.805
12 HB3 SER 3 2HB SER 3 -13.059 -9.177 -9.450
13 HG SER 3 HG SER 3 -13.714 -11.594 -8.121
14 H GLY 4 H GLY 4 -16.657 -10.772 -9.300
15 HA2 GLY 4 1HA GLY 4 -17.272 -8.006 -9.123
16 HA3 GLY 4 2HA GLY 4 -18.046 -8.710 -10.535
17 H SER 5 H SER 5 -19.353 -10.710 -10.109
18 HA SER 5 HA SER 5 -21.299 -10.158 -8.143
19 HB2 SER 5 1HB SER 5 -22.266 -12.350 -8.795
20 HB3 SER 5 2HB SER 5 -21.877 -11.345 -10.190
21 HG SER 5 HG SER 5 -21.197 -13.617 -10.283
22 H SER 6 H SER 6 -18.753 -12.626 -8.321
23 HA SER 6 HA SER 6 -19.351 -13.974 -5.952
24 HB2 SER 6 1HB SER 6 -16.609 -13.543 -7.162
25 HB3 SER 6 2HB SER 6 -17.066 -14.824 -6.039
26 HG SER 6 HG SER 6 -17.589 -15.911 -7.748
27 H GLY 7 H GLY 7 -17.190 -11.211 -6.518
28 HA2 GLY 7 1HA GLY 7 -17.601 -9.651 -4.422
29 HA3 GLY 7 2HA GLY 7 -16.722 -10.960 -3.645
30 H LYS 8 H LYS 8 -15.130 -9.349 -3.091
31 HA LYS 8 HA LYS 8 -13.119 -9.097 -5.183
32 HB2 LYS 8 1HB LYS 8 -12.761 -6.715 -4.763
33 HB3 LYS 8 2HB LYS 8 -14.396 -7.009 -5.341
34 HG2 LYS 8 1HG LYS 8 -14.862 -5.581 -3.645
35 HG3 LYS 8 2HG LYS 8 -14.905 -7.099 -2.745
36 HD2 LYS 8 1HD LYS 8 -12.447 -6.703 -2.248
37 HD3 LYS 8 2HD LYS 8 -12.687 -5.069 -2.871
38 HE2 LYS 8 1HE LYS 8 -12.952 -4.906 -0.535
39 HE3 LYS 8 2HE LYS 8 -14.583 -4.865 -1.202
40 HZ1 LYS 8 3HZ LYS 8 -13.758 -6.500 0.778
41 HZ2 LYS 8 1HZ LYS 8 -13.649 -7.514 -0.572
42 HZ3 LYS 8 2HZ LYS 8 -15.118 -6.767 -0.193
43 H LYS 9 H LYS 9 -11.043 -9.130 -4.425
44 HA LYS 9 HA LYS 9 -10.658 -10.032 -1.737
45 HB2 LYS 9 1HB LYS 9 -8.837 -9.501 -4.065
46 HB3 LYS 9 2HB LYS 9 -8.172 -9.832 -2.470
47 HG2 LYS 9 1HG LYS 9 -10.097 -11.660 -3.884
48 HG3 LYS 9 2HG LYS 9 -8.341 -11.813 -3.979
49 HD2 LYS 9 1HD LYS 9 -8.403 -11.863 -1.415
50 HD3 LYS 9 2HD LYS 9 -10.133 -12.163 -1.594
51 HE2 LYS 9 1HE LYS 9 -7.953 -13.830 -2.845
52 HE3 LYS 9 2HE LYS 9 -8.794 -14.234 -1.350
53 HZ1 LYS 9 3HZ LYS 9 -10.252 -13.779 -3.882
54 HZ2 LYS 9 1HZ LYS 9 -10.793 -14.563 -2.484
55 HZ3 LYS 9 2HZ LYS 9 -9.634 -15.300 -3.472
56 HA PRO 10 HA PRO 10 -9.799 -6.237 0.303
57 HB2 PRO 10 1HB PRO 10 -8.050 -7.084 2.199
58 HB3 PRO 10 2HB PRO 10 -9.780 -7.444 2.257
59 HG2 PRO 10 1HG PRO 10 -7.517 -9.167 1.324
60 HG3 PRO 10 2HG PRO 10 -8.914 -9.601 2.326
61 HD2 PRO 10 1HD PRO 10 -8.789 -10.160 -0.321
62 HD3 PRO 10 2HD PRO 10 -10.317 -9.795 0.508
63 H LEU 11 H LEU 11 -8.008 -4.779 0.942
64 HA LEU 11 HA LEU 11 -5.869 -4.904 -1.045
65 HB2 LEU 11 1HB LEU 11 -6.489 -2.613 0.798
66 HB3 LEU 11 2HB LEU 11 -5.573 -2.581 -0.708
67 HG LEU 11 HG LEU 11 -7.667 -3.046 -1.944
68 HD11 LEU 11 1HD1 LEU 11 -8.769 -3.058 0.827
69 HD12 LEU 11 2HD1 LEU 11 -9.125 -4.123 -0.533
70 HD13 LEU 11 3HD1 LEU 11 -9.771 -2.482 -0.506
71 HD21 LEU 11 3HD2 LEU 11 -7.556 -0.834 -2.157
72 HD22 LEU 11 1HD2 LEU 11 -6.975 -0.635 -0.504
73 HD23 LEU 11 2HD2 LEU 11 -8.707 -0.727 -0.824
74 H VAL 12 H VAL 12 -4.228 -6.128 -0.299
75 HA VAL 12 HA VAL 12 -3.102 -5.413 2.331
76 HB VAL 12 HB VAL 12 -3.792 -7.590 2.702
77 HG11 VAL 12 1HG1 VAL 12 -4.679 -8.376 0.735
78 HG12 VAL 12 2HG1 VAL 12 -3.233 -7.989 -0.199
79 HG13 VAL 12 3HG1 VAL 12 -3.242 -9.388 0.876
80 HG21 VAL 12 3HG2 VAL 12 -1.819 -8.967 2.782
81 HG22 VAL 12 1HG2 VAL 12 -1.046 -7.998 1.527
82 HG23 VAL 12 2HG2 VAL 12 -1.361 -7.297 3.114
83 H CYS 13 H CYS 13 -0.968 -4.952 2.435
84 HA CYS 13 HA CYS 13 0.425 -4.305 0.064
85 HB2 CYS 13 1HB CYS 13 0.778 -3.174 2.247
86 HB3 CYS 13 2HB CYS 13 1.543 -4.638 2.855
87 H ASN 14 H ASN 14 1.381 -5.649 -1.299
88 HA ASN 14 HA ASN 14 1.885 -8.379 -0.671
89 HB2 ASN 14 1HB ASN 14 1.301 -7.461 -2.955
90 HB3 ASN 14 2HB ASN 14 2.949 -6.848 -3.048
91 HD21 ASN 14 1HD2 ASN 14 1.065 -9.236 -4.079
92 HD22 ASN 14 2HD2 ASN 14 2.216 -10.515 -4.228
93 H GLU 15 H GLU 15 3.612 -5.562 -0.063
94 HA GLU 15 HA GLU 15 6.256 -6.697 -0.284
95 HB2 GLU 15 1HB GLU 15 5.449 -4.152 1.124
96 HB3 GLU 15 2HB GLU 15 7.052 -4.590 0.550
97 HG2 GLU 15 1HG GLU 15 4.851 -4.458 -1.434
98 HG3 GLU 15 2HG GLU 15 5.485 -2.945 -0.790
99 H CYS 16 H CYS 16 4.043 -5.808 2.342
100 HA CYS 16 HA CYS 16 5.718 -7.388 4.182
101 HB2 CYS 16 1HB CYS 16 4.838 -6.007 6.003
102 HB3 CYS 16 2HB CYS 16 5.622 -5.007 4.784
103 H GLY 17 H GLY 17 2.430 -6.639 3.154
104 HA2 GLY 17 1HA GLY 17 0.785 -8.373 2.977
105 HA3 GLY 17 2HA GLY 17 1.579 -9.212 4.301
106 H LYS 18 H LYS 18 0.640 -5.804 4.125
107 HA LYS 18 HA LYS 18 -1.004 -6.227 6.524
108 HB2 LYS 18 1HB LYS 18 0.976 -4.504 6.327
109 HB3 LYS 18 2HB LYS 18 -0.236 -3.512 5.528
110 HG2 LYS 18 1HG LYS 18 -1.679 -3.725 7.515
111 HG3 LYS 18 2HG LYS 18 -0.398 -4.638 8.316
112 HD2 LYS 18 1HD LYS 18 0.259 -1.970 7.165
113 HD3 LYS 18 2HD LYS 18 -0.658 -2.036 8.672
114 HE2 LYS 18 1HE LYS 18 1.796 -3.705 8.406
115 HE3 LYS 18 2HE LYS 18 1.975 -1.972 8.676
116 HZ1 LYS 18 3HZ LYS 18 1.583 -3.859 10.599
117 HZ2 LYS 18 1HZ LYS 18 0.051 -3.163 10.427
118 HZ3 LYS 18 2HZ LYS 18 1.385 -2.191 10.794
119 H THR 19 H THR 19 -3.129 -6.263 6.279
120 HA THR 19 HA THR 19 -4.371 -5.497 3.810
121 HB THR 19 HB THR 19 -6.470 -6.202 4.847
122 HG1 THR 19 1HG THR 19 -6.424 -5.696 6.946
123 HG21 THR 19 3HG2 THR 19 -4.088 -7.857 4.685
124 HG22 THR 19 1HG2 THR 19 -5.737 -8.202 4.163
125 HG23 THR 19 2HG2 THR 19 -5.263 -8.493 5.836
126 H PHE 20 H PHE 20 -6.183 -4.004 3.658
127 HA PHE 20 HA PHE 20 -6.303 -1.919 5.694
128 HB2 PHE 20 1HB PHE 20 -5.612 -1.379 2.800
129 HB3 PHE 20 2HB PHE 20 -6.040 -0.138 3.973
130 HD1 PHE 20 1HD PHE 20 -3.493 -2.569 2.958
131 HD2 PHE 20 2HD PHE 20 -4.492 0.556 5.669
132 HE1 PHE 20 1HE PHE 20 -1.136 -2.416 3.646
133 HE2 PHE 20 2HE PHE 20 -2.137 0.714 6.361
134 HZ PHE 20 HZ PHE 20 -0.455 -0.773 5.349
135 H ARG 21 H ARG 21 -8.288 -1.031 5.903
136 HA ARG 21 HA ARG 21 -10.471 -2.251 4.524
137 HB2 ARG 21 1HB ARG 21 -11.888 -0.852 5.911
138 HB3 ARG 21 2HB ARG 21 -10.605 -1.553 6.889
139 HG2 ARG 21 1HG ARG 21 -9.505 0.473 7.128
140 HG3 ARG 21 2HG ARG 21 -10.302 1.183 5.723
141 HD2 ARG 21 1HD ARG 21 -12.437 1.153 6.958
142 HD3 ARG 21 2HD ARG 21 -11.591 0.514 8.367
143 HE ARG 21 HE ARG 21 -11.538 3.235 7.383
144 HH11 ARG 21 2HH1 ARG 21 -10.052 0.844 9.431
145 HH12 ARG 21 1HH1 ARG 21 -9.273 2.010 10.448
146 HH21 ARG 21 2HH2 ARG 21 -10.517 4.780 8.714
147 HH22 ARG 21 1HH2 ARG 21 -9.538 4.249 10.040
148 H GLN 22 H GLN 22 -8.800 0.828 4.313
149 HA GLN 22 HA GLN 22 -10.655 1.720 2.225
150 HB2 GLN 22 1HB GLN 22 -8.502 3.210 3.735
151 HB3 GLN 22 2HB GLN 22 -9.493 3.913 2.463
152 HG2 GLN 22 1HG GLN 22 -11.463 3.079 3.984
153 HG3 GLN 22 2HG GLN 22 -10.227 3.149 5.239
154 HE21 GLN 22 1HE2 GLN 22 -12.572 4.861 3.648
155 HE22 GLN 22 2HE2 GLN 22 -12.076 6.463 4.063
156 H SER 23 H SER 23 -9.477 3.060 0.450
157 HA SER 23 HA SER 23 -7.508 1.265 -0.737
158 HB2 SER 23 1HB SER 23 -8.850 3.658 -2.011
159 HB3 SER 23 2HB SER 23 -8.003 2.344 -2.829
160 HG SER 23 HG SER 23 -10.112 1.812 -2.980
161 H SER 24 H SER 24 -7.878 4.664 0.167
162 HA SER 24 HA SER 24 -5.371 5.537 -0.794
163 HB2 SER 24 1HB SER 24 -6.962 7.229 -0.357
164 HB3 SER 24 2HB SER 24 -7.280 6.626 1.270
165 HG SER 24 HG SER 24 -5.852 8.563 0.975
166 H CYS 25 H CYS 25 -6.396 4.076 2.221
167 HA CYS 25 HA CYS 25 -4.208 4.646 3.834
168 HB2 CYS 25 1HB CYS 25 -6.046 2.259 3.730
169 HB3 CYS 25 2HB CYS 25 -4.788 2.418 4.949
170 HG CYS 25 HG CYS 25 -5.998 5.121 5.529
171 H LEU 26 H LEU 26 -4.715 1.551 2.132
172 HA LEU 26 HA LEU 26 -2.257 0.430 2.485
173 HB2 LEU 26 1HB LEU 26 -4.009 -0.792 1.421
174 HB3 LEU 26 2HB LEU 26 -4.049 0.338 0.068
175 HG LEU 26 HG LEU 26 -1.802 -0.452 -0.606
176 HD11 LEU 26 1HD1 LEU 26 -2.096 -2.786 1.219
177 HD12 LEU 26 2HD1 LEU 26 -1.393 -1.295 1.843
178 HD13 LEU 26 3HD1 LEU 26 -0.648 -2.112 0.469
179 HD21 LEU 26 3HD2 LEU 26 -3.614 -2.826 -0.366
180 HD22 LEU 26 1HD2 LEU 26 -2.575 -2.347 -1.709
181 HD23 LEU 26 2HD2 LEU 26 -4.052 -1.444 -1.371
182 H SER 27 H SER 27 -3.164 2.428 -0.329
183 HA SER 27 HA SER 27 -0.696 2.523 -1.569
184 HB2 SER 27 1HB SER 27 -2.799 3.396 -2.551
185 HB3 SER 27 2HB SER 27 -2.725 4.767 -1.445
186 HG SER 27 HG SER 27 -1.742 4.809 -3.753
187 H LYS 28 H LYS 28 -2.023 4.919 0.714
188 HA LYS 28 HA LYS 28 0.266 6.514 0.890
189 HB2 LYS 28 1HB LYS 28 -1.797 7.377 1.714
190 HB3 LYS 28 2HB LYS 28 -1.995 6.029 2.826
191 HG2 LYS 28 1HG LYS 28 0.398 7.763 3.132
192 HG3 LYS 28 2HG LYS 28 -1.170 8.389 3.647
193 HD2 LYS 28 1HD LYS 28 -0.305 5.660 4.509
194 HD3 LYS 28 2HD LYS 28 0.336 7.084 5.333
195 HE2 LYS 28 1HE LYS 28 -1.503 6.794 6.619
196 HE3 LYS 28 2HE LYS 28 -2.266 7.716 5.325
197 HZ1 LYS 28 3HZ LYS 28 -2.662 4.981 6.095
198 HZ2 LYS 28 1HZ LYS 28 -2.394 5.158 4.434
199 HZ3 LYS 28 2HZ LYS 28 -3.657 6.000 5.182
200 H HIS 29 H HIS 29 -0.210 3.360 1.953
201 HA HIS 29 HA HIS 29 1.762 3.558 4.103
202 HB2 HIS 29 1HB HIS 29 0.136 2.159 4.906
203 HB3 HIS 29 2HB HIS 29 -0.293 1.563 3.305
204 HD1 HIS 29 1HD HIS 29 1.507 0.639 6.312
205 HD2 HIS 29 2HD HIS 29 1.678 -0.374 2.287
206 HE1 HIS 29 1HE HIS 29 2.807 -1.511 6.215
207 H GLN 30 H GLN 30 1.289 2.114 0.928
208 HA GLN 30 HA GLN 30 3.514 0.464 0.799
209 HB2 GLN 30 1HB GLN 30 2.121 2.064 -1.344
210 HB3 GLN 30 2HB GLN 30 3.418 0.930 -1.696
211 HG2 GLN 30 1HG GLN 30 1.104 -0.027 -0.100
212 HG3 GLN 30 2HG GLN 30 0.889 0.225 -1.832
213 HE21 GLN 30 1HE2 GLN 30 0.501 -2.231 -1.155
214 HE22 GLN 30 2HE2 GLN 30 1.848 -3.255 -1.503
215 H ARG 31 H ARG 31 3.261 3.941 0.351
216 HA ARG 31 HA ARG 31 5.669 4.550 -0.819
217 HB2 ARG 31 1HB ARG 31 5.563 6.692 0.514
218 HB3 ARG 31 2HB ARG 31 4.120 6.306 -0.414
219 HG2 ARG 31 1HG ARG 31 2.991 5.538 1.570
220 HG3 ARG 31 2HG ARG 31 4.457 5.762 2.527
221 HD2 ARG 31 1HD ARG 31 2.880 7.605 2.850
222 HD3 ARG 31 2HD ARG 31 4.382 8.158 2.110
223 HE ARG 31 HE ARG 31 2.300 7.528 0.223
224 HH11 ARG 31 2HH1 ARG 31 3.697 9.985 2.256
225 HH12 ARG 31 1HH1 ARG 31 3.063 11.301 1.325
226 HH21 ARG 31 2HH2 ARG 31 1.458 9.252 -1.011
227 HH22 ARG 31 1HH2 ARG 31 1.788 10.883 -0.533
228 H ILE 32 H ILE 32 5.099 3.253 2.319
229 HA ILE 32 HA ILE 32 7.472 4.085 3.606
230 HB ILE 32 HB ILE 32 6.994 2.520 5.290
231 HG12 ILE 32 1HG1 ILE 32 5.395 1.013 3.212
232 HG13 ILE 32 2HG1 ILE 32 6.899 0.497 3.967
233 HG21 ILE 32 1HG2 ILE 32 5.250 3.844 5.734
234 HG22 ILE 32 2HG2 ILE 32 4.760 3.911 4.042
235 HG23 ILE 32 3HG2 ILE 32 4.258 2.555 5.053
236 HD11 ILE 32 3HD1 ILE 32 5.322 -0.731 5.102
237 HD12 ILE 32 1HD1 ILE 32 5.548 0.654 6.169
238 HD13 ILE 32 2HD1 ILE 32 4.145 0.582 5.102
239 H HIS 33 H HIS 33 6.718 1.394 1.483
240 HA HIS 33 HA HIS 33 9.358 0.225 1.853
241 HB2 HIS 33 1HB HIS 33 7.150 -0.654 -0.017
242 HB3 HIS 33 2HB HIS 33 8.572 -1.583 0.450
243 HD1 HIS 33 1HD HIS 33 8.659 -2.006 3.208
244 HD2 HIS 33 2HD HIS 33 4.969 -1.289 1.438
245 HE1 HIS 33 1HE HIS 33 6.952 -2.874 4.838
246 H SER 34 H SER 34 7.454 1.810 -0.674
247 HA SER 34 HA SER 34 9.029 1.564 -2.872
248 HB2 SER 34 1HB SER 34 6.879 2.863 -2.708
249 HB3 SER 34 2HB SER 34 7.806 4.198 -2.024
250 HG SER 34 HG SER 34 7.384 3.995 -4.464
251 H GLY 35 H GLY 35 9.518 3.858 -0.208
252 HA2 GLY 35 1HA GLY 35 11.858 5.030 -1.371
253 HA3 GLY 35 2HA GLY 35 11.292 5.251 0.278
254 H GLU 36 H GLU 36 13.016 3.010 -1.851
255 HA GLU 36 HA GLU 36 14.341 1.880 0.522
256 HB2 GLU 36 1HB GLU 36 14.841 -0.074 -0.809
257 HB3 GLU 36 2HB GLU 36 13.120 0.271 -0.915
258 HG2 GLU 36 1HG GLU 36 13.850 1.583 -3.070
259 HG3 GLU 36 2HG GLU 36 15.234 0.496 -2.991
260 H LYS 37 H LYS 37 16.632 0.991 -0.148
261 HA LYS 37 HA LYS 37 18.174 3.307 -0.873
262 HB2 LYS 37 1HB LYS 37 18.950 0.490 -0.111
263 HB3 LYS 37 2HB LYS 37 20.124 1.744 -0.490
264 HG2 LYS 37 1HG LYS 37 18.064 2.004 1.685
265 HG3 LYS 37 2HG LYS 37 19.695 1.382 1.946
266 HD2 LYS 37 1HD LYS 37 19.167 4.065 0.690
267 HD3 LYS 37 2HD LYS 37 19.320 3.848 2.435
268 HE2 LYS 37 1HE LYS 37 21.433 2.776 0.615
269 HE3 LYS 37 2HE LYS 37 21.403 4.497 0.999
270 HZ1 LYS 37 3HZ LYS 37 21.216 3.583 3.425
271 HZ2 LYS 37 1HZ LYS 37 22.722 3.708 2.665
272 HZ3 LYS 37 2HZ LYS 37 21.941 2.210 2.752
273 HA PRO 38 HA PRO 38 18.845 2.489 -5.135
274 HB2 PRO 38 1HB PRO 38 21.348 3.491 -5.457
275 HB3 PRO 38 2HB PRO 38 19.926 4.514 -5.225
276 HG2 PRO 38 1HG PRO 38 21.985 3.652 -3.231
277 HG3 PRO 38 2HG PRO 38 21.247 5.248 -3.457
278 HD2 PRO 38 1HD PRO 38 20.453 3.538 -1.514
279 HD3 PRO 38 2HD PRO 38 19.335 4.666 -2.308
280 H SER 39 H SER 39 20.840 1.719 -6.600
281 HA SER 39 HA SER 39 22.065 -0.074 -7.280
282 HB2 SER 39 1HB SER 39 23.508 0.893 -5.366
283 HB3 SER 39 2HB SER 39 22.924 -0.478 -4.422
284 HG SER 39 HG SER 39 24.564 -1.440 -5.342
285 H GLY 40 H GLY 40 19.389 -0.602 -6.744
286 HA2 GLY 40 1HA GLY 40 19.359 -3.161 -5.314
287 HA3 GLY 40 2HA GLY 40 17.947 -2.246 -5.821
288 HA PRO 41 HA PRO 41 18.393 -5.776 -8.753
289 HB2 PRO 41 1HB PRO 41 15.732 -6.302 -8.868
290 HB3 PRO 41 2HB PRO 41 16.790 -6.965 -7.616
291 HG2 PRO 41 1HG PRO 41 14.948 -4.609 -7.486
292 HG3 PRO 41 2HG PRO 41 15.215 -5.888 -6.287
293 HD2 PRO 41 1HD PRO 41 16.348 -3.438 -6.080
294 HD3 PRO 41 2HD PRO 41 17.143 -4.911 -5.488
295 H SER 42 H SER 42 18.154 -5.677 -10.936
296 HA SER 42 HA SER 42 16.559 -3.448 -12.021
297 HB2 SER 42 1HB SER 42 18.241 -3.086 -13.721
298 HB3 SER 42 2HB SER 42 19.027 -3.051 -12.143
299 HG SER 42 HG SER 42 19.476 -4.694 -14.231
300 H SER 43 H SER 43 15.737 -3.755 -14.183
301 HA SER 43 HA SER 43 14.829 -6.470 -14.591
302 HB2 SER 43 1HB SER 43 14.233 -3.961 -16.179
303 HB3 SER 43 2HB SER 43 13.394 -5.505 -16.331
304 HG SER 43 HG SER 43 13.533 -4.038 -13.910
305 H GLY 44 H GLY 44 14.797 -7.364 -16.857
306 HA2 GLY 44 1HA GLY 44 16.030 -7.030 -19.069
307 HA3 GLY 44 2HA GLY 44 17.463 -6.968 -18.055
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -3.112 -23.727 -9.676
2 HA2 GLY 1 1HA GLY 1 -4.689 -23.555 -12.141
3 HA3 GLY 1 2HA GLY 1 -5.329 -23.550 -10.505
4 H SER 2 H SER 2 -5.301 -21.697 -13.045
5 HA SER 2 HA SER 2 -4.487 -19.209 -11.737
6 HB2 SER 2 1HB SER 2 -4.713 -18.177 -13.930
7 HB3 SER 2 2HB SER 2 -3.741 -19.642 -14.069
8 HG SER 2 HG SER 2 -6.278 -20.321 -14.408
9 H SER 3 H SER 3 -5.895 -17.787 -10.932
10 HA SER 3 HA SER 3 -8.748 -18.128 -11.589
11 HB2 SER 3 1HB SER 3 -9.341 -17.640 -9.300
12 HB3 SER 3 2HB SER 3 -8.164 -18.953 -9.295
13 HG SER 3 HG SER 3 -7.479 -16.225 -8.940
14 H GLY 4 H GLY 4 -10.057 -16.206 -11.414
15 HA2 GLY 4 1HA GLY 4 -8.467 -13.746 -11.805
16 HA3 GLY 4 2HA GLY 4 -9.961 -14.089 -12.664
17 H SER 5 H SER 5 -8.829 -13.942 -9.283
18 HA SER 5 HA SER 5 -11.402 -12.762 -8.534
19 HB2 SER 5 1HB SER 5 -10.683 -13.210 -6.206
20 HB3 SER 5 2HB SER 5 -10.670 -14.669 -7.196
21 HG SER 5 HG SER 5 -8.499 -14.656 -7.219
22 H SER 6 H SER 6 -11.420 -10.621 -8.827
23 HA SER 6 HA SER 6 -9.283 -9.055 -7.559
24 HB2 SER 6 1HB SER 6 -10.303 -8.827 -10.372
25 HB3 SER 6 2HB SER 6 -9.704 -7.393 -9.537
26 HG SER 6 HG SER 6 -8.081 -8.528 -10.749
27 H GLY 7 H GLY 7 -10.076 -7.667 -6.128
28 HA2 GLY 7 1HA GLY 7 -11.528 -5.764 -5.690
29 HA3 GLY 7 2HA GLY 7 -12.797 -6.608 -6.565
30 H LYS 8 H LYS 8 -13.536 -8.688 -5.586
31 HA LYS 8 HA LYS 8 -14.650 -8.400 -3.140
32 HB2 LYS 8 1HB LYS 8 -14.813 -10.856 -3.007
33 HB3 LYS 8 2HB LYS 8 -15.208 -10.254 -4.612
34 HG2 LYS 8 1HG LYS 8 -12.839 -10.799 -5.272
35 HG3 LYS 8 2HG LYS 8 -12.692 -11.637 -3.725
36 HD2 LYS 8 1HD LYS 8 -13.294 -13.343 -5.179
37 HD3 LYS 8 2HD LYS 8 -14.840 -12.877 -4.465
38 HE2 LYS 8 1HE LYS 8 -15.238 -13.076 -6.780
39 HE3 LYS 8 2HE LYS 8 -15.140 -11.345 -6.460
40 HZ1 LYS 8 3HZ LYS 8 -12.569 -12.263 -7.053
41 HZ2 LYS 8 1HZ LYS 8 -13.534 -11.206 -7.954
42 HZ3 LYS 8 2HZ LYS 8 -13.608 -12.871 -8.241
43 H LYS 9 H LYS 9 -11.403 -9.612 -3.800
44 HA LYS 9 HA LYS 9 -10.771 -10.388 -1.163
45 HB2 LYS 9 1HB LYS 9 -9.180 -9.734 -3.611
46 HB3 LYS 9 2HB LYS 9 -8.347 -9.903 -2.071
47 HG2 LYS 9 1HG LYS 9 -10.203 -12.026 -3.084
48 HG3 LYS 9 2HG LYS 9 -8.512 -11.955 -3.584
49 HD2 LYS 9 1HD LYS 9 -7.888 -11.965 -1.157
50 HD3 LYS 9 2HD LYS 9 -9.587 -12.268 -0.784
51 HE2 LYS 9 1HE LYS 9 -9.486 -14.310 -2.172
52 HE3 LYS 9 2HE LYS 9 -7.768 -14.018 -2.437
53 HZ1 LYS 9 3HZ LYS 9 -7.489 -15.269 -0.629
54 HZ2 LYS 9 1HZ LYS 9 -9.105 -15.131 -0.149
55 HZ3 LYS 9 2HZ LYS 9 -7.996 -13.920 0.256
56 HA PRO 10 HA PRO 10 -10.104 -6.573 0.914
57 HB2 PRO 10 1HB PRO 10 -8.215 -7.326 2.712
58 HB3 PRO 10 2HB PRO 10 -9.910 -7.811 2.840
59 HG2 PRO 10 1HG PRO 10 -7.575 -9.350 1.771
60 HG3 PRO 10 2HG PRO 10 -8.890 -9.901 2.825
61 HD2 PRO 10 1HD PRO 10 -8.848 -10.402 0.164
62 HD3 PRO 10 2HD PRO 10 -10.358 -10.163 1.067
63 H LEU 11 H LEU 11 -8.341 -5.044 1.571
64 HA LEU 11 HA LEU 11 -6.321 -4.950 -0.543
65 HB2 LEU 11 1HB LEU 11 -6.966 -2.770 1.420
66 HB3 LEU 11 2HB LEU 11 -6.156 -2.629 -0.139
67 HG LEU 11 HG LEU 11 -8.296 -3.179 -1.255
68 HD11 LEU 11 1HD1 LEU 11 -9.204 -3.372 1.577
69 HD12 LEU 11 2HD1 LEU 11 -9.594 -4.396 0.195
70 HD13 LEU 11 3HD1 LEU 11 -10.328 -2.799 0.344
71 HD21 LEU 11 3HD2 LEU 11 -8.125 -0.934 -1.335
72 HD22 LEU 11 1HD2 LEU 11 -7.809 -0.788 0.394
73 HD23 LEU 11 2HD2 LEU 11 -9.462 -0.994 -0.186
74 H VAL 12 H VAL 12 -4.570 -6.094 0.067
75 HA VAL 12 HA VAL 12 -3.337 -5.389 2.651
76 HB VAL 12 HB VAL 12 -3.868 -7.597 3.037
77 HG11 VAL 12 1HG1 VAL 12 -4.890 -8.479 1.214
78 HG12 VAL 12 2HG1 VAL 12 -3.675 -7.859 0.094
79 HG13 VAL 12 3HG1 VAL 12 -3.338 -9.301 1.053
80 HG21 VAL 12 3HG2 VAL 12 -1.858 -8.837 3.024
81 HG22 VAL 12 1HG2 VAL 12 -1.267 -8.007 1.585
82 HG23 VAL 12 2HG2 VAL 12 -1.374 -7.144 3.119
83 H CYS 13 H CYS 13 -1.112 -5.116 2.701
84 HA CYS 13 HA CYS 13 0.081 -4.247 0.253
85 HB2 CYS 13 1HB CYS 13 0.529 -3.168 2.443
86 HB3 CYS 13 2HB CYS 13 1.363 -4.627 2.967
87 H ASN 14 H ASN 14 0.843 -5.612 -1.216
88 HA ASN 14 HA ASN 14 1.525 -8.307 -0.670
89 HB2 ASN 14 1HB ASN 14 2.513 -6.888 -3.117
90 HB3 ASN 14 2HB ASN 14 1.892 -8.529 -2.954
91 HD21 ASN 14 1HD2 ASN 14 -0.309 -8.886 -2.982
92 HD22 ASN 14 2HD2 ASN 14 -1.440 -7.681 -3.487
93 H GLU 15 H GLU 15 3.157 -5.548 0.076
94 HA GLU 15 HA GLU 15 5.829 -6.578 -0.450
95 HB2 GLU 15 1HB GLU 15 5.141 -4.059 1.054
96 HB3 GLU 15 2HB GLU 15 6.643 -4.455 0.231
97 HG2 GLU 15 1HG GLU 15 4.158 -4.334 -1.384
98 HG3 GLU 15 2HG GLU 15 4.863 -2.820 -0.819
99 H CYS 16 H CYS 16 3.745 -5.799 2.304
100 HA CYS 16 HA CYS 16 5.598 -7.304 4.033
101 HB2 CYS 16 1HB CYS 16 4.782 -5.950 5.913
102 HB3 CYS 16 2HB CYS 16 5.488 -4.938 4.657
103 H GLY 17 H GLY 17 2.229 -6.649 3.226
104 HA2 GLY 17 1HA GLY 17 0.629 -8.433 3.155
105 HA3 GLY 17 2HA GLY 17 1.529 -9.242 4.429
106 H LYS 18 H LYS 18 0.455 -5.870 4.283
107 HA LYS 18 HA LYS 18 -1.044 -6.340 6.770
108 HB2 LYS 18 1HB LYS 18 0.911 -4.617 6.563
109 HB3 LYS 18 2HB LYS 18 -0.297 -3.614 5.772
110 HG2 LYS 18 1HG LYS 18 -1.728 -3.813 7.770
111 HG3 LYS 18 2HG LYS 18 -0.449 -4.737 8.562
112 HD2 LYS 18 1HD LYS 18 1.063 -2.830 8.358
113 HD3 LYS 18 2HD LYS 18 -0.199 -1.907 7.538
114 HE2 LYS 18 1HE LYS 18 -1.569 -2.502 9.707
115 HE3 LYS 18 2HE LYS 18 0.039 -2.683 10.405
116 HZ1 LYS 18 3HZ LYS 18 -1.252 -0.269 9.330
117 HZ2 LYS 18 1HZ LYS 18 0.436 -0.382 9.332
118 HZ3 LYS 18 2HZ LYS 18 -0.420 -0.478 10.788
119 H THR 19 H THR 19 -3.173 -6.431 6.581
120 HA THR 19 HA THR 19 -4.529 -5.630 4.195
121 HB THR 19 HB THR 19 -6.577 -6.341 5.320
122 HG1 THR 19 1HG THR 19 -6.455 -7.046 7.503
123 HG21 THR 19 3HG2 THR 19 -5.659 -8.677 6.110
124 HG22 THR 19 1HG2 THR 19 -4.149 -8.073 5.427
125 HG23 THR 19 2HG2 THR 19 -5.585 -8.208 4.412
126 H PHE 20 H PHE 20 -6.245 -4.083 4.046
127 HA PHE 20 HA PHE 20 -6.259 -1.995 6.102
128 HB2 PHE 20 1HB PHE 20 -5.857 -1.505 3.144
129 HB3 PHE 20 2HB PHE 20 -6.149 -0.247 4.340
130 HD1 PHE 20 2HD PHE 20 -4.440 0.351 5.962
131 HD2 PHE 20 1HD PHE 20 -3.728 -2.608 2.986
132 HE1 PHE 20 2HE PHE 20 -2.024 0.497 6.399
133 HE2 PHE 20 1HE PHE 20 -1.310 -2.467 3.420
134 HZ PHE 20 HZ PHE 20 -0.455 -0.912 5.127
135 H ARG 21 H ARG 21 -8.062 -0.403 5.718
136 HA ARG 21 HA ARG 21 -10.463 -1.898 5.015
137 HB2 ARG 21 1HB ARG 21 -10.304 -0.668 7.180
138 HB3 ARG 21 2HB ARG 21 -10.223 0.838 6.275
139 HG2 ARG 21 1HG ARG 21 -12.450 0.200 5.265
140 HG3 ARG 21 2HG ARG 21 -12.524 -1.080 6.478
141 HD2 ARG 21 1HD ARG 21 -13.731 0.901 7.224
142 HD3 ARG 21 2HD ARG 21 -12.333 0.588 8.253
143 HE ARG 21 HE ARG 21 -12.710 2.830 6.446
144 HH11 ARG 21 2HH1 ARG 21 -10.543 1.023 8.485
145 HH12 ARG 21 1HH1 ARG 21 -9.404 2.319 8.644
146 HH21 ARG 21 2HH2 ARG 21 -11.218 4.543 6.647
147 HH22 ARG 21 1HH2 ARG 21 -9.789 4.321 7.599
148 H GLN 22 H GLN 22 -8.989 1.259 4.284
149 HA GLN 22 HA GLN 22 -10.741 1.476 1.939
150 HB2 GLN 22 1HB GLN 22 -8.999 3.594 3.210
151 HB3 GLN 22 2HB GLN 22 -10.155 3.841 1.908
152 HG2 GLN 22 1HG GLN 22 -11.880 2.909 3.601
153 HG3 GLN 22 2HG GLN 22 -10.654 3.311 4.802
154 HE21 GLN 22 1HE2 GLN 22 -13.370 4.418 4.127
155 HE22 GLN 22 2HE2 GLN 22 -13.115 6.121 3.986
156 H SER 23 H SER 23 -9.729 2.477 -0.024
157 HA SER 23 HA SER 23 -7.519 0.900 -0.853
158 HB2 SER 23 1HB SER 23 -7.660 2.253 -2.951
159 HB3 SER 23 2HB SER 23 -9.204 1.551 -2.466
160 HG SER 23 HG SER 23 -9.795 3.566 -1.622
161 H SER 24 H SER 24 -7.888 4.304 0.028
162 HA SER 24 HA SER 24 -5.319 5.174 -0.664
163 HB2 SER 24 1HB SER 24 -7.122 6.178 1.552
164 HB3 SER 24 2HB SER 24 -5.731 7.041 0.898
165 HG SER 24 HG SER 24 -6.795 7.127 -1.101
166 H CYS 25 H CYS 25 -6.564 4.054 2.478
167 HA CYS 25 HA CYS 25 -4.450 4.316 4.118
168 HB2 CYS 25 1HB CYS 25 -6.339 1.993 3.810
169 HB3 CYS 25 2HB CYS 25 -5.111 2.012 5.070
170 HG CYS 25 HG CYS 25 -8.080 3.227 5.215
171 H LEU 26 H LEU 26 -4.884 1.352 2.177
172 HA LEU 26 HA LEU 26 -2.393 0.242 2.657
173 HB2 LEU 26 1HB LEU 26 -4.062 -1.085 1.633
174 HB3 LEU 26 2HB LEU 26 -4.234 0.044 0.290
175 HG LEU 26 HG LEU 26 -1.966 -0.603 -0.481
176 HD11 LEU 26 1HD1 LEU 26 -0.842 -2.494 0.451
177 HD12 LEU 26 2HD1 LEU 26 -2.166 -2.794 1.577
178 HD13 LEU 26 3HD1 LEU 26 -1.165 -1.353 1.758
179 HD21 LEU 26 3HD2 LEU 26 -2.673 -3.020 -1.070
180 HD22 LEU 26 1HD2 LEU 26 -3.658 -1.676 -1.648
181 HD23 LEU 26 2HD2 LEU 26 -4.177 -2.609 -0.244
182 H SER 27 H SER 27 -3.309 1.921 -0.357
183 HA SER 27 HA SER 27 -0.876 2.119 -1.554
184 HB2 SER 27 1HB SER 27 -3.264 3.916 -1.531
185 HB3 SER 27 2HB SER 27 -1.793 4.484 -2.319
186 HG SER 27 HG SER 27 -3.525 3.079 -3.476
187 H LYS 28 H LYS 28 -2.205 4.813 0.370
188 HA LYS 28 HA LYS 28 0.007 6.386 0.564
189 HB2 LYS 28 1HB LYS 28 -2.304 6.815 1.520
190 HB3 LYS 28 2HB LYS 28 -1.810 5.870 2.919
191 HG2 LYS 28 1HG LYS 28 -1.375 8.001 3.637
192 HG3 LYS 28 2HG LYS 28 0.196 7.536 2.979
193 HD2 LYS 28 1HD LYS 28 -0.119 9.637 2.060
194 HD3 LYS 28 2HD LYS 28 -0.708 8.578 0.777
195 HE2 LYS 28 1HE LYS 28 -3.005 8.914 1.576
196 HE3 LYS 28 2HE LYS 28 -2.404 9.991 2.835
197 HZ1 LYS 28 3HZ LYS 28 -2.295 10.427 -0.097
198 HZ2 LYS 28 1HZ LYS 28 -1.487 11.402 1.026
199 HZ3 LYS 28 2HZ LYS 28 -3.176 11.317 1.041
200 H HIS 29 H HIS 29 -0.447 3.288 1.982
201 HA HIS 29 HA HIS 29 1.794 3.634 3.823
202 HB2 HIS 29 1HB HIS 29 0.243 2.401 4.971
203 HB3 HIS 29 2HB HIS 29 -0.399 1.651 3.512
204 HD1 HIS 29 1HD HIS 29 1.835 1.042 6.332
205 HD2 HIS 29 2HD HIS 29 1.270 -0.524 2.525
206 HE1 HIS 29 1HE HIS 29 3.025 -1.174 6.333
207 H GLN 30 H GLN 30 0.937 2.019 0.841
208 HA GLN 30 HA GLN 30 3.077 0.224 0.659
209 HB2 GLN 30 1HB GLN 30 1.592 1.651 -1.553
210 HB3 GLN 30 2HB GLN 30 2.649 0.264 -1.780
211 HG2 GLN 30 1HG GLN 30 1.028 -0.808 0.010
212 HG3 GLN 30 2HG GLN 30 -0.079 0.408 -0.628
213 HE21 GLN 30 1HE2 GLN 30 0.914 -2.696 -0.945
214 HE22 GLN 30 2HE2 GLN 30 0.449 -2.989 -2.582
215 H ARG 31 H ARG 31 2.832 3.637 -0.151
216 HA ARG 31 HA ARG 31 5.100 4.020 -1.661
217 HB2 ARG 31 1HB ARG 31 5.177 6.316 -0.597
218 HB3 ARG 31 2HB ARG 31 3.643 5.863 -1.327
219 HG2 ARG 31 1HG ARG 31 2.560 5.758 0.672
220 HG3 ARG 31 2HG ARG 31 4.016 5.310 1.563
221 HD2 ARG 31 1HD ARG 31 3.607 8.038 0.361
222 HD3 ARG 31 2HD ARG 31 3.100 7.629 1.999
223 HE ARG 31 HE ARG 31 5.812 8.000 1.050
224 HH11 ARG 31 2HH1 ARG 31 3.731 6.813 3.577
225 HH12 ARG 31 1HH1 ARG 31 4.964 6.862 4.794
226 HH21 ARG 31 2HH2 ARG 31 7.443 8.069 2.644
227 HH22 ARG 31 1HH2 ARG 31 7.074 7.577 4.262
228 H ILE 32 H ILE 32 4.882 3.057 1.616
229 HA ILE 32 HA ILE 32 7.389 4.006 2.542
230 HB ILE 32 HB ILE 32 7.081 2.666 4.444
231 HG12 ILE 32 1HG1 ILE 32 5.290 0.947 2.721
232 HG13 ILE 32 2HG1 ILE 32 6.833 0.496 3.438
233 HG21 ILE 32 1HG2 ILE 32 4.356 2.731 4.546
234 HG22 ILE 32 2HG2 ILE 32 5.416 4.100 4.876
235 HG23 ILE 32 3HG2 ILE 32 4.703 3.903 3.276
236 HD11 ILE 32 3HD1 ILE 32 4.147 0.687 4.669
237 HD12 ILE 32 1HD1 ILE 32 5.418 -0.515 4.894
238 HD13 ILE 32 2HD1 ILE 32 5.548 1.063 5.672
239 H HIS 33 H HIS 33 6.373 1.118 0.832
240 HA HIS 33 HA HIS 33 9.029 -0.062 1.046
241 HB2 HIS 33 1HB HIS 33 6.627 -1.127 -0.447
242 HB3 HIS 33 2HB HIS 33 8.077 -2.017 0.009
243 HD1 HIS 33 1HD HIS 33 8.415 -2.233 2.718
244 HD2 HIS 33 2HD HIS 33 4.600 -1.334 1.341
245 HE1 HIS 33 1HE HIS 33 6.865 -2.786 4.621
246 H SER 34 H SER 34 6.780 0.917 -1.539
247 HA SER 34 HA SER 34 7.122 1.525 -3.706
248 HB2 SER 34 1HB SER 34 8.288 3.404 -2.623
249 HB3 SER 34 2HB SER 34 9.785 2.473 -2.617
250 HG SER 34 HG SER 34 8.852 2.455 -5.089
251 H GLY 35 H GLY 35 7.637 -1.155 -3.177
252 HA2 GLY 35 1HA GLY 35 10.146 -1.874 -4.447
253 HA3 GLY 35 2HA GLY 35 8.935 -2.983 -3.824
254 H GLU 36 H GLU 36 9.251 -0.534 -6.398
255 HA GLU 36 HA GLU 36 7.408 -1.994 -8.081
256 HB2 GLU 36 1HB GLU 36 9.020 0.518 -8.550
257 HB3 GLU 36 2HB GLU 36 7.906 -0.167 -9.724
258 HG2 GLU 36 1HG GLU 36 6.187 -0.004 -7.776
259 HG3 GLU 36 2HG GLU 36 7.330 1.170 -7.125
260 H LYS 37 H LYS 37 7.974 -2.590 -10.306
261 HA LYS 37 HA LYS 37 10.229 -4.283 -10.386
262 HB2 LYS 37 1HB LYS 37 9.617 -4.697 -12.706
263 HB3 LYS 37 2HB LYS 37 8.182 -4.696 -11.690
264 HG2 LYS 37 1HG LYS 37 7.787 -2.330 -12.395
265 HG3 LYS 37 2HG LYS 37 9.107 -2.522 -13.550
266 HD2 LYS 37 1HD LYS 37 7.379 -3.097 -14.912
267 HD3 LYS 37 2HD LYS 37 7.687 -4.682 -14.198
268 HE2 LYS 37 1HE LYS 37 5.824 -2.882 -12.758
269 HE3 LYS 37 2HE LYS 37 5.259 -3.576 -14.277
270 HZ1 LYS 37 3HZ LYS 37 4.836 -4.855 -12.115
271 HZ2 LYS 37 1HZ LYS 37 6.470 -5.285 -12.200
272 HZ3 LYS 37 2HZ LYS 37 5.415 -5.718 -13.450
273 HA PRO 38 HA PRO 38 13.218 -1.112 -11.395
274 HB2 PRO 38 1HB PRO 38 15.362 -2.776 -11.382
275 HB3 PRO 38 2HB PRO 38 14.617 -2.159 -9.903
276 HG2 PRO 38 1HG PRO 38 14.264 -4.816 -11.236
277 HG3 PRO 38 2HG PRO 38 14.459 -4.446 -9.512
278 HD2 PRO 38 1HD PRO 38 12.046 -4.964 -10.627
279 HD3 PRO 38 2HD PRO 38 12.248 -3.847 -9.262
280 H SER 39 H SER 39 12.245 -0.932 -13.550
281 HA SER 39 HA SER 39 14.086 -1.835 -15.582
282 HB2 SER 39 1HB SER 39 12.402 -3.702 -15.348
283 HB3 SER 39 2HB SER 39 11.166 -2.563 -15.882
284 HG SER 39 HG SER 39 13.375 -2.626 -17.502
285 H GLY 40 H GLY 40 14.525 0.047 -16.527
286 HA2 GLY 40 1HA GLY 40 13.599 1.556 -18.277
287 HA3 GLY 40 2HA GLY 40 12.255 1.826 -17.178
288 HA PRO 41 HA PRO 41 15.279 5.275 -16.582
289 HB2 PRO 41 1HB PRO 41 13.391 7.224 -16.523
290 HB3 PRO 41 2HB PRO 41 14.109 6.627 -18.024
291 HG2 PRO 41 1HG PRO 41 11.486 5.920 -16.765
292 HG3 PRO 41 2HG PRO 41 11.859 6.243 -18.469
293 HD2 PRO 41 1HD PRO 41 11.591 3.734 -17.486
294 HD3 PRO 41 2HD PRO 41 12.699 4.125 -18.816
295 H SER 42 H SER 42 15.750 6.325 -14.676
296 HA SER 42 HA SER 42 14.838 5.272 -12.280
297 HB2 SER 42 1HB SER 42 16.299 7.801 -12.979
298 HB3 SER 42 2HB SER 42 15.806 7.495 -11.314
299 HG SER 42 HG SER 42 16.891 5.283 -12.007
300 H SER 43 H SER 43 13.896 6.704 -10.463
301 HA SER 43 HA SER 43 11.220 7.243 -11.064
302 HB2 SER 43 1HB SER 43 11.109 8.240 -8.798
303 HB3 SER 43 2HB SER 43 11.950 6.690 -8.802
304 HG SER 43 HG SER 43 13.119 9.274 -8.731
305 H GLY 44 H GLY 44 13.957 9.460 -10.604
306 HA2 GLY 44 1HA GLY 44 12.824 11.374 -12.405
307 HA3 GLY 44 2HA GLY 44 12.687 11.893 -10.732
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -26.121 -2.134 -6.923
2 HA2 GLY 1 1HA GLY 1 -27.174 -0.987 -8.746
3 HA3 GLY 1 2HA GLY 1 -26.152 0.206 -7.957
4 H SER 2 H SER 2 -26.106 1.311 -10.005
5 HA SER 2 HA SER 2 -25.392 0.488 -12.457
6 HB2 SER 2 1HB SER 2 -25.708 2.889 -11.609
7 HB3 SER 2 2HB SER 2 -23.983 2.862 -11.241
8 HG SER 2 HG SER 2 -23.938 3.555 -13.260
9 H SER 3 H SER 3 -23.000 1.283 -9.935
10 HA SER 3 HA SER 3 -20.881 0.070 -11.503
11 HB2 SER 3 1HB SER 3 -20.484 2.163 -10.225
12 HB3 SER 3 2HB SER 3 -20.769 1.277 -8.728
13 HG SER 3 HG SER 3 -18.598 1.176 -10.479
14 H GLY 4 H GLY 4 -19.781 -1.795 -11.004
15 HA2 GLY 4 1HA GLY 4 -21.234 -3.710 -9.394
16 HA3 GLY 4 2HA GLY 4 -19.811 -4.032 -10.372
17 H SER 5 H SER 5 -18.060 -4.570 -9.270
18 HA SER 5 HA SER 5 -17.660 -3.403 -6.599
19 HB2 SER 5 1HB SER 5 -18.475 -5.703 -6.327
20 HB3 SER 5 2HB SER 5 -17.181 -6.293 -7.369
21 HG SER 5 HG SER 5 -16.913 -5.036 -4.839
22 H SER 6 H SER 6 -15.483 -3.179 -5.930
23 HA SER 6 HA SER 6 -13.652 -2.815 -8.160
24 HB2 SER 6 1HB SER 6 -13.405 -2.058 -5.239
25 HB3 SER 6 2HB SER 6 -12.231 -1.652 -6.489
26 HG SER 6 HG SER 6 -13.430 0.023 -6.854
27 H GLY 7 H GLY 7 -13.731 -4.519 -5.039
28 HA2 GLY 7 1HA GLY 7 -12.181 -6.688 -6.093
29 HA3 GLY 7 2HA GLY 7 -11.246 -5.675 -5.003
30 H LYS 8 H LYS 8 -13.780 -8.017 -5.282
31 HA LYS 8 HA LYS 8 -15.032 -7.977 -2.857
32 HB2 LYS 8 1HB LYS 8 -15.311 -10.407 -3.076
33 HB3 LYS 8 2HB LYS 8 -15.586 -9.585 -4.607
34 HG2 LYS 8 1HG LYS 8 -13.610 -10.377 -5.532
35 HG3 LYS 8 2HG LYS 8 -12.905 -10.742 -3.956
36 HD2 LYS 8 1HD LYS 8 -14.426 -12.593 -3.657
37 HD3 LYS 8 2HD LYS 8 -15.274 -12.181 -5.149
38 HE2 LYS 8 1HE LYS 8 -13.067 -12.532 -6.339
39 HE3 LYS 8 2HE LYS 8 -12.469 -13.228 -4.833
40 HZ1 LYS 8 3HZ LYS 8 -14.486 -14.749 -4.996
41 HZ2 LYS 8 1HZ LYS 8 -13.209 -15.039 -6.067
42 HZ3 LYS 8 2HZ LYS 8 -14.601 -14.246 -6.607
43 H LYS 9 H LYS 9 -11.762 -9.022 -3.550
44 HA LYS 9 HA LYS 9 -11.340 -10.082 -0.895
45 HB2 LYS 9 1HB LYS 9 -9.521 -9.643 -3.260
46 HB3 LYS 9 2HB LYS 9 -8.933 -10.234 -1.711
47 HG2 LYS 9 1HG LYS 9 -10.586 -12.113 -1.916
48 HG3 LYS 9 2HG LYS 9 -10.884 -11.568 -3.568
49 HD2 LYS 9 1HD LYS 9 -8.147 -12.269 -2.522
50 HD3 LYS 9 2HD LYS 9 -9.205 -13.430 -3.326
51 HE2 LYS 9 1HE LYS 9 -8.227 -10.837 -4.517
52 HE3 LYS 9 2HE LYS 9 -7.561 -12.432 -4.863
53 HZ1 LYS 9 3HZ LYS 9 -9.040 -11.995 -6.598
54 HZ2 LYS 9 1HZ LYS 9 -10.229 -11.370 -5.569
55 HZ3 LYS 9 2HZ LYS 9 -9.904 -13.030 -5.576
56 HA PRO 10 HA PRO 10 -9.951 -6.426 1.101
57 HB2 PRO 10 1HB PRO 10 -8.068 -7.429 2.779
58 HB3 PRO 10 2HB PRO 10 -9.801 -7.676 3.023
59 HG2 PRO 10 1HG PRO 10 -7.775 -9.522 1.820
60 HG3 PRO 10 2HG PRO 10 -9.081 -9.886 2.963
61 HD2 PRO 10 1HD PRO 10 -9.284 -10.392 0.310
62 HD3 PRO 10 2HD PRO 10 -10.684 -9.946 1.307
63 H LEU 11 H LEU 11 -8.136 -4.996 1.384
64 HA LEU 11 HA LEU 11 -6.106 -5.377 -0.692
65 HB2 LEU 11 1HB LEU 11 -6.830 -2.899 0.864
66 HB3 LEU 11 2HB LEU 11 -5.705 -2.985 -0.490
67 HG LEU 11 HG LEU 11 -8.680 -3.473 -0.633
68 HD11 LEU 11 1HD1 LEU 11 -7.685 -1.085 -0.280
69 HD12 LEU 11 2HD1 LEU 11 -8.938 -1.358 -1.489
70 HD13 LEU 11 3HD1 LEU 11 -7.250 -1.231 -1.983
71 HD21 LEU 11 3HD2 LEU 11 -8.226 -3.381 -3.105
72 HD22 LEU 11 1HD2 LEU 11 -7.626 -4.820 -2.280
73 HD23 LEU 11 2HD2 LEU 11 -6.510 -3.526 -2.721
74 H VAL 12 H VAL 12 -4.381 -6.435 0.076
75 HA VAL 12 HA VAL 12 -3.195 -5.472 2.599
76 HB VAL 12 HB VAL 12 -3.818 -7.642 3.144
77 HG11 VAL 12 1HG1 VAL 12 -3.325 -8.200 0.273
78 HG12 VAL 12 2HG1 VAL 12 -3.124 -9.533 1.412
79 HG13 VAL 12 3HG1 VAL 12 -4.668 -8.685 1.308
80 HG21 VAL 12 3HG2 VAL 12 -1.796 -8.895 3.365
81 HG22 VAL 12 1HG2 VAL 12 -1.071 -8.071 1.984
82 HG23 VAL 12 2HG2 VAL 12 -1.379 -7.185 3.477
83 H CYS 13 H CYS 13 -1.037 -5.029 2.628
84 HA CYS 13 HA CYS 13 0.247 -4.497 0.153
85 HB2 CYS 13 1HB CYS 13 0.663 -3.145 2.158
86 HB3 CYS 13 2HB CYS 13 1.386 -4.538 2.956
87 H ASN 14 H ASN 14 1.260 -5.887 -1.119
88 HA ASN 14 HA ASN 14 1.859 -8.552 -0.282
89 HB2 ASN 14 1HB ASN 14 3.092 -8.425 -2.653
90 HB3 ASN 14 2HB ASN 14 1.344 -8.590 -2.509
91 HD21 ASN 14 1HD2 ASN 14 3.913 -6.183 -2.800
92 HD22 ASN 14 2HD2 ASN 14 2.983 -5.043 -3.707
93 H GLU 15 H GLU 15 3.553 -5.596 -0.198
94 HA GLU 15 HA GLU 15 6.207 -6.609 -0.410
95 HB2 GLU 15 1HB GLU 15 5.375 -4.090 1.024
96 HB3 GLU 15 2HB GLU 15 6.927 -4.442 0.277
97 HG2 GLU 15 1HG GLU 15 5.441 -4.664 -1.889
98 HG3 GLU 15 2HG GLU 15 4.362 -3.619 -0.967
99 H CYS 16 H CYS 16 4.062 -5.869 2.307
100 HA CYS 16 HA CYS 16 5.954 -7.269 4.081
101 HB2 CYS 16 1HB CYS 16 5.065 -5.918 5.928
102 HB3 CYS 16 2HB CYS 16 5.739 -4.898 4.661
103 H GLY 17 H GLY 17 2.569 -6.759 3.235
104 HA2 GLY 17 1HA GLY 17 1.034 -8.597 3.177
105 HA3 GLY 17 2HA GLY 17 1.961 -9.365 4.457
106 H LYS 18 H LYS 18 0.748 -6.040 4.281
107 HA LYS 18 HA LYS 18 -0.759 -6.565 6.755
108 HB2 LYS 18 1HB LYS 18 1.173 -4.802 6.596
109 HB3 LYS 18 2HB LYS 18 -0.052 -3.808 5.818
110 HG2 LYS 18 1HG LYS 18 -1.488 -4.066 7.798
111 HG3 LYS 18 2HG LYS 18 -0.210 -5.000 8.579
112 HD2 LYS 18 1HD LYS 18 1.276 -3.096 8.511
113 HD3 LYS 18 2HD LYS 18 0.089 -2.161 7.598
114 HE2 LYS 18 1HE LYS 18 -0.159 -1.404 9.792
115 HE3 LYS 18 2HE LYS 18 -1.472 -2.563 9.591
116 HZ1 LYS 18 3HZ LYS 18 0.819 -3.907 10.519
117 HZ2 LYS 18 1HZ LYS 18 -0.682 -3.728 11.280
118 HZ3 LYS 18 2HZ LYS 18 0.531 -2.574 11.521
119 H THR 19 H THR 19 -2.900 -6.522 6.649
120 HA THR 19 HA THR 19 -4.241 -5.821 4.214
121 HB THR 19 HB THR 19 -6.312 -6.419 5.414
122 HG1 THR 19 1HG THR 19 -6.204 -6.089 7.509
123 HG21 THR 19 3HG2 THR 19 -5.115 -8.755 6.292
124 HG22 THR 19 1HG2 THR 19 -4.006 -8.154 5.060
125 HG23 THR 19 2HG2 THR 19 -5.700 -8.435 4.659
126 H PHE 20 H PHE 20 -6.011 -4.294 4.065
127 HA PHE 20 HA PHE 20 -6.009 -2.134 6.032
128 HB2 PHE 20 1HB PHE 20 -5.356 -1.798 3.105
129 HB3 PHE 20 2HB PHE 20 -5.902 -0.464 4.116
130 HD1 PHE 20 1HD PHE 20 -3.225 -2.978 3.693
131 HD2 PHE 20 2HD PHE 20 -4.418 0.666 5.541
132 HE1 PHE 20 1HE PHE 20 -0.909 -2.599 4.434
133 HE2 PHE 20 2HE PHE 20 -2.104 1.051 6.284
134 HZ PHE 20 HZ PHE 20 -0.346 -0.582 5.730
135 H ARG 21 H ARG 21 -7.737 -0.458 5.404
136 HA ARG 21 HA ARG 21 -10.201 -1.873 5.061
137 HB2 ARG 21 1HB ARG 21 -9.503 1.027 5.467
138 HB3 ARG 21 2HB ARG 21 -11.156 0.509 5.170
139 HG2 ARG 21 1HG ARG 21 -11.063 -0.917 7.156
140 HG3 ARG 21 2HG ARG 21 -9.410 -0.378 7.457
141 HD2 ARG 21 1HD ARG 21 -11.754 1.502 7.272
142 HD3 ARG 21 2HD ARG 21 -11.209 0.787 8.788
143 HE ARG 21 HE ARG 21 -9.948 2.916 7.320
144 HH11 ARG 21 2HH1 ARG 21 -9.493 0.373 9.654
145 HH12 ARG 21 1HH1 ARG 21 -8.103 1.110 10.380
146 HH21 ARG 21 2HH2 ARG 21 -8.119 3.896 8.268
147 HH22 ARG 21 1HH2 ARG 21 -7.323 3.114 9.592
148 H GLN 22 H GLN 22 -8.820 0.904 3.291
149 HA GLN 22 HA GLN 22 -9.927 -0.216 0.816
150 HB2 GLN 22 1HB GLN 22 -10.604 2.094 0.132
151 HB3 GLN 22 2HB GLN 22 -11.542 1.430 1.463
152 HG2 GLN 22 1HG GLN 22 -10.356 2.764 3.052
153 HG3 GLN 22 2HG GLN 22 -9.223 3.310 1.817
154 HE21 GLN 22 1HE2 GLN 22 -12.752 3.121 2.189
155 HE22 GLN 22 2HE2 GLN 22 -13.062 4.743 1.683
156 H SER 23 H SER 23 -9.067 1.088 -1.128
157 HA SER 23 HA SER 23 -6.351 0.769 -1.345
158 HB2 SER 23 1HB SER 23 -6.496 2.345 -3.306
159 HB3 SER 23 2HB SER 23 -7.687 1.044 -3.324
160 HG SER 23 HG SER 23 -9.262 2.454 -2.831
161 H SER 24 H SER 24 -7.922 3.965 -1.115
162 HA SER 24 HA SER 24 -5.883 5.650 -0.848
163 HB2 SER 24 1HB SER 24 -7.232 7.086 0.482
164 HB3 SER 24 2HB SER 24 -8.360 6.145 -0.493
165 HG SER 24 HG SER 24 -8.758 6.367 1.883
166 H CYS 25 H CYS 25 -6.861 3.346 1.622
167 HA CYS 25 HA CYS 25 -4.997 4.303 3.580
168 HB2 CYS 25 1HB CYS 25 -7.233 2.849 3.798
169 HB3 CYS 25 2HB CYS 25 -6.068 1.532 3.742
170 HG CYS 25 HG CYS 25 -6.371 3.973 6.101
171 H LEU 26 H LEU 26 -5.199 1.165 1.890
172 HA LEU 26 HA LEU 26 -2.717 0.186 2.543
173 HB2 LEU 26 1HB LEU 26 -4.303 -1.200 1.430
174 HB3 LEU 26 2HB LEU 26 -4.321 -0.146 0.018
175 HG LEU 26 HG LEU 26 -2.001 -0.822 -0.481
176 HD11 LEU 26 1HD1 LEU 26 -1.025 -2.728 0.691
177 HD12 LEU 26 2HD1 LEU 26 -2.388 -2.745 1.809
178 HD13 LEU 26 3HD1 LEU 26 -1.285 -1.369 1.784
179 HD21 LEU 26 3HD2 LEU 26 -2.554 -2.893 -1.441
180 HD22 LEU 26 1HD2 LEU 26 -4.079 -2.011 -1.348
181 HD23 LEU 26 2HD2 LEU 26 -3.715 -3.270 -0.167
182 H SER 27 H SER 27 -3.547 2.137 -0.318
183 HA SER 27 HA SER 27 -1.057 2.253 -1.509
184 HB2 SER 27 1HB SER 27 -3.237 3.173 -2.414
185 HB3 SER 27 2HB SER 27 -2.977 4.586 -1.392
186 HG SER 27 HG SER 27 -0.787 3.931 -2.886
187 H LYS 28 H LYS 28 -2.415 4.785 0.609
188 HA LYS 28 HA LYS 28 -0.255 6.401 0.910
189 HB2 LYS 28 1HB LYS 28 -1.353 7.334 2.672
190 HB3 LYS 28 2HB LYS 28 -2.665 6.329 2.070
191 HG2 LYS 28 1HG LYS 28 -2.753 5.754 4.258
192 HG3 LYS 28 2HG LYS 28 -1.566 4.566 3.717
193 HD2 LYS 28 1HD LYS 28 0.129 6.500 4.296
194 HD3 LYS 28 2HD LYS 28 -1.187 7.032 5.345
195 HE2 LYS 28 1HE LYS 28 -0.160 4.209 5.372
196 HE3 LYS 28 2HE LYS 28 0.567 5.478 6.356
197 HZ1 LYS 28 3HZ LYS 28 -1.144 5.463 7.776
198 HZ2 LYS 28 1HZ LYS 28 -1.492 3.938 7.129
199 HZ3 LYS 28 2HZ LYS 28 -2.308 5.305 6.558
200 H HIS 29 H HIS 29 -0.637 3.193 2.166
201 HA HIS 29 HA HIS 29 1.720 3.448 3.872
202 HB2 HIS 29 1HB HIS 29 0.257 2.160 5.065
203 HB3 HIS 29 2HB HIS 29 -0.511 1.505 3.621
204 HD1 HIS 29 1HD HIS 29 1.794 0.629 6.267
205 HD2 HIS 29 2HD HIS 29 1.166 -0.561 2.337
206 HE1 HIS 29 1HE HIS 29 2.970 -1.581 6.038
207 H GLN 30 H GLN 30 0.708 2.092 0.834
208 HA GLN 30 HA GLN 30 2.834 0.275 0.456
209 HB2 GLN 30 1HB GLN 30 0.786 1.556 -1.267
210 HB3 GLN 30 2HB GLN 30 2.206 0.906 -2.075
211 HG2 GLN 30 1HG GLN 30 0.827 -0.822 -0.100
212 HG3 GLN 30 2HG GLN 30 0.038 -0.542 -1.652
213 HE21 GLN 30 1HE2 GLN 30 0.818 -3.054 -0.920
214 HE22 GLN 30 2HE2 GLN 30 2.140 -3.567 -1.907
215 H ARG 31 H ARG 31 2.731 3.672 0.431
216 HA ARG 31 HA ARG 31 4.961 4.041 -1.367
217 HB2 ARG 31 1HB ARG 31 4.715 6.368 -0.960
218 HB3 ARG 31 2HB ARG 31 3.087 5.707 -1.039
219 HG2 ARG 31 1HG ARG 31 2.663 6.116 1.149
220 HG3 ARG 31 2HG ARG 31 4.342 5.876 1.635
221 HD2 ARG 31 1HD ARG 31 3.182 8.286 0.242
222 HD3 ARG 31 2HD ARG 31 3.746 8.198 1.911
223 HE ARG 31 HE ARG 31 5.364 8.467 -0.463
224 HH11 ARG 31 2HH1 ARG 31 5.283 7.567 2.899
225 HH12 ARG 31 1HH1 ARG 31 6.979 7.822 3.143
226 HH21 ARG 31 2HH2 ARG 31 7.598 8.807 -0.155
227 HH22 ARG 31 1HH2 ARG 31 8.295 8.528 1.405
228 H ILE 32 H ILE 32 4.631 3.058 1.805
229 HA ILE 32 HA ILE 32 6.891 4.370 2.961
230 HB ILE 32 HB ILE 32 6.514 3.121 4.877
231 HG12 ILE 32 1HG1 ILE 32 5.172 1.006 3.178
232 HG13 ILE 32 2HG1 ILE 32 6.808 0.910 3.822
233 HG21 ILE 32 1HG2 ILE 32 4.161 3.907 3.382
234 HG22 ILE 32 2HG2 ILE 32 3.810 2.625 4.539
235 HG23 ILE 32 3HG2 ILE 32 4.541 4.132 5.089
236 HD11 ILE 32 3HD1 ILE 32 5.029 1.444 5.969
237 HD12 ILE 32 1HD1 ILE 32 4.392 0.096 5.028
238 HD13 ILE 32 2HD1 ILE 32 6.028 0.020 5.684
239 H HIS 33 H HIS 33 6.411 1.509 1.058
240 HA HIS 33 HA HIS 33 9.081 0.499 1.647
241 HB2 HIS 33 1HB HIS 33 7.005 -0.611 -0.251
242 HB3 HIS 33 2HB HIS 33 8.462 -1.427 0.306
243 HD1 HIS 33 1HD HIS 33 8.495 -1.772 3.052
244 HD2 HIS 33 2HD HIS 33 4.813 -1.224 1.208
245 HE1 HIS 33 1HE HIS 33 6.789 -2.634 4.687
246 H SER 34 H SER 34 7.249 1.916 -1.014
247 HA SER 34 HA SER 34 9.518 1.771 -2.812
248 HB2 SER 34 1HB SER 34 8.036 2.765 -4.463
249 HB3 SER 34 2HB SER 34 7.190 1.458 -3.636
250 HG SER 34 HG SER 34 5.860 3.278 -3.779
251 H GLY 35 H GLY 35 9.185 3.535 -0.241
252 HA2 GLY 35 1HA GLY 35 9.925 6.099 -1.498
253 HA3 GLY 35 2HA GLY 35 9.287 5.926 0.130
254 H GLU 36 H GLU 36 10.779 6.403 1.588
255 HA GLU 36 HA GLU 36 13.595 6.025 0.977
256 HB2 GLU 36 1HB GLU 36 12.167 7.319 3.301
257 HB3 GLU 36 2HB GLU 36 13.916 7.164 3.206
258 HG2 GLU 36 1HG GLU 36 13.500 9.319 2.455
259 HG3 GLU 36 2HG GLU 36 13.721 8.390 0.973
260 H LYS 37 H LYS 37 14.999 5.195 2.826
261 HA LYS 37 HA LYS 37 13.919 2.613 3.655
262 HB2 LYS 37 1HB LYS 37 16.281 2.068 4.189
263 HB3 LYS 37 2HB LYS 37 16.048 2.546 2.513
264 HG2 LYS 37 1HG LYS 37 17.064 4.629 2.848
265 HG3 LYS 37 2HG LYS 37 16.938 4.503 4.604
266 HD2 LYS 37 1HD LYS 37 18.585 2.591 2.968
267 HD3 LYS 37 2HD LYS 37 19.237 4.113 3.579
268 HE2 LYS 37 1HE LYS 37 18.774 3.442 5.852
269 HE3 LYS 37 2HE LYS 37 17.977 1.973 5.291
270 HZ1 LYS 37 3HZ LYS 37 20.447 1.927 6.077
271 HZ2 LYS 37 1HZ LYS 37 20.760 2.457 4.501
272 HZ3 LYS 37 2HZ LYS 37 19.954 0.993 4.756
273 HA PRO 38 HA PRO 38 13.347 3.851 7.843
274 HB2 PRO 38 1HB PRO 38 13.430 1.404 9.015
275 HB3 PRO 38 2HB PRO 38 12.051 1.967 8.063
276 HG2 PRO 38 1HG PRO 38 14.303 0.166 7.256
277 HG3 PRO 38 2HG PRO 38 12.570 0.014 6.911
278 HD2 PRO 38 1HD PRO 38 14.337 0.974 5.098
279 HD3 PRO 38 2HD PRO 38 12.654 1.531 5.178
280 H SER 39 H SER 39 15.022 4.941 8.715
281 HA SER 39 HA SER 39 17.590 3.641 9.110
282 HB2 SER 39 1HB SER 39 17.353 6.026 8.292
283 HB3 SER 39 2HB SER 39 16.807 6.447 9.915
284 HG SER 39 HG SER 39 18.998 5.083 10.262
285 H GLY 40 H GLY 40 18.566 3.273 11.097
286 HA2 GLY 40 1HA GLY 40 17.386 4.016 13.580
287 HA3 GLY 40 2HA GLY 40 16.999 2.349 13.180
288 HA PRO 41 HA PRO 41 21.153 2.655 15.368
289 HB2 PRO 41 1HB PRO 41 20.469 1.160 17.528
290 HB3 PRO 41 2HB PRO 41 20.253 2.913 17.466
291 HG2 PRO 41 1HG PRO 41 18.244 0.740 17.015
292 HG3 PRO 41 2HG PRO 41 18.071 2.252 17.924
293 HD2 PRO 41 1HD PRO 41 17.116 1.948 15.409
294 HD3 PRO 41 2HD PRO 41 17.715 3.503 16.022
295 H SER 42 H SER 42 22.531 0.785 16.013
296 HA SER 42 HA SER 42 22.657 -1.157 14.062
297 HB2 SER 42 1HB SER 42 24.224 -2.349 15.543
298 HB3 SER 42 2HB SER 42 24.541 -0.614 15.541
299 HG SER 42 HG SER 42 24.306 -1.971 17.642
300 H SER 43 H SER 43 21.390 -1.535 17.370
301 HA SER 43 HA SER 43 19.472 -3.491 16.421
302 HB2 SER 43 1HB SER 43 20.150 -5.248 17.956
303 HB3 SER 43 2HB SER 43 21.513 -4.829 16.918
304 HG SER 43 HG SER 43 21.353 -3.389 19.264
305 H GLY 44 H GLY 44 18.066 -4.258 18.306
306 HA2 GLY 44 1HA GLY 44 17.849 -2.158 20.363
307 HA3 GLY 44 2HA GLY 44 16.444 -2.608 19.407
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -23.630 -5.273 -12.562
2 HA2 GLY 1 1HA GLY 1 -23.188 -2.760 -13.790
3 HA3 GLY 1 2HA GLY 1 -22.628 -2.711 -12.125
4 H SER 2 H SER 2 -20.549 -2.284 -13.254
5 HA SER 2 HA SER 2 -19.124 -4.806 -13.600
6 HB2 SER 2 1HB SER 2 -19.335 -2.649 -15.683
7 HB3 SER 2 2HB SER 2 -17.903 -3.675 -15.597
8 HG SER 2 HG SER 2 -20.497 -4.783 -15.661
9 H SER 3 H SER 3 -17.197 -4.785 -12.622
10 HA SER 3 HA SER 3 -16.065 -2.172 -11.859
11 HB2 SER 3 1HB SER 3 -15.232 -3.249 -9.794
12 HB3 SER 3 2HB SER 3 -16.991 -3.302 -9.898
13 HG SER 3 HG SER 3 -15.750 -5.312 -9.312
14 H GLY 4 H GLY 4 -13.670 -2.433 -11.203
15 HA2 GLY 4 1HA GLY 4 -12.372 -4.071 -13.288
16 HA3 GLY 4 2HA GLY 4 -11.741 -2.546 -12.682
17 H SER 5 H SER 5 -11.676 -2.729 -10.056
18 HA SER 5 HA SER 5 -9.489 -4.404 -9.525
19 HB2 SER 5 1HB SER 5 -9.776 -3.731 -7.178
20 HB3 SER 5 2HB SER 5 -9.940 -2.344 -8.255
21 HG SER 5 HG SER 5 -11.759 -2.068 -7.239
22 H SER 6 H SER 6 -9.333 -6.172 -8.013
23 HA SER 6 HA SER 6 -10.966 -8.315 -8.557
24 HB2 SER 6 1HB SER 6 -9.906 -9.462 -6.741
25 HB3 SER 6 2HB SER 6 -8.706 -8.362 -7.420
26 HG SER 6 HG SER 6 -10.328 -7.739 -5.179
27 H GLY 7 H GLY 7 -11.211 -6.031 -5.855
28 HA2 GLY 7 1HA GLY 7 -13.078 -5.404 -4.645
29 HA3 GLY 7 2HA GLY 7 -14.044 -6.457 -5.669
30 H LYS 8 H LYS 8 -13.832 -8.823 -5.231
31 HA LYS 8 HA LYS 8 -14.643 -9.525 -2.738
32 HB2 LYS 8 1HB LYS 8 -12.949 -11.224 -4.579
33 HB3 LYS 8 2HB LYS 8 -13.930 -11.829 -3.252
34 HG2 LYS 8 1HG LYS 8 -15.104 -10.274 -5.536
35 HG3 LYS 8 2HG LYS 8 -14.901 -12.027 -5.581
36 HD2 LYS 8 1HD LYS 8 -16.433 -12.370 -3.857
37 HD3 LYS 8 2HD LYS 8 -16.313 -10.702 -3.292
38 HE2 LYS 8 1HE LYS 8 -18.351 -10.675 -4.361
39 HE3 LYS 8 2HE LYS 8 -17.277 -10.138 -5.651
40 HZ1 LYS 8 3HZ LYS 8 -17.889 -13.001 -5.347
41 HZ2 LYS 8 1HZ LYS 8 -17.427 -12.149 -6.733
42 HZ3 LYS 8 2HZ LYS 8 -18.995 -11.982 -6.123
43 H LYS 9 H LYS 9 -11.286 -9.921 -3.884
44 HA LYS 9 HA LYS 9 -10.253 -10.577 -1.332
45 HB2 LYS 9 1HB LYS 9 -8.876 -9.541 -3.815
46 HB3 LYS 9 2HB LYS 9 -8.032 -10.129 -2.388
47 HG2 LYS 9 1HG LYS 9 -8.655 -12.324 -2.762
48 HG3 LYS 9 2HG LYS 9 -10.027 -11.868 -3.775
49 HD2 LYS 9 1HD LYS 9 -8.456 -12.688 -5.295
50 HD3 LYS 9 2HD LYS 9 -8.263 -10.936 -5.393
51 HE2 LYS 9 1HE LYS 9 -6.073 -11.669 -5.258
52 HE3 LYS 9 2HE LYS 9 -6.446 -11.288 -3.577
53 HZ1 LYS 9 3HZ LYS 9 -5.369 -13.583 -4.333
54 HZ2 LYS 9 1HZ LYS 9 -7.002 -14.010 -4.438
55 HZ3 LYS 9 2HZ LYS 9 -6.369 -13.445 -2.976
56 HA PRO 10 HA PRO 10 -10.057 -6.583 0.537
57 HB2 PRO 10 1HB PRO 10 -8.275 -7.169 2.499
58 HB3 PRO 10 2HB PRO 10 -9.960 -7.702 2.541
59 HG2 PRO 10 1HG PRO 10 -7.512 -9.220 1.725
60 HG3 PRO 10 2HG PRO 10 -8.880 -9.754 2.718
61 HD2 PRO 10 1HD PRO 10 -8.640 -10.404 0.101
62 HD3 PRO 10 2HD PRO 10 -10.215 -10.164 0.884
63 H LEU 11 H LEU 11 -8.345 -4.997 1.283
64 HA LEU 11 HA LEU 11 -6.257 -4.880 -0.755
65 HB2 LEU 11 1HB LEU 11 -6.973 -2.740 1.230
66 HB3 LEU 11 2HB LEU 11 -6.100 -2.562 -0.291
67 HG LEU 11 HG LEU 11 -8.196 -3.111 -1.501
68 HD11 LEU 11 1HD1 LEU 11 -10.293 -2.761 -0.011
69 HD12 LEU 11 2HD1 LEU 11 -9.230 -3.279 1.297
70 HD13 LEU 11 3HD1 LEU 11 -9.524 -4.347 -0.076
71 HD21 LEU 11 3HD2 LEU 11 -7.855 -0.846 -1.480
72 HD22 LEU 11 1HD2 LEU 11 -7.913 -0.741 0.280
73 HD23 LEU 11 2HD2 LEU 11 -9.404 -0.941 -0.640
74 H VAL 12 H VAL 12 -4.515 -6.027 -0.126
75 HA VAL 12 HA VAL 12 -3.352 -5.377 2.504
76 HB VAL 12 HB VAL 12 -3.873 -7.607 2.793
77 HG11 VAL 12 1HG1 VAL 12 -3.643 -7.722 -0.135
78 HG12 VAL 12 2HG1 VAL 12 -3.155 -9.189 0.715
79 HG13 VAL 12 3HG1 VAL 12 -4.774 -8.531 0.949
80 HG21 VAL 12 3HG2 VAL 12 -1.396 -7.114 3.002
81 HG22 VAL 12 1HG2 VAL 12 -1.840 -8.811 2.821
82 HG23 VAL 12 2HG2 VAL 12 -1.201 -7.914 1.443
83 H CYS 13 H CYS 13 -1.151 -5.025 2.616
84 HA CYS 13 HA CYS 13 0.095 -4.083 0.226
85 HB2 CYS 13 1HB CYS 13 0.435 -3.091 2.505
86 HB3 CYS 13 2HB CYS 13 1.370 -4.521 2.932
87 H ASN 14 H ASN 14 0.954 -5.377 -1.251
88 HA ASN 14 HA ASN 14 1.670 -8.077 -0.754
89 HB2 ASN 14 1HB ASN 14 2.692 -6.572 -3.136
90 HB3 ASN 14 2HB ASN 14 2.111 -8.231 -3.032
91 HD21 ASN 14 1HD2 ASN 14 1.401 -5.856 -4.738
92 HD22 ASN 14 2HD2 ASN 14 -0.320 -5.747 -4.622
93 H GLU 15 H GLU 15 3.215 -5.306 0.115
94 HA GLU 15 HA GLU 15 5.926 -6.235 -0.378
95 HB2 GLU 15 1HB GLU 15 5.050 -3.807 1.189
96 HB3 GLU 15 2HB GLU 15 6.647 -4.128 0.527
97 HG2 GLU 15 1HG GLU 15 4.355 -4.025 -1.353
98 HG3 GLU 15 2HG GLU 15 4.936 -2.511 -0.662
99 H CYS 16 H CYS 16 3.769 -5.640 2.370
100 HA CYS 16 HA CYS 16 5.629 -7.175 4.064
101 HB2 CYS 16 1HB CYS 16 4.642 -5.970 5.989
102 HB3 CYS 16 2HB CYS 16 5.421 -4.883 4.843
103 H GLY 17 H GLY 17 2.257 -6.633 3.190
104 HA2 GLY 17 1HA GLY 17 0.746 -8.482 2.975
105 HA3 GLY 17 2HA GLY 17 1.648 -9.317 4.232
106 H LYS 18 H LYS 18 0.440 -5.990 4.249
107 HA LYS 18 HA LYS 18 -1.160 -6.686 6.621
108 HB2 LYS 18 1HB LYS 18 0.519 -5.095 7.209
109 HB3 LYS 18 2HB LYS 18 0.169 -4.106 5.797
110 HG2 LYS 18 1HG LYS 18 -2.005 -3.525 6.728
111 HG3 LYS 18 2HG LYS 18 -1.680 -4.539 8.135
112 HD2 LYS 18 1HD LYS 18 0.270 -3.125 8.668
113 HD3 LYS 18 2HD LYS 18 -0.128 -2.090 7.295
114 HE2 LYS 18 1HE LYS 18 -0.974 -1.082 9.309
115 HE3 LYS 18 2HE LYS 18 -2.332 -1.640 8.333
116 HZ1 LYS 18 3HZ LYS 18 -1.750 -2.285 10.977
117 HZ2 LYS 18 1HZ LYS 18 -1.542 -3.700 10.074
118 HZ3 LYS 18 2HZ LYS 18 -3.016 -2.872 10.021
119 H THR 19 H THR 19 -3.297 -6.580 6.464
120 HA THR 19 HA THR 19 -4.544 -5.700 4.034
121 HB THR 19 HB THR 19 -6.638 -6.409 5.034
122 HG1 THR 19 1HG THR 19 -5.419 -7.205 7.420
123 HG21 THR 19 3HG2 THR 19 -4.268 -8.104 4.966
124 HG22 THR 19 1HG2 THR 19 -5.892 -8.408 4.351
125 HG23 THR 19 2HG2 THR 19 -5.519 -8.719 6.047
126 H PHE 20 H PHE 20 -6.354 -4.172 3.985
127 HA PHE 20 HA PHE 20 -6.304 -2.116 6.062
128 HB2 PHE 20 1HB PHE 20 -5.780 -1.612 3.130
129 HB3 PHE 20 2HB PHE 20 -6.215 -0.343 4.269
130 HD1 PHE 20 1HD PHE 20 -3.647 -2.853 3.425
131 HD2 PHE 20 2HD PHE 20 -4.617 0.586 5.738
132 HE1 PHE 20 1HE PHE 20 -1.278 -2.602 4.040
133 HE2 PHE 20 2HE PHE 20 -2.250 0.842 6.356
134 HZ PHE 20 HZ PHE 20 -0.576 -0.752 5.506
135 H ARG 21 H ARG 21 -8.070 -0.468 5.681
136 HA ARG 21 HA ARG 21 -10.493 -1.905 4.924
137 HB2 ARG 21 1HB ARG 21 -10.038 0.678 6.420
138 HB3 ARG 21 2HB ARG 21 -11.634 0.074 5.996
139 HG2 ARG 21 1HG ARG 21 -11.057 -2.021 7.265
140 HG3 ARG 21 2HG ARG 21 -9.624 -1.171 7.849
141 HD2 ARG 21 1HD ARG 21 -11.113 -0.737 9.544
142 HD3 ARG 21 2HD ARG 21 -11.357 0.672 8.512
143 HE ARG 21 HE ARG 21 -13.207 -1.535 8.927
144 HH11 ARG 21 2HH1 ARG 21 -12.395 1.356 7.164
145 HH12 ARG 21 1HH1 ARG 21 -14.009 1.616 6.591
146 HH21 ARG 21 2HH2 ARG 21 -15.336 -1.203 8.179
147 HH22 ARG 21 1HH2 ARG 21 -15.681 0.160 7.170
148 H GLN 22 H GLN 22 -8.843 1.157 4.219
149 HA GLN 22 HA GLN 22 -10.578 1.472 1.863
150 HB2 GLN 22 1HB GLN 22 -8.937 3.565 3.300
151 HB3 GLN 22 2HB GLN 22 -9.987 3.850 1.918
152 HG2 GLN 22 1HG GLN 22 -11.876 2.964 3.361
153 HG3 GLN 22 2HG GLN 22 -10.759 3.102 4.718
154 HE21 GLN 22 1HE2 GLN 22 -10.743 4.956 5.766
155 HE22 GLN 22 2HE2 GLN 22 -11.338 6.465 5.171
156 H SER 23 H SER 23 -9.563 2.383 -0.076
157 HA SER 23 HA SER 23 -7.241 0.930 -0.795
158 HB2 SER 23 1HB SER 23 -7.389 2.194 -2.931
159 HB3 SER 23 2HB SER 23 -8.929 1.476 -2.460
160 HG SER 23 HG SER 23 -9.189 3.706 -1.404
161 H SER 24 H SER 24 -7.809 4.399 -0.255
162 HA SER 24 HA SER 24 -5.269 5.349 -0.803
163 HB2 SER 24 1HB SER 24 -7.275 6.760 -0.330
164 HB3 SER 24 2HB SER 24 -7.098 6.373 1.381
165 HG SER 24 HG SER 24 -5.843 8.252 -0.039
166 H CYS 25 H CYS 25 -6.518 3.897 2.157
167 HA CYS 25 HA CYS 25 -4.389 4.449 3.866
168 HB2 CYS 25 1HB CYS 25 -6.215 2.039 3.784
169 HB3 CYS 25 2HB CYS 25 -5.135 2.421 5.120
170 HG CYS 25 HG CYS 25 -6.543 5.105 5.157
171 H LEU 26 H LEU 26 -4.948 1.417 2.067
172 HA LEU 26 HA LEU 26 -2.500 0.227 2.637
173 HB2 LEU 26 1HB LEU 26 -4.214 -1.107 1.715
174 HB3 LEU 26 2HB LEU 26 -4.380 -0.056 0.310
175 HG LEU 26 HG LEU 26 -2.200 -0.825 -0.512
176 HD11 LEU 26 1HD1 LEU 26 -2.011 -3.119 1.271
177 HD12 LEU 26 2HD1 LEU 26 -1.739 -1.580 2.087
178 HD13 LEU 26 3HD1 LEU 26 -0.756 -2.024 0.692
179 HD21 LEU 26 3HD2 LEU 26 -4.152 -1.974 -1.306
180 HD22 LEU 26 1HD2 LEU 26 -4.196 -2.989 0.136
181 HD23 LEU 26 2HD2 LEU 26 -2.878 -3.161 -1.023
182 H SER 27 H SER 27 -3.393 1.819 -0.432
183 HA SER 27 HA SER 27 -0.911 1.827 -1.622
184 HB2 SER 27 1HB SER 27 -1.730 3.911 -2.828
185 HB3 SER 27 2HB SER 27 -2.794 2.508 -2.915
186 HG SER 27 HG SER 27 -3.090 4.878 -1.429
187 H LYS 28 H LYS 28 -2.315 4.499 0.280
188 HA LYS 28 HA LYS 28 -0.098 6.168 0.286
189 HB2 LYS 28 1HB LYS 28 -2.376 6.777 1.090
190 HB3 LYS 28 2HB LYS 28 -2.085 5.823 2.539
191 HG2 LYS 28 1HG LYS 28 -0.343 7.290 3.244
192 HG3 LYS 28 2HG LYS 28 -0.381 8.159 1.708
193 HD2 LYS 28 1HD LYS 28 -2.842 7.999 3.400
194 HD3 LYS 28 2HD LYS 28 -1.576 9.164 3.792
195 HE2 LYS 28 1HE LYS 28 -1.804 10.255 1.709
196 HE3 LYS 28 2HE LYS 28 -2.772 8.942 1.042
197 HZ1 LYS 28 3HZ LYS 28 -4.373 9.574 2.964
198 HZ2 LYS 28 1HZ LYS 28 -4.362 10.494 1.545
199 HZ3 LYS 28 2HZ LYS 28 -3.560 11.057 2.924
200 H HIS 29 H HIS 29 -0.467 3.142 1.762
201 HA HIS 29 HA HIS 29 1.600 3.657 3.766
202 HB2 HIS 29 1HB HIS 29 0.050 2.365 4.842
203 HB3 HIS 29 2HB HIS 29 -0.468 1.563 3.363
204 HD1 HIS 29 1HD HIS 29 1.646 1.121 6.312
205 HD2 HIS 29 2HD HIS 29 1.324 -0.567 2.530
206 HE1 HIS 29 1HE HIS 29 2.923 -1.042 6.430
207 H GLN 30 H GLN 30 1.008 1.813 0.832
208 HA GLN 30 HA GLN 30 3.248 0.169 0.830
209 HB2 GLN 30 1HB GLN 30 1.882 1.476 -1.529
210 HB3 GLN 30 2HB GLN 30 3.000 0.122 -1.630
211 HG2 GLN 30 1HG GLN 30 1.333 -1.031 -0.006
212 HG3 GLN 30 2HG GLN 30 0.208 0.197 -0.584
213 HE21 GLN 30 1HE2 GLN 30 1.031 -2.874 -1.007
214 HE22 GLN 30 2HE2 GLN 30 0.671 -3.081 -2.684
215 H ARG 31 H ARG 31 2.925 3.556 -0.022
216 HA ARG 31 HA ARG 31 5.253 4.031 -1.406
217 HB2 ARG 31 1HB ARG 31 5.194 6.320 -0.300
218 HB3 ARG 31 2HB ARG 31 3.739 5.827 -1.156
219 HG2 ARG 31 1HG ARG 31 2.515 5.602 0.766
220 HG3 ARG 31 2HG ARG 31 3.936 5.280 1.762
221 HD2 ARG 31 1HD ARG 31 4.524 7.768 1.047
222 HD3 ARG 31 2HD ARG 31 2.772 7.865 0.878
223 HE ARG 31 HE ARG 31 3.717 6.762 3.381
224 HH11 ARG 31 2HH1 ARG 31 2.700 9.601 1.642
225 HH12 ARG 31 1HH1 ARG 31 2.293 10.491 3.072
226 HH21 ARG 31 2HH2 ARG 31 3.185 7.923 5.271
227 HH22 ARG 31 1HH2 ARG 31 2.570 9.535 5.136
228 H ILE 32 H ILE 32 4.882 3.119 1.891
229 HA ILE 32 HA ILE 32 7.314 4.124 2.925
230 HB ILE 32 HB ILE 32 6.945 2.798 4.821
231 HG12 ILE 32 1HG1 ILE 32 5.150 1.017 3.158
232 HG13 ILE 32 2HG1 ILE 32 6.807 0.635 3.613
233 HG21 ILE 32 1HG2 ILE 32 4.195 2.749 4.709
234 HG22 ILE 32 2HG2 ILE 32 5.188 4.123 5.190
235 HG23 ILE 32 3HG2 ILE 32 4.626 3.983 3.525
236 HD11 ILE 32 3HD1 ILE 32 6.108 0.759 5.995
237 HD12 ILE 32 1HD1 ILE 32 4.443 0.946 5.443
238 HD13 ILE 32 2HD1 ILE 32 5.334 -0.531 5.074
239 H HIS 33 H HIS 33 6.469 1.180 1.210
240 HA HIS 33 HA HIS 33 9.116 0.047 1.589
241 HB2 HIS 33 1HB HIS 33 6.844 -0.986 -0.119
242 HB3 HIS 33 2HB HIS 33 8.273 -1.880 0.391
243 HD1 HIS 33 1HD HIS 33 8.448 -2.039 3.172
244 HD2 HIS 33 2HD HIS 33 4.707 -1.452 1.461
245 HE1 HIS 33 1HE HIS 33 6.789 -2.726 4.932
246 H SER 34 H SER 34 7.131 1.300 -1.072
247 HA SER 34 HA SER 34 8.685 0.846 -3.248
248 HB2 SER 34 1HB SER 34 7.230 3.411 -2.565
249 HB3 SER 34 2HB SER 34 7.838 3.006 -4.170
250 HG SER 34 HG SER 34 6.265 1.074 -2.979
251 H GLY 35 H GLY 35 9.097 3.556 -0.976
252 HA2 GLY 35 1HA GLY 35 11.477 4.493 -2.286
253 HA3 GLY 35 2HA GLY 35 10.831 5.070 -0.757
254 H GLU 36 H GLU 36 13.597 4.464 -1.503
255 HA GLU 36 HA GLU 36 14.145 2.453 0.577
256 HB2 GLU 36 1HB GLU 36 16.102 1.710 -0.695
257 HB3 GLU 36 2HB GLU 36 14.622 1.485 -1.617
258 HG2 GLU 36 1HG GLU 36 15.274 3.869 -2.555
259 HG3 GLU 36 2HG GLU 36 16.887 3.339 -2.082
260 H LYS 37 H LYS 37 15.896 2.842 1.923
261 HA LYS 37 HA LYS 37 16.708 5.627 2.077
262 HB2 LYS 37 1HB LYS 37 16.910 3.264 3.917
263 HB3 LYS 37 2HB LYS 37 17.884 4.700 4.208
264 HG2 LYS 37 1HG LYS 37 15.992 5.007 5.528
265 HG3 LYS 37 2HG LYS 37 15.683 5.995 4.097
266 HD2 LYS 37 1HD LYS 37 14.150 4.443 3.225
267 HD3 LYS 37 2HD LYS 37 14.700 3.163 4.309
268 HE2 LYS 37 1HE LYS 37 13.820 4.481 6.220
269 HE3 LYS 37 2HE LYS 37 13.173 5.650 5.071
270 HZ1 LYS 37 3HZ LYS 37 11.863 3.470 6.003
271 HZ2 LYS 37 1HZ LYS 37 12.408 2.944 4.490
272 HZ3 LYS 37 2HZ LYS 37 11.452 4.335 4.608
273 HA PRO 38 HA PRO 38 20.745 5.170 0.417
274 HB2 PRO 38 1HB PRO 38 22.165 6.893 1.962
275 HB3 PRO 38 2HB PRO 38 21.010 7.430 0.736
276 HG2 PRO 38 1HG PRO 38 20.652 7.185 3.698
277 HG3 PRO 38 2HG PRO 38 20.131 8.487 2.612
278 HD2 PRO 38 1HD PRO 38 18.440 6.569 3.503
279 HD3 PRO 38 2HD PRO 38 18.271 7.324 1.905
280 H SER 39 H SER 39 20.955 2.937 1.159
281 HA SER 39 HA SER 39 22.769 2.681 3.468
282 HB2 SER 39 1HB SER 39 21.944 0.288 3.559
283 HB3 SER 39 2HB SER 39 20.746 1.512 3.978
284 HG SER 39 HG SER 39 19.644 1.058 2.217
285 H GLY 40 H GLY 40 22.108 1.728 0.152
286 HA2 GLY 40 1HA GLY 40 24.190 -0.133 -0.174
287 HA3 GLY 40 2HA GLY 40 23.441 0.794 -1.465
288 HA PRO 41 HA PRO 41 27.494 2.547 -1.903
289 HB2 PRO 41 1HB PRO 41 26.856 4.273 -3.899
290 HB3 PRO 41 2HB PRO 41 27.081 2.539 -4.163
291 HG2 PRO 41 1HG PRO 41 24.543 4.092 -3.837
292 HG3 PRO 41 2HG PRO 41 24.923 2.798 -4.989
293 HD2 PRO 41 1HD PRO 41 23.485 2.366 -2.736
294 HD3 PRO 41 2HD PRO 41 24.557 1.135 -3.435
295 H SER 42 H SER 42 24.858 3.892 -0.474
296 HA SER 42 HA SER 42 26.264 6.438 0.003
297 HB2 SER 42 1HB SER 42 23.375 5.904 -0.562
298 HB3 SER 42 2HB SER 42 23.797 7.237 0.513
299 HG SER 42 HG SER 42 23.802 8.120 -1.480
300 H SER 43 H SER 43 26.026 7.353 2.103
301 HA SER 43 HA SER 43 25.439 5.331 4.159
302 HB2 SER 43 1HB SER 43 27.257 7.749 4.242
303 HB3 SER 43 2HB SER 43 26.918 6.714 5.629
304 HG SER 43 HG SER 43 28.716 5.848 4.789
305 H GLY 44 H GLY 44 24.639 6.209 6.261
306 HA2 GLY 44 1HA GLY 44 23.277 7.602 7.528
307 HA3 GLY 44 2HA GLY 44 23.237 8.736 6.187
Start of MODEL 19
1 H1 GLY 1 H GLY 1 -15.156 -17.524 -20.841
2 HA2 GLY 1 1HA GLY 1 -13.512 -15.813 -20.529
3 HA3 GLY 1 2HA GLY 1 -14.676 -14.919 -19.563
4 H SER 2 H SER 2 -14.384 -14.963 -17.440
5 HA SER 2 HA SER 2 -13.241 -17.341 -16.185
6 HB2 SER 2 1HB SER 2 -12.044 -14.578 -16.083
7 HB3 SER 2 2HB SER 2 -11.755 -15.753 -14.800
8 HG SER 2 HG SER 2 -11.379 -16.674 -17.382
9 H SER 3 H SER 3 -13.377 -17.216 -13.777
10 HA SER 3 HA SER 3 -15.515 -15.442 -12.835
11 HB2 SER 3 1HB SER 3 -16.455 -17.690 -13.505
12 HB3 SER 3 2HB SER 3 -15.475 -18.403 -12.224
13 HG SER 3 HG SER 3 -17.670 -17.874 -11.612
14 H GLY 4 H GLY 4 -14.927 -14.448 -11.027
15 HA2 GLY 4 1HA GLY 4 -12.525 -15.166 -9.649
16 HA3 GLY 4 2HA GLY 4 -13.636 -13.879 -9.203
17 H SER 5 H SER 5 -12.250 -15.894 -7.545
18 HA SER 5 HA SER 5 -13.975 -17.906 -6.666
19 HB2 SER 5 1HB SER 5 -11.511 -17.575 -6.081
20 HB3 SER 5 2HB SER 5 -12.060 -16.423 -4.864
21 HG SER 5 HG SER 5 -11.971 -18.329 -3.810
22 H SER 6 H SER 6 -13.578 -14.574 -5.508
23 HA SER 6 HA SER 6 -16.211 -14.808 -4.211
24 HB2 SER 6 1HB SER 6 -14.132 -14.749 -2.654
25 HB3 SER 6 2HB SER 6 -14.050 -13.042 -3.090
26 HG SER 6 HG SER 6 -16.014 -14.422 -1.638
27 H GLY 7 H GLY 7 -16.951 -12.435 -3.587
28 HA2 GLY 7 1HA GLY 7 -17.427 -11.095 -6.022
29 HA3 GLY 7 2HA GLY 7 -17.793 -10.469 -4.421
30 H LYS 8 H LYS 8 -15.695 -9.802 -3.184
31 HA LYS 8 HA LYS 8 -13.899 -8.393 -5.041
32 HB2 LYS 8 1HB LYS 8 -15.763 -6.994 -3.863
33 HB3 LYS 8 2HB LYS 8 -14.734 -7.145 -2.445
34 HG2 LYS 8 1HG LYS 8 -14.099 -5.118 -3.379
35 HG3 LYS 8 2HG LYS 8 -12.863 -6.242 -3.949
36 HD2 LYS 8 1HD LYS 8 -13.980 -6.434 -6.090
37 HD3 LYS 8 2HD LYS 8 -15.300 -5.408 -5.523
38 HE2 LYS 8 1HE LYS 8 -13.653 -3.575 -5.196
39 HE3 LYS 8 2HE LYS 8 -12.418 -4.608 -5.915
40 HZ1 LYS 8 3HZ LYS 8 -13.984 -2.892 -7.280
41 HZ2 LYS 8 1HZ LYS 8 -14.806 -4.354 -7.507
42 HZ3 LYS 8 2HZ LYS 8 -13.183 -4.216 -7.962
43 H LYS 9 H LYS 9 -11.808 -7.861 -4.171
44 HA LYS 9 HA LYS 9 -11.006 -9.679 -1.996
45 HB2 LYS 9 1HB LYS 9 -9.648 -8.816 -4.519
46 HB3 LYS 9 2HB LYS 9 -8.669 -9.270 -3.130
47 HG2 LYS 9 1HG LYS 9 -10.026 -11.427 -3.091
48 HG3 LYS 9 2HG LYS 9 -10.583 -10.962 -4.700
49 HD2 LYS 9 1HD LYS 9 -8.185 -10.782 -5.388
50 HD3 LYS 9 2HD LYS 9 -7.741 -11.457 -3.818
51 HE2 LYS 9 1HE LYS 9 -7.755 -13.310 -5.230
52 HE3 LYS 9 2HE LYS 9 -9.325 -13.385 -4.430
53 HZ1 LYS 9 3HZ LYS 9 -8.818 -13.321 -7.156
54 HZ2 LYS 9 1HZ LYS 9 -9.525 -11.832 -6.776
55 HZ3 LYS 9 2HZ LYS 9 -10.324 -13.270 -6.387
56 HA PRO 10 HA PRO 10 -9.861 -6.182 0.422
57 HB2 PRO 10 1HB PRO 10 -8.063 -7.374 2.071
58 HB3 PRO 10 2HB PRO 10 -9.807 -7.625 2.209
59 HG2 PRO 10 1HG PRO 10 -7.741 -9.361 0.913
60 HG3 PRO 10 2HG PRO 10 -9.100 -9.826 1.953
61 HD2 PRO 10 1HD PRO 10 -9.185 -10.053 -0.744
62 HD3 PRO 10 2HD PRO 10 -10.626 -9.696 0.230
63 H LEU 11 H LEU 11 -8.077 -4.783 0.891
64 HA LEU 11 HA LEU 11 -5.940 -4.994 -1.098
65 HB2 LEU 11 1HB LEU 11 -6.448 -2.611 0.644
66 HB3 LEU 11 2HB LEU 11 -5.672 -2.681 -0.937
67 HG LEU 11 HG LEU 11 -8.619 -3.099 -0.441
68 HD11 LEU 11 1HD1 LEU 11 -7.842 -0.791 0.030
69 HD12 LEU 11 2HD1 LEU 11 -8.949 -0.898 -1.338
70 HD13 LEU 11 3HD1 LEU 11 -7.219 -0.704 -1.618
71 HD21 LEU 11 3HD2 LEU 11 -8.810 -3.685 -2.582
72 HD22 LEU 11 1HD2 LEU 11 -7.060 -3.904 -2.578
73 HD23 LEU 11 2HD2 LEU 11 -7.755 -2.375 -3.115
74 H VAL 12 H VAL 12 -4.150 -5.965 -0.414
75 HA VAL 12 HA VAL 12 -3.143 -5.296 2.274
76 HB VAL 12 HB VAL 12 -3.734 -7.516 2.578
77 HG11 VAL 12 1HG1 VAL 12 -3.100 -7.798 -0.313
78 HG12 VAL 12 2HG1 VAL 12 -2.991 -9.229 0.713
79 HG13 VAL 12 3HG1 VAL 12 -4.511 -8.342 0.593
80 HG21 VAL 12 3HG2 VAL 12 -0.941 -7.787 1.479
81 HG22 VAL 12 1HG2 VAL 12 -1.321 -7.074 3.047
82 HG23 VAL 12 2HG2 VAL 12 -1.700 -8.767 2.733
83 H CYS 13 H CYS 13 -0.987 -4.853 2.464
84 HA CYS 13 HA CYS 13 0.401 -4.043 0.120
85 HB2 CYS 13 1HB CYS 13 0.757 -2.839 2.176
86 HB3 CYS 13 2HB CYS 13 1.292 -4.302 2.996
87 H ASN 14 H ASN 14 1.452 -5.313 -1.245
88 HA ASN 14 HA ASN 14 2.072 -8.029 -0.651
89 HB2 ASN 14 1HB ASN 14 2.548 -8.248 -2.884
90 HB3 ASN 14 2HB ASN 14 1.578 -6.780 -2.948
91 HD21 ASN 14 1HD2 ASN 14 3.978 -7.989 -4.461
92 HD22 ASN 14 2HD2 ASN 14 5.049 -6.644 -4.627
93 H GLU 15 H GLU 15 3.706 -5.088 -0.147
94 HA GLU 15 HA GLU 15 6.385 -6.062 -0.316
95 HB2 GLU 15 1HB GLU 15 5.546 -3.703 1.345
96 HB3 GLU 15 2HB GLU 15 7.055 -3.957 0.480
97 HG2 GLU 15 1HG GLU 15 5.405 -3.971 -1.601
98 HG3 GLU 15 2HG GLU 15 4.441 -2.984 -0.504
99 H CYS 16 H CYS 16 4.101 -5.530 2.341
100 HA CYS 16 HA CYS 16 5.888 -7.097 4.085
101 HB2 CYS 16 1HB CYS 16 5.042 -5.876 5.981
102 HB3 CYS 16 2HB CYS 16 5.568 -4.713 4.768
103 H GLY 17 H GLY 17 2.554 -6.490 3.110
104 HA2 GLY 17 1HA GLY 17 1.023 -8.311 2.815
105 HA3 GLY 17 2HA GLY 17 1.872 -9.181 4.084
106 H LYS 18 H LYS 18 0.690 -5.842 4.102
107 HA LYS 18 HA LYS 18 -0.944 -6.536 6.449
108 HB2 LYS 18 1HB LYS 18 0.959 -4.767 6.535
109 HB3 LYS 18 2HB LYS 18 -0.183 -3.732 5.689
110 HG2 LYS 18 1HG LYS 18 -1.803 -4.115 7.537
111 HG3 LYS 18 2HG LYS 18 -0.538 -4.994 8.398
112 HD2 LYS 18 1HD LYS 18 0.862 -3.004 8.412
113 HD3 LYS 18 2HD LYS 18 -0.357 -2.121 7.489
114 HE2 LYS 18 1HE LYS 18 -1.955 -2.575 9.379
115 HE3 LYS 18 2HE LYS 18 -0.580 -3.184 10.299
116 HZ1 LYS 18 3HZ LYS 18 0.385 -0.846 9.549
117 HZ2 LYS 18 1HZ LYS 18 -0.517 -1.042 10.967
118 HZ3 LYS 18 2HZ LYS 18 -1.259 -0.447 9.569
119 H THR 19 H THR 19 -3.076 -6.526 6.232
120 HA THR 19 HA THR 19 -4.303 -5.648 3.787
121 HB THR 19 HB THR 19 -6.403 -6.439 4.764
122 HG1 THR 19 1HG THR 19 -5.084 -7.318 7.080
123 HG21 THR 19 3HG2 THR 19 -5.137 -8.764 5.629
124 HG22 THR 19 1HG2 THR 19 -4.009 -8.043 4.480
125 HG23 THR 19 2HG2 THR 19 -5.665 -8.398 3.986
126 H PHE 20 H PHE 20 -5.991 -4.093 3.607
127 HA PHE 20 HA PHE 20 -6.136 -2.123 5.778
128 HB2 PHE 20 1HB PHE 20 -5.518 -1.569 2.877
129 HB3 PHE 20 2HB PHE 20 -6.095 -0.324 3.981
130 HD1 PHE 20 1HD PHE 20 -3.401 -2.863 3.610
131 HD2 PHE 20 2HD PHE 20 -4.579 0.894 5.226
132 HE1 PHE 20 1HE PHE 20 -1.091 -2.465 4.359
133 HE2 PHE 20 2HE PHE 20 -2.271 1.298 5.977
134 HZ PHE 20 HZ PHE 20 -0.523 -0.382 5.543
135 H ARG 21 H ARG 21 -7.933 -0.491 5.322
136 HA ARG 21 HA ARG 21 -10.280 -1.995 4.415
137 HB2 ARG 21 1HB ARG 21 -11.553 -0.203 5.645
138 HB3 ARG 21 2HB ARG 21 -10.520 -1.210 6.652
139 HG2 ARG 21 1HG ARG 21 -9.395 1.328 5.605
140 HG3 ARG 21 2HG ARG 21 -10.586 1.413 6.904
141 HD2 ARG 21 1HD ARG 21 -8.351 -0.526 7.175
142 HD3 ARG 21 2HD ARG 21 -7.991 1.186 7.390
143 HE ARG 21 HE ARG 21 -9.236 -0.484 9.265
144 HH11 ARG 21 2HH1 ARG 21 -9.574 2.693 7.881
145 HH12 ARG 21 1HH1 ARG 21 -10.322 3.369 9.289
146 HH21 ARG 21 2HH2 ARG 21 -10.219 0.396 11.126
147 HH22 ARG 21 1HH2 ARG 21 -10.688 2.062 11.135
148 H GLN 22 H GLN 22 -8.499 0.979 3.880
149 HA GLN 22 HA GLN 22 -10.263 1.557 1.591
150 HB2 GLN 22 1HB GLN 22 -8.728 3.500 3.325
151 HB3 GLN 22 2HB GLN 22 -9.612 3.940 1.870
152 HG2 GLN 22 1HG GLN 22 -10.983 2.549 4.135
153 HG3 GLN 22 2HG GLN 22 -10.724 4.292 4.160
154 HE21 GLN 22 1HE2 GLN 22 -12.880 4.805 4.040
155 HE22 GLN 22 2HE2 GLN 22 -13.832 4.545 2.622
156 H SER 23 H SER 23 -9.253 2.495 -0.282
157 HA SER 23 HA SER 23 -6.888 1.181 -1.045
158 HB2 SER 23 1HB SER 23 -8.223 3.589 -2.308
159 HB3 SER 23 2HB SER 23 -6.997 2.581 -3.077
160 HG SER 23 HG SER 23 -9.472 2.188 -3.317
161 H SER 24 H SER 24 -7.479 4.595 -0.237
162 HA SER 24 HA SER 24 -4.861 5.507 -0.597
163 HB2 SER 24 1HB SER 24 -6.826 6.993 -0.333
164 HB3 SER 24 2HB SER 24 -6.918 6.543 1.370
165 HG SER 24 HG SER 24 -5.611 8.529 0.484
166 H CYS 25 H CYS 25 -6.444 4.073 2.210
167 HA CYS 25 HA CYS 25 -4.473 4.547 4.123
168 HB2 CYS 25 1HB CYS 25 -6.877 3.427 4.255
169 HB3 CYS 25 2HB CYS 25 -5.932 1.945 4.161
170 HG CYS 25 HG CYS 25 -4.912 4.202 6.446
171 H LEU 26 H LEU 26 -4.810 1.890 1.808
172 HA LEU 26 HA LEU 26 -2.495 0.495 2.743
173 HB2 LEU 26 1HB LEU 26 -4.057 -0.874 1.707
174 HB3 LEU 26 2HB LEU 26 -4.304 0.253 0.375
175 HG LEU 26 HG LEU 26 -2.018 -0.345 -0.448
176 HD11 LEU 26 1HD1 LEU 26 -2.226 -2.571 1.573
177 HD12 LEU 26 2HD1 LEU 26 -1.160 -1.173 1.718
178 HD13 LEU 26 3HD1 LEU 26 -0.934 -2.321 0.398
179 HD21 LEU 26 3HD2 LEU 26 -4.203 -1.372 -1.230
180 HD22 LEU 26 1HD2 LEU 26 -3.794 -2.760 -0.222
181 HD23 LEU 26 2HD2 LEU 26 -2.736 -2.296 -1.555
182 H SER 27 H SER 27 -3.186 2.429 -0.167
183 HA SER 27 HA SER 27 -0.676 2.311 -1.339
184 HB2 SER 27 1HB SER 27 -2.726 4.534 -1.372
185 HB3 SER 27 2HB SER 27 -1.299 4.504 -2.409
186 HG SER 27 HG SER 27 -3.649 3.148 -2.646
187 H LYS 28 H LYS 28 -1.929 4.918 0.749
188 HA LYS 28 HA LYS 28 0.317 6.471 0.958
189 HB2 LYS 28 1HB LYS 28 -0.701 7.504 2.738
190 HB3 LYS 28 2HB LYS 28 -2.080 6.657 2.051
191 HG2 LYS 28 1HG LYS 28 -1.757 4.846 3.682
192 HG3 LYS 28 2HG LYS 28 -0.415 5.748 4.391
193 HD2 LYS 28 1HD LYS 28 -2.079 7.650 4.716
194 HD3 LYS 28 2HD LYS 28 -3.336 6.467 4.348
195 HE2 LYS 28 1HE LYS 28 -3.255 6.327 6.641
196 HE3 LYS 28 2HE LYS 28 -2.126 5.053 6.184
197 HZ1 LYS 28 3HZ LYS 28 -0.332 6.765 6.437
198 HZ2 LYS 28 1HZ LYS 28 -1.095 6.306 7.875
199 HZ3 LYS 28 2HZ LYS 28 -1.484 7.781 7.145
200 H HIS 29 H HIS 29 -0.266 3.355 2.376
201 HA HIS 29 HA HIS 29 2.100 3.557 4.075
202 HB2 HIS 29 1HB HIS 29 0.529 2.443 5.319
203 HB3 HIS 29 2HB HIS 29 -0.233 1.718 3.906
204 HD1 HIS 29 1HD HIS 29 2.114 1.009 6.612
205 HD2 HIS 29 2HD HIS 29 1.236 -0.572 2.872
206 HE1 HIS 29 1HE HIS 29 3.160 -1.278 6.586
207 H GLN 30 H GLN 30 1.014 2.112 1.107
208 HA GLN 30 HA GLN 30 3.026 0.146 0.842
209 HB2 GLN 30 1HB GLN 30 1.223 1.547 -1.111
210 HB3 GLN 30 2HB GLN 30 2.455 0.422 -1.665
211 HG2 GLN 30 1HG GLN 30 1.326 -1.129 0.160
212 HG3 GLN 30 2HG GLN 30 -0.056 -0.088 -0.180
213 HE21 GLN 30 1HE2 GLN 30 1.639 -2.808 -1.119
214 HE22 GLN 30 2HE2 GLN 30 0.921 -3.044 -2.673
215 H ARG 31 H ARG 31 3.160 3.520 0.696
216 HA ARG 31 HA ARG 31 5.453 3.608 -1.094
217 HB2 ARG 31 1HB ARG 31 5.263 5.961 -1.024
218 HB3 ARG 31 2HB ARG 31 3.609 5.363 -1.047
219 HG2 ARG 31 1HG ARG 31 3.330 5.802 1.271
220 HG3 ARG 31 2HG ARG 31 5.050 6.138 1.474
221 HD2 ARG 31 1HD ARG 31 3.720 8.196 1.411
222 HD3 ARG 31 2HD ARG 31 4.856 8.106 0.066
223 HE ARG 31 HE ARG 31 2.184 7.152 -0.503
224 HH11 ARG 31 2HH1 ARG 31 4.395 9.840 -0.557
225 HH12 ARG 31 1HH1 ARG 31 3.516 10.708 -1.772
226 HH21 ARG 31 2HH2 ARG 31 1.016 8.285 -2.102
227 HH22 ARG 31 1HH2 ARG 31 1.593 9.822 -2.649
228 H ILE 32 H ILE 32 4.899 3.042 2.151
229 HA ILE 32 HA ILE 32 7.108 4.416 3.306
230 HB ILE 32 HB ILE 32 6.601 3.355 5.300
231 HG12 ILE 32 1HG1 ILE 32 5.382 1.079 3.721
232 HG13 ILE 32 2HG1 ILE 32 6.965 1.056 4.491
233 HG21 ILE 32 1HG2 ILE 32 3.913 2.796 4.755
234 HG22 ILE 32 2HG2 ILE 32 4.597 4.309 5.347
235 HG23 ILE 32 3HG2 ILE 32 4.384 4.056 3.615
236 HD11 ILE 32 3HD1 ILE 32 4.661 1.692 6.221
237 HD12 ILE 32 1HD1 ILE 32 4.777 0.039 5.618
238 HD13 ILE 32 2HD1 ILE 32 6.104 0.733 6.551
239 H HIS 33 H HIS 33 6.713 1.359 1.692
240 HA HIS 33 HA HIS 33 9.297 0.362 2.550
241 HB2 HIS 33 1HB HIS 33 7.415 -0.780 0.477
242 HB3 HIS 33 2HB HIS 33 8.774 -1.607 1.234
243 HD1 HIS 33 1HD HIS 33 8.484 -1.863 3.962
244 HD2 HIS 33 2HD HIS 33 5.050 -1.230 1.712
245 HE1 HIS 33 1HE HIS 33 6.576 -2.596 5.427
246 H SER 34 H SER 34 7.794 1.573 -0.420
247 HA SER 34 HA SER 34 9.772 1.150 -2.260
248 HB2 SER 34 1HB SER 34 7.765 3.337 -1.899
249 HB3 SER 34 2HB SER 34 8.998 3.520 -3.146
250 HG SER 34 HG SER 34 6.851 2.360 -3.584
251 H GLY 35 H GLY 35 9.651 3.641 0.232
252 HA2 GLY 35 1HA GLY 35 11.568 5.413 -0.427
253 HA3 GLY 35 2HA GLY 35 11.423 4.776 1.205
254 H GLU 36 H GLU 36 13.836 5.635 -0.074
255 HA GLU 36 HA GLU 36 15.296 3.263 -0.833
256 HB2 GLU 36 1HB GLU 36 16.144 6.126 -0.387
257 HB3 GLU 36 2HB GLU 36 17.257 4.850 -0.859
258 HG2 GLU 36 1HG GLU 36 15.580 4.478 -2.810
259 HG3 GLU 36 2HG GLU 36 15.057 6.116 -2.423
260 H LYS 37 H LYS 37 14.095 3.748 1.946
261 HA LYS 37 HA LYS 37 16.393 3.809 3.685
262 HB2 LYS 37 1HB LYS 37 14.706 3.325 5.470
263 HB3 LYS 37 2HB LYS 37 14.364 4.769 4.525
264 HG2 LYS 37 1HG LYS 37 12.684 3.598 3.258
265 HG3 LYS 37 2HG LYS 37 13.084 2.081 4.068
266 HD2 LYS 37 1HD LYS 37 11.287 2.712 5.326
267 HD3 LYS 37 2HD LYS 37 12.567 3.528 6.228
268 HE2 LYS 37 1HE LYS 37 12.104 5.599 5.037
269 HE3 LYS 37 2HE LYS 37 10.867 4.790 4.077
270 HZ1 LYS 37 3HZ LYS 37 9.514 5.588 5.660
271 HZ2 LYS 37 1HZ LYS 37 10.749 5.763 6.803
272 HZ3 LYS 37 2HZ LYS 37 10.036 4.250 6.554
273 HA PRO 38 HA PRO 38 17.195 -0.549 3.235
274 HB2 PRO 38 1HB PRO 38 19.225 -0.646 5.035
275 HB3 PRO 38 2HB PRO 38 19.419 0.002 3.402
276 HG2 PRO 38 1HG PRO 38 18.999 1.461 5.982
277 HG3 PRO 38 2HG PRO 38 20.110 1.838 4.652
278 HD2 PRO 38 1HD PRO 38 17.747 3.117 4.983
279 HD3 PRO 38 2HD PRO 38 18.457 2.822 3.383
280 H SER 39 H SER 39 15.348 -1.465 4.130
281 HA SER 39 HA SER 39 14.672 -1.351 6.871
282 HB2 SER 39 1HB SER 39 13.868 -3.287 4.691
283 HB3 SER 39 2HB SER 39 13.174 -3.301 6.312
284 HG SER 39 HG SER 39 13.152 -1.058 4.573
285 H GLY 40 H GLY 40 16.436 -3.740 4.937
286 HA2 GLY 40 1HA GLY 40 17.755 -4.691 7.345
287 HA3 GLY 40 2HA GLY 40 16.742 -5.872 6.527
288 HA PRO 41 HA PRO 41 21.019 -5.047 4.388
289 HB2 PRO 41 1HB PRO 41 22.809 -6.298 6.001
290 HB3 PRO 41 2HB PRO 41 22.435 -4.576 6.134
291 HG2 PRO 41 1HG PRO 41 21.406 -6.869 7.760
292 HG3 PRO 41 2HG PRO 41 21.942 -5.267 8.299
293 HD2 PRO 41 1HD PRO 41 19.326 -5.911 8.019
294 HD3 PRO 41 2HD PRO 41 19.942 -4.270 7.735
295 H SER 42 H SER 42 19.059 -7.480 5.431
296 HA SER 42 HA SER 42 20.402 -9.853 4.934
297 HB2 SER 42 1HB SER 42 17.508 -9.099 4.515
298 HB3 SER 42 2HB SER 42 18.105 -10.745 4.301
299 HG SER 42 HG SER 42 17.365 -10.529 6.396
300 H SER 43 H SER 43 18.208 -8.250 2.621
301 HA SER 43 HA SER 43 19.077 -9.759 0.405
302 HB2 SER 43 1HB SER 43 17.794 -8.207 -0.946
303 HB3 SER 43 2HB SER 43 16.899 -8.549 0.534
304 HG SER 43 HG SER 43 18.629 -6.336 0.415
305 H GLY 44 H GLY 44 20.045 -6.604 1.664
306 HA2 GLY 44 1HA GLY 44 22.494 -6.170 1.348
307 HA3 GLY 44 2HA GLY 44 22.215 -6.564 -0.342
Start of MODEL 20
1 H1 GLY 1 H GLY 1 -21.646 -22.034 0.927
2 HA2 GLY 1 1HA GLY 1 -20.908 -19.872 0.658
3 HA3 GLY 1 2HA GLY 1 -19.502 -20.629 -0.075
4 H SER 2 H SER 2 -19.030 -19.765 -1.972
5 HA SER 2 HA SER 2 -21.252 -18.924 -3.717
6 HB2 SER 2 1HB SER 2 -18.531 -17.701 -3.278
7 HB3 SER 2 2HB SER 2 -19.490 -17.343 -4.714
8 HG SER 2 HG SER 2 -19.663 -16.109 -2.477
9 H SER 3 H SER 3 -21.461 -20.070 -5.511
10 HA SER 3 HA SER 3 -19.566 -22.046 -6.280
11 HB2 SER 3 1HB SER 3 -22.108 -22.076 -6.641
12 HB3 SER 3 2HB SER 3 -21.804 -21.033 -8.030
13 HG SER 3 HG SER 3 -21.808 -23.160 -8.719
14 H GLY 4 H GLY 4 -20.522 -18.915 -7.656
15 HA2 GLY 4 1HA GLY 4 -18.275 -19.112 -9.546
16 HA3 GLY 4 2HA GLY 4 -19.643 -18.019 -9.698
17 H SER 5 H SER 5 -19.064 -15.978 -9.440
18 HA SER 5 HA SER 5 -16.684 -15.308 -7.923
19 HB2 SER 5 1HB SER 5 -17.127 -14.235 -10.112
20 HB3 SER 5 2HB SER 5 -18.582 -13.500 -9.440
21 HG SER 5 HG SER 5 -17.384 -12.166 -8.247
22 H SER 6 H SER 6 -16.635 -14.447 -5.940
23 HA SER 6 HA SER 6 -19.134 -14.188 -4.492
24 HB2 SER 6 1HB SER 6 -17.686 -13.920 -2.505
25 HB3 SER 6 2HB SER 6 -17.277 -15.369 -3.424
26 HG SER 6 HG SER 6 -15.906 -12.889 -3.385
27 H GLY 7 H GLY 7 -16.286 -12.141 -5.131
28 HA2 GLY 7 1HA GLY 7 -17.695 -9.813 -5.696
29 HA3 GLY 7 2HA GLY 7 -17.398 -9.806 -3.964
30 H LYS 8 H LYS 8 -15.731 -8.560 -3.476
31 HA LYS 8 HA LYS 8 -13.408 -8.555 -5.290
32 HB2 LYS 8 1HB LYS 8 -12.935 -6.276 -4.452
33 HB3 LYS 8 2HB LYS 8 -14.488 -6.385 -5.270
34 HG2 LYS 8 1HG LYS 8 -15.673 -6.320 -3.216
35 HG3 LYS 8 2HG LYS 8 -14.190 -6.533 -2.282
36 HD2 LYS 8 1HD LYS 8 -14.624 -4.169 -4.090
37 HD3 LYS 8 2HD LYS 8 -15.155 -4.177 -2.407
38 HE2 LYS 8 1HE LYS 8 -12.760 -4.822 -1.827
39 HE3 LYS 8 2HE LYS 8 -12.356 -4.382 -3.485
40 HZ1 LYS 8 3HZ LYS 8 -12.397 -2.680 -1.391
41 HZ2 LYS 8 1HZ LYS 8 -13.905 -2.390 -2.101
42 HZ3 LYS 8 2HZ LYS 8 -12.492 -2.219 -3.016
43 H LYS 9 H LYS 9 -11.312 -8.336 -4.312
44 HA LYS 9 HA LYS 9 -11.189 -9.660 -1.705
45 HB2 LYS 9 1HB LYS 9 -9.064 -10.425 -2.285
46 HB3 LYS 9 2HB LYS 9 -9.929 -10.459 -3.816
47 HG2 LYS 9 1HG LYS 9 -8.782 -8.637 -4.657
48 HG3 LYS 9 2HG LYS 9 -8.321 -8.059 -3.054
49 HD2 LYS 9 1HD LYS 9 -6.341 -8.945 -3.910
50 HD3 LYS 9 2HD LYS 9 -6.966 -10.241 -2.888
51 HE2 LYS 9 1HE LYS 9 -7.447 -10.067 -5.858
52 HE3 LYS 9 2HE LYS 9 -6.113 -10.966 -5.136
53 HZ1 LYS 9 3HZ LYS 9 -8.163 -11.946 -3.760
54 HZ2 LYS 9 1HZ LYS 9 -7.604 -12.631 -5.202
55 HZ3 LYS 9 2HZ LYS 9 -8.945 -11.602 -5.220
56 HA PRO 10 HA PRO 10 -9.797 -6.112 0.474
57 HB2 PRO 10 1HB PRO 10 -8.083 -7.226 2.260
58 HB3 PRO 10 2HB PRO 10 -9.838 -7.407 2.372
59 HG2 PRO 10 1HG PRO 10 -7.803 -9.309 1.275
60 HG3 PRO 10 2HG PRO 10 -9.202 -9.643 2.312
61 HD2 PRO 10 1HD PRO 10 -9.230 -10.085 -0.360
62 HD3 PRO 10 2HD PRO 10 -10.680 -9.603 0.543
63 H LEU 11 H LEU 11 -8.000 -4.721 0.838
64 HA LEU 11 HA LEU 11 -5.840 -5.136 -1.081
65 HB2 LEU 11 1HB LEU 11 -6.445 -2.683 0.557
66 HB3 LEU 11 2HB LEU 11 -5.377 -2.795 -0.840
67 HG LEU 11 HG LEU 11 -8.371 -3.159 -0.928
68 HD11 LEU 11 1HD1 LEU 11 -7.897 -0.879 -0.374
69 HD12 LEU 11 2HD1 LEU 11 -8.332 -0.956 -2.081
70 HD13 LEU 11 3HD1 LEU 11 -6.641 -0.788 -1.609
71 HD21 LEU 11 3HD2 LEU 11 -8.116 -3.098 -3.317
72 HD22 LEU 11 1HD2 LEU 11 -7.067 -4.359 -2.667
73 HD23 LEU 11 2HD2 LEU 11 -6.382 -2.813 -3.168
74 H VAL 12 H VAL 12 -4.086 -6.137 -0.357
75 HA VAL 12 HA VAL 12 -3.049 -5.394 2.298
76 HB VAL 12 HB VAL 12 -3.816 -7.567 2.687
77 HG11 VAL 12 1HG1 VAL 12 -3.091 -8.007 -0.148
78 HG12 VAL 12 2HG1 VAL 12 -2.962 -9.395 0.935
79 HG13 VAL 12 3HG1 VAL 12 -4.501 -8.550 0.762
80 HG21 VAL 12 3HG2 VAL 12 -1.404 -7.173 3.258
81 HG22 VAL 12 1HG2 VAL 12 -1.856 -8.867 3.066
82 HG23 VAL 12 2HG2 VAL 12 -0.981 -8.036 1.780
83 H CYS 13 H CYS 13 -0.933 -4.889 2.399
84 HA CYS 13 HA CYS 13 0.506 -4.363 0.033
85 HB2 CYS 13 1HB CYS 13 0.853 -3.112 2.126
86 HB3 CYS 13 2HB CYS 13 1.526 -4.556 2.876
87 H ASN 14 H ASN 14 1.535 -5.736 -1.245
88 HA ASN 14 HA ASN 14 2.024 -8.447 -0.475
89 HB2 ASN 14 1HB ASN 14 1.417 -7.929 -2.771
90 HB3 ASN 14 2HB ASN 14 2.837 -6.902 -2.947
91 HD21 ASN 14 1HD2 ASN 14 4.370 -7.814 -4.084
92 HD22 ASN 14 2HD2 ASN 14 4.764 -9.496 -4.113
93 H GLU 15 H GLU 15 3.711 -5.602 0.028
94 HA GLU 15 HA GLU 15 6.373 -6.704 -0.169
95 HB2 GLU 15 1HB GLU 15 5.610 -4.135 1.207
96 HB3 GLU 15 2HB GLU 15 7.155 -4.565 0.486
97 HG2 GLU 15 1HG GLU 15 5.758 -4.711 -1.714
98 HG3 GLU 15 2HG GLU 15 4.630 -3.688 -0.826
99 H CYS 16 H CYS 16 4.124 -5.801 2.415
100 HA CYS 16 HA CYS 16 5.847 -7.248 4.318
101 HB2 CYS 16 1HB CYS 16 4.884 -5.842 6.086
102 HB3 CYS 16 2HB CYS 16 5.669 -4.863 4.851
103 H GLY 17 H GLY 17 2.539 -6.657 3.252
104 HA2 GLY 17 1HA GLY 17 0.953 -8.445 3.126
105 HA3 GLY 17 2HA GLY 17 1.781 -9.226 4.465
106 H LYS 18 H LYS 18 0.693 -5.866 4.198
107 HA LYS 18 HA LYS 18 -0.943 -6.306 6.603
108 HB2 LYS 18 1HB LYS 18 1.005 -4.557 6.455
109 HB3 LYS 18 2HB LYS 18 -0.186 -3.586 5.600
110 HG2 LYS 18 1HG LYS 18 -1.686 -3.729 7.524
111 HG3 LYS 18 2HG LYS 18 -0.489 -4.702 8.382
112 HD2 LYS 18 1HD LYS 18 1.113 -2.757 8.032
113 HD3 LYS 18 2HD LYS 18 -0.301 -1.817 7.549
114 HE2 LYS 18 1HE LYS 18 -0.015 -3.259 10.182
115 HE3 LYS 18 2HE LYS 18 0.316 -1.544 9.940
116 HZ1 LYS 18 3HZ LYS 18 -1.905 -1.079 9.592
117 HZ2 LYS 18 1HZ LYS 18 -1.982 -2.260 10.801
118 HZ3 LYS 18 2HZ LYS 18 -2.301 -2.674 9.192
119 H THR 19 H THR 19 -3.064 -6.380 6.330
120 HA THR 19 HA THR 19 -4.273 -5.577 3.841
121 HB THR 19 HB THR 19 -6.375 -6.400 4.820
122 HG1 THR 19 1HG THR 19 -6.090 -7.460 6.962
123 HG21 THR 19 3HG2 THR 19 -5.472 -8.244 3.882
124 HG22 THR 19 1HG2 THR 19 -5.239 -8.753 5.554
125 HG23 THR 19 2HG2 THR 19 -3.911 -8.003 4.666
126 H PHE 20 H PHE 20 -5.969 -4.052 3.609
127 HA PHE 20 HA PHE 20 -6.302 -2.124 5.787
128 HB2 PHE 20 1HB PHE 20 -5.555 -1.375 2.952
129 HB3 PHE 20 2HB PHE 20 -5.994 -0.237 4.221
130 HD1 PHE 20 2HD PHE 20 -4.494 0.133 6.127
131 HD2 PHE 20 1HD PHE 20 -3.395 -2.377 2.870
132 HE1 PHE 20 2HE PHE 20 -2.143 0.242 6.842
133 HE2 PHE 20 1HE PHE 20 -1.041 -2.272 3.580
134 HZ PHE 20 HZ PHE 20 -0.412 -0.961 5.567
135 H ARG 21 H ARG 21 -8.177 -0.755 5.552
136 HA ARG 21 HA ARG 21 -10.356 -2.160 4.252
137 HB2 ARG 21 1HB ARG 21 -10.425 0.329 5.967
138 HB3 ARG 21 2HB ARG 21 -11.810 -0.638 5.478
139 HG2 ARG 21 1HG ARG 21 -9.589 -1.903 7.018
140 HG3 ARG 21 2HG ARG 21 -10.798 -0.922 7.850
141 HD2 ARG 21 1HD ARG 21 -11.455 -3.234 6.032
142 HD3 ARG 21 2HD ARG 21 -11.305 -3.369 7.783
143 HE ARG 21 HE ARG 21 -13.172 -1.361 6.880
144 HH11 ARG 21 2HH1 ARG 21 -12.714 -4.684 7.814
145 HH12 ARG 21 1HH1 ARG 21 -14.377 -4.933 8.228
146 HH21 ARG 21 2HH2 ARG 21 -15.365 -1.677 7.423
147 HH22 ARG 21 1HH2 ARG 21 -15.885 -3.222 8.005
148 H GLN 22 H GLN 22 -8.948 1.105 4.205
149 HA GLN 22 HA GLN 22 -10.511 1.744 1.821
150 HB2 GLN 22 1HB GLN 22 -8.666 3.502 3.448
151 HB3 GLN 22 2HB GLN 22 -9.721 4.035 2.146
152 HG2 GLN 22 1HG GLN 22 -11.674 3.401 3.449
153 HG3 GLN 22 2HG GLN 22 -10.630 2.827 4.748
154 HE21 GLN 22 1HE2 GLN 22 -11.000 4.193 6.364
155 HE22 GLN 22 2HE2 GLN 22 -10.865 5.913 6.272
156 H SER 23 H SER 23 -9.512 2.586 -0.084
157 HA SER 23 HA SER 23 -7.245 1.107 -0.911
158 HB2 SER 23 1HB SER 23 -8.829 3.346 -2.154
159 HB3 SER 23 2HB SER 23 -7.387 2.702 -2.938
160 HG SER 23 HG SER 23 -9.705 1.758 -3.265
161 H SER 24 H SER 24 -7.694 4.389 0.243
162 HA SER 24 HA SER 24 -5.117 5.346 -0.467
163 HB2 SER 24 1HB SER 24 -7.031 6.840 0.027
164 HB3 SER 24 2HB SER 24 -6.970 6.335 1.716
165 HG SER 24 HG SER 24 -5.784 8.354 0.921
166 H CYS 25 H CYS 25 -6.385 3.596 2.273
167 HA CYS 25 HA CYS 25 -4.356 4.067 4.134
168 HB2 CYS 25 1HB CYS 25 -6.222 1.746 3.698
169 HB3 CYS 25 2HB CYS 25 -5.038 1.738 4.999
170 HG CYS 25 HG CYS 25 -6.744 2.759 6.622
171 H LEU 26 H LEU 26 -4.669 1.445 1.749
172 HA LEU 26 HA LEU 26 -2.179 0.243 2.371
173 HB2 LEU 26 1HB LEU 26 -3.764 -1.118 1.301
174 HB3 LEU 26 2HB LEU 26 -4.045 0.068 0.027
175 HG LEU 26 HG LEU 26 -1.649 -0.414 -0.715
176 HD11 LEU 26 1HD1 LEU 26 -0.688 -1.547 1.079
177 HD12 LEU 26 2HD1 LEU 26 -1.007 -2.820 -0.098
178 HD13 LEU 26 3HD1 LEU 26 -2.083 -2.606 1.283
179 HD21 LEU 26 3HD2 LEU 26 -2.507 -1.785 -2.277
180 HD22 LEU 26 1HD2 LEU 26 -4.039 -1.443 -1.472
181 HD23 LEU 26 2HD2 LEU 26 -3.148 -2.915 -1.084
182 H SER 27 H SER 27 -3.177 2.264 -0.393
183 HA SER 27 HA SER 27 -0.709 2.473 -1.638
184 HB2 SER 27 1HB SER 27 -3.023 3.311 -2.420
185 HB3 SER 27 2HB SER 27 -2.636 4.786 -1.534
186 HG SER 27 HG SER 27 -1.664 5.308 -3.326
187 H LYS 28 H LYS 28 -2.159 4.849 0.596
188 HA LYS 28 HA LYS 28 0.068 6.508 0.821
189 HB2 LYS 28 1HB LYS 28 -2.131 7.190 1.602
190 HB3 LYS 28 2HB LYS 28 -2.112 5.939 2.837
191 HG2 LYS 28 1HG LYS 28 0.107 7.898 2.863
192 HG3 LYS 28 2HG LYS 28 -1.491 8.469 3.348
193 HD2 LYS 28 1HD LYS 28 -0.292 5.964 4.494
194 HD3 LYS 28 2HD LYS 28 0.053 7.555 5.176
195 HE2 LYS 28 1HE LYS 28 -1.752 7.002 6.449
196 HE3 LYS 28 2HE LYS 28 -2.591 7.747 5.088
197 HZ1 LYS 28 3HZ LYS 28 -2.039 4.879 4.944
198 HZ2 LYS 28 1HZ LYS 28 -3.358 5.756 4.350
199 HZ3 LYS 28 2HZ LYS 28 -3.260 5.388 5.998
200 H HIS 29 H HIS 29 -0.313 3.340 1.891
201 HA HIS 29 HA HIS 29 1.630 3.616 4.060
202 HB2 HIS 29 1HB HIS 29 0.071 2.160 4.873
203 HB3 HIS 29 2HB HIS 29 -0.374 1.574 3.273
204 HD1 HIS 29 1HD HIS 29 1.581 0.705 6.226
205 HD2 HIS 29 2HD HIS 29 1.523 -0.374 2.214
206 HE1 HIS 29 1HE HIS 29 2.894 -1.435 6.086
207 H GLN 30 H GLN 30 1.240 2.167 0.879
208 HA GLN 30 HA GLN 30 3.524 0.583 0.791
209 HB2 GLN 30 1HB GLN 30 2.034 2.078 -1.357
210 HB3 GLN 30 2HB GLN 30 3.425 1.066 -1.723
211 HG2 GLN 30 1HG GLN 30 1.129 -0.040 -0.167
212 HG3 GLN 30 2HG GLN 30 1.039 0.091 -1.923
213 HE21 GLN 30 1HE2 GLN 30 0.898 -2.195 -2.004
214 HE22 GLN 30 2HE2 GLN 30 2.311 -3.175 -1.837
215 H ARG 31 H ARG 31 3.140 4.042 0.344
216 HA ARG 31 HA ARG 31 5.511 4.749 -0.846
217 HB2 ARG 31 1HB ARG 31 5.340 6.874 0.521
218 HB3 ARG 31 2HB ARG 31 3.915 6.450 -0.419
219 HG2 ARG 31 1HG ARG 31 2.871 5.528 1.598
220 HG3 ARG 31 2HG ARG 31 4.293 5.994 2.533
221 HD2 ARG 31 1HD ARG 31 2.427 7.608 2.726
222 HD3 ARG 31 2HD ARG 31 3.898 8.322 2.065
223 HE ARG 31 HE ARG 31 1.384 7.898 0.680
224 HH11 ARG 31 2HH1 ARG 31 4.767 8.685 0.453
225 HH12 ARG 31 1HH1 ARG 31 4.620 9.445 -1.097
226 HH21 ARG 31 2HH2 ARG 31 1.177 8.896 -1.361
227 HH22 ARG 31 1HH2 ARG 31 2.577 9.565 -2.127
228 H ILE 32 H ILE 32 5.030 3.394 2.278
229 HA ILE 32 HA ILE 32 7.407 4.308 3.524
230 HB ILE 32 HB ILE 32 6.968 2.794 5.251
231 HG12 ILE 32 1HG1 ILE 32 5.335 1.165 3.292
232 HG13 ILE 32 2HG1 ILE 32 6.942 0.753 3.880
233 HG21 ILE 32 1HG2 ILE 32 4.685 4.068 3.979
234 HG22 ILE 32 2HG2 ILE 32 4.228 2.709 5.004
235 HG23 ILE 32 3HG2 ILE 32 5.168 4.042 5.675
236 HD11 ILE 32 3HD1 ILE 32 4.558 -0.088 4.944
237 HD12 ILE 32 1HD1 ILE 32 6.131 -0.152 5.738
238 HD13 ILE 32 2HD1 ILE 32 5.049 1.210 6.031
239 H HIS 33 H HIS 33 6.648 1.577 1.455
240 HA HIS 33 HA HIS 33 9.292 0.420 1.805
241 HB2 HIS 33 1HB HIS 33 7.065 -0.434 -0.056
242 HB3 HIS 33 2HB HIS 33 8.503 -1.364 0.355
243 HD1 HIS 33 1HD HIS 33 8.655 -1.742 3.154
244 HD2 HIS 33 2HD HIS 33 4.932 -1.226 1.383
245 HE1 HIS 33 1HE HIS 33 6.995 -2.686 4.791
246 H SER 34 H SER 34 7.355 1.726 -0.886
247 HA SER 34 HA SER 34 9.303 1.604 -2.862
248 HB2 SER 34 1HB SER 34 8.003 3.328 -4.033
249 HB3 SER 34 2HB SER 34 6.937 2.120 -3.316
250 HG SER 34 HG SER 34 7.382 4.785 -2.560
251 H GLY 35 H GLY 35 8.584 4.237 -0.586
252 HA2 GLY 35 1HA GLY 35 10.120 5.728 0.348
253 HA3 GLY 35 2HA GLY 35 11.343 5.128 -0.763
254 H GLU 36 H GLU 36 9.429 7.727 -0.007
255 HA GLU 36 HA GLU 36 9.310 8.733 -2.755
256 HB2 GLU 36 1HB GLU 36 7.251 9.090 -1.696
257 HB3 GLU 36 2HB GLU 36 8.007 9.561 -0.180
258 HG2 GLU 36 1HG GLU 36 8.495 11.693 -0.934
259 HG3 GLU 36 2HG GLU 36 8.377 11.229 -2.630
260 H LYS 37 H LYS 37 11.667 8.534 -0.705
261 HA LYS 37 HA LYS 37 12.482 11.249 -0.315
262 HB2 LYS 37 1HB LYS 37 13.175 9.230 1.077
263 HB3 LYS 37 2HB LYS 37 14.268 8.820 -0.238
264 HG2 LYS 37 1HG LYS 37 15.325 11.059 0.033
265 HG3 LYS 37 2HG LYS 37 14.317 11.302 1.462
266 HD2 LYS 37 1HD LYS 37 16.228 8.997 1.102
267 HD3 LYS 37 2HD LYS 37 16.618 10.485 1.966
268 HE2 LYS 37 1HE LYS 37 14.258 8.762 2.679
269 HE3 LYS 37 2HE LYS 37 15.860 8.511 3.372
270 HZ1 LYS 37 3HZ LYS 37 14.670 9.869 4.869
271 HZ2 LYS 37 1HZ LYS 37 14.125 10.898 3.642
272 HZ3 LYS 37 2HZ LYS 37 15.758 10.898 4.082
273 HA PRO 38 HA PRO 38 14.154 12.007 -4.332
274 HB2 PRO 38 1HB PRO 38 15.668 14.170 -3.700
275 HB3 PRO 38 2HB PRO 38 13.907 14.237 -3.836
276 HG2 PRO 38 1HG PRO 38 15.610 14.016 -1.385
277 HG3 PRO 38 2HG PRO 38 14.176 15.021 -1.664
278 HD2 PRO 38 1HD PRO 38 14.077 12.689 -0.291
279 HD3 PRO 38 2HD PRO 38 12.723 13.273 -1.279
280 H SER 39 H SER 39 16.359 12.451 -5.328
281 HA SER 39 HA SER 39 18.451 10.974 -3.870
282 HB2 SER 39 1HB SER 39 19.201 10.103 -6.094
283 HB3 SER 39 2HB SER 39 17.602 9.532 -5.616
284 HG SER 39 HG SER 39 18.089 11.730 -7.346
285 H GLY 40 H GLY 40 20.633 11.557 -4.341
286 HA2 GLY 40 1HA GLY 40 20.879 14.273 -5.482
287 HA3 GLY 40 2HA GLY 40 21.806 13.722 -4.095
288 HA PRO 41 HA PRO 41 24.934 13.035 -7.189
289 HB2 PRO 41 1HB PRO 41 26.854 12.213 -5.455
290 HB3 PRO 41 2HB PRO 41 26.417 13.912 -5.669
291 HG2 PRO 41 1HG PRO 41 25.567 11.992 -3.535
292 HG3 PRO 41 2HG PRO 41 26.063 13.688 -3.382
293 HD2 PRO 41 1HD PRO 41 23.466 12.923 -3.364
294 HD3 PRO 41 2HD PRO 41 23.998 14.482 -4.027
295 H SER 42 H SER 42 23.164 10.819 -5.482
296 HA SER 42 HA SER 42 24.732 8.465 -5.915
297 HB2 SER 42 1HB SER 42 22.905 8.782 -4.156
298 HB3 SER 42 2HB SER 42 21.749 8.539 -5.464
299 HG SER 42 HG SER 42 22.551 6.642 -4.136
300 H SER 43 H SER 43 25.126 7.659 -7.860
301 HA SER 43 HA SER 43 22.983 7.078 -9.680
302 HB2 SER 43 1HB SER 43 23.748 8.383 -11.557
303 HB3 SER 43 2HB SER 43 23.518 9.477 -10.193
304 HG SER 43 HG SER 43 25.486 10.045 -10.735
305 H GLY 44 H GLY 44 23.699 5.794 -11.525
306 HA2 GLY 44 1HA GLY 44 25.350 4.524 -12.676
307 HA3 GLY 44 2HA GLY 44 26.423 4.726 -11.299