Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
504693 | 2emp RC | 10305 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 -13.752 -4.008 10.155
2 HA2 GLY 1 1HA GLY 1 -14.823 -4.142 7.921
3 HA3 GLY 1 2HA GLY 1 -13.603 -2.999 7.380
4 H SER 2 H SER 2 -14.006 -5.407 6.081
5 HA SER 2 HA SER 2 -12.911 -7.234 5.280
6 HB2 SER 2 1HB SER 2 -11.115 -5.568 4.943
7 HB3 SER 2 2HB SER 2 -10.502 -5.916 6.559
8 HG SER 2 HG SER 2 -10.143 -8.073 5.859
9 H SER 3 H SER 3 -14.223 -7.637 7.686
10 HA SER 3 HA SER 3 -12.444 -9.104 9.450
11 HB2 SER 3 1HB SER 3 -14.283 -7.727 10.382
12 HB3 SER 3 2HB SER 3 -15.452 -8.775 9.578
13 HG SER 3 HG SER 3 -13.545 -9.973 11.227
14 H GLY 4 H GLY 4 -11.825 -11.071 8.836
15 HA2 GLY 4 1HA GLY 4 -13.895 -12.898 7.792
16 HA3 GLY 4 2HA GLY 4 -12.307 -12.810 7.045
17 H SER 5 H SER 5 -12.100 -15.078 7.472
18 HA SER 5 HA SER 5 -11.581 -15.708 10.302
19 HB2 SER 5 1HB SER 5 -13.351 -17.008 8.861
20 HB3 SER 5 2HB SER 5 -11.932 -17.831 8.214
21 HG SER 5 HG SER 5 -11.380 -18.373 10.382
22 H SER 6 H SER 6 -10.451 -16.543 7.025
23 HA SER 6 HA SER 6 -7.997 -17.653 7.874
24 HB2 SER 6 1HB SER 6 -8.835 -16.515 5.198
25 HB3 SER 6 2HB SER 6 -7.327 -17.388 5.472
26 HG SER 6 HG SER 6 -8.820 -19.093 6.344
27 H GLY 7 H GLY 7 -6.603 -16.486 9.051
28 HA2 GLY 7 1HA GLY 7 -6.286 -13.753 9.145
29 HA3 GLY 7 2HA GLY 7 -5.006 -14.899 9.516
30 H THR 8 H THR 8 -4.224 -15.978 7.265
31 HA THR 8 HA THR 8 -2.494 -14.369 6.038
32 HB THR 8 HB THR 8 -4.152 -16.358 4.477
33 HG1 THR 8 HG1 THR 8 -1.691 -16.889 5.781
34 HG21 THR 8 3HG2 THR 8 -2.089 -16.612 3.144
35 HG22 THR 8 1HG2 THR 8 -1.346 -15.312 4.075
36 HG23 THR 8 2HG2 THR 8 -2.746 -14.978 3.055
37 H GLY 9 H GLY 9 -5.809 -14.822 4.786
38 HA2 GLY 9 1HA GLY 9 -7.175 -13.393 3.614
39 HA3 GLY 9 2HA GLY 9 -6.143 -12.079 4.159
40 H VAL 10 H VAL 10 -6.945 -11.514 1.832
41 HA VAL 10 HA VAL 10 -4.684 -11.551 0.151
42 HB VAL 10 HB VAL 10 -5.470 -13.904 -0.205
43 HG11 VAL 10 1HG1 VAL 10 -7.854 -12.494 -1.394
44 HG12 VAL 10 2HG1 VAL 10 -7.470 -14.196 -1.660
45 HG13 VAL 10 3HG1 VAL 10 -7.845 -13.618 -0.036
46 HG21 VAL 10 3HG2 VAL 10 -4.105 -13.074 -1.903
47 HG22 VAL 10 1HG2 VAL 10 -5.533 -13.646 -2.766
48 HG23 VAL 10 2HG2 VAL 10 -5.324 -11.924 -2.452
49 H LYS 11 H LYS 11 -4.840 -10.032 -1.451
50 HA LYS 11 HA LYS 11 -7.476 -8.880 -2.016
51 HB2 LYS 11 1HB LYS 11 -5.118 -7.499 -0.818
52 HB3 LYS 11 2HB LYS 11 -6.109 -6.606 -1.965
53 HG2 LYS 11 1HG LYS 11 -7.156 -6.037 -0.031
54 HG3 LYS 11 2HG LYS 11 -8.066 -7.495 -0.434
55 HD2 LYS 11 1HD LYS 11 -6.593 -8.801 1.039
56 HD3 LYS 11 2HD LYS 11 -5.722 -7.324 1.461
57 HE2 LYS 11 1HE LYS 11 -7.210 -7.552 3.221
58 HE3 LYS 11 2HE LYS 11 -8.055 -6.436 2.149
59 HZ1 LYS 11 3HZ LYS 11 -9.229 -8.549 3.156
60 HZ2 LYS 11 1HZ LYS 11 -8.554 -9.294 1.796
61 HZ3 LYS 11 2HZ LYS 11 -9.605 -7.983 1.607
62 HA PRO 12 HA PRO 12 -6.056 -8.970 -6.181
63 HB2 PRO 12 1HB PRO 12 -7.731 -7.121 -7.251
64 HB3 PRO 12 2HB PRO 12 -8.261 -8.740 -6.781
65 HG2 PRO 12 1HG PRO 12 -8.531 -6.153 -5.299
66 HG3 PRO 12 2HG PRO 12 -9.722 -7.450 -5.512
67 HD2 PRO 12 1HD PRO 12 -8.270 -7.163 -3.244
68 HD3 PRO 12 2HD PRO 12 -8.792 -8.748 -3.850
69 H TYR 13 H TYR 13 -6.601 -5.728 -4.808
70 HA TYR 13 HA TYR 13 -4.710 -4.509 -6.604
71 HB2 TYR 13 1HB TYR 13 -5.850 -3.239 -4.121
72 HB3 TYR 13 2HB TYR 13 -5.294 -2.451 -5.594
73 HD1 TYR 13 HD1 TYR 13 -6.627 -3.089 -7.770
74 HD2 TYR 13 HD2 TYR 13 -8.121 -3.560 -3.814
75 HE1 TYR 13 HE1 TYR 13 -8.925 -3.096 -8.646
76 HE2 TYR 13 HE2 TYR 13 -10.423 -3.569 -4.679
77 HH TYR 13 HH TYR 13 -11.166 -2.722 -7.936
78 H MET 14 H MET 14 -2.682 -5.308 -6.276
79 HA MET 14 HA MET 14 -1.504 -4.811 -3.622
80 HB2 MET 14 1HB MET 14 -1.643 -7.187 -3.878
81 HB3 MET 14 2HB MET 14 -1.002 -7.108 -5.513
82 HG2 MET 14 1HG MET 14 0.855 -7.786 -4.397
83 HG3 MET 14 2HG MET 14 1.067 -6.039 -4.300
84 HE1 MET 14 3HE MET 14 1.964 -8.801 -1.756
85 HE2 MET 14 1HE MET 14 0.343 -9.103 -1.130
86 HE3 MET 14 2HE MET 14 0.663 -9.254 -2.857
87 H CYS 15 H CYS 15 0.344 -3.659 -3.566
88 HA CYS 15 HA CYS 15 1.244 -2.433 -6.021
89 HB2 CYS 15 1HB CYS 15 1.060 -1.002 -4.102
90 HB3 CYS 15 2HB CYS 15 2.062 -2.078 -3.134
91 H ASN 16 H ASN 16 3.378 -2.483 -6.823
92 HA ASN 16 HA ASN 16 4.851 -4.921 -6.086
93 HB2 ASN 16 1HB ASN 16 5.629 -5.074 -8.314
94 HB3 ASN 16 2HB ASN 16 3.925 -4.653 -8.453
95 HD21 ASN 16 1HD2 ASN 16 7.198 -3.456 -8.688
96 HD22 ASN 16 2HD2 ASN 16 6.827 -2.068 -9.646
97 H GLU 17 H GLU 17 5.045 -1.477 -6.407
98 HA GLU 17 HA GLU 17 7.797 -1.089 -6.556
99 HB2 GLU 17 1HB GLU 17 5.548 0.525 -5.405
100 HB3 GLU 17 2HB GLU 17 7.208 1.062 -5.196
101 HG2 GLU 17 1HG GLU 17 6.144 2.124 -7.113
102 HG3 GLU 17 2HG GLU 17 7.520 1.133 -7.595
103 H CYS 18 H CYS 18 5.727 -1.427 -3.688
104 HA CYS 18 HA CYS 18 8.162 -1.904 -2.095
105 HB2 CYS 18 1HB CYS 18 6.867 -1.125 -0.135
106 HB3 CYS 18 2HB CYS 18 7.030 0.121 -1.368
107 H GLY 19 H GLY 19 4.742 -2.797 -2.468
108 HA2 GLY 19 1HA GLY 19 4.249 -5.198 -2.612
109 HA3 GLY 19 2HA GLY 19 5.429 -5.437 -1.332
110 H LYS 20 H LYS 20 2.725 -3.151 -1.696
111 HA LYS 20 HA LYS 20 1.671 -4.162 0.865
112 HB2 LYS 20 1HB LYS 20 1.957 -1.404 -0.228
113 HB3 LYS 20 2HB LYS 20 0.556 -1.746 0.779
114 HG2 LYS 20 1HG LYS 20 1.955 -2.385 2.615
115 HG3 LYS 20 2HG LYS 20 3.402 -2.266 1.611
116 HD2 LYS 20 1HD LYS 20 3.290 0.066 1.521
117 HD3 LYS 20 2HD LYS 20 1.596 0.095 2.017
118 HE2 LYS 20 1HE LYS 20 2.620 0.736 3.966
119 HE3 LYS 20 2HE LYS 20 2.544 -1.010 4.199
120 HZ1 LYS 20 3HZ LYS 20 4.743 -1.115 4.280
121 HZ2 LYS 20 1HZ LYS 20 4.793 0.576 4.278
122 HZ3 LYS 20 2HZ LYS 20 4.914 -0.274 2.822
123 H ALA 21 H ALA 21 -0.351 -4.925 0.895
124 HA ALA 21 HA ALA 21 -1.889 -4.837 -1.586
125 HB1 ALA 21 3HB ALA 21 -1.687 -6.677 0.687
126 HB2 ALA 21 1HB ALA 21 -3.326 -6.434 0.082
127 HB3 ALA 21 2HB ALA 21 -2.058 -6.998 -1.007
128 H PHE 22 H PHE 22 -4.144 -4.328 -1.594
129 HA PHE 22 HA PHE 22 -5.138 -2.818 0.708
130 HB2 PHE 22 1HB PHE 22 -5.217 -1.731 -2.113
131 HB3 PHE 22 2HB PHE 22 -5.810 -0.934 -0.660
132 HD1 PHE 22 HD2 PHE 22 -2.762 -2.106 -2.387
133 HD2 PHE 22 HD1 PHE 22 -4.375 0.331 0.708
134 HE1 PHE 22 HE2 PHE 22 -0.561 -1.052 -2.073
135 HE2 PHE 22 HE1 PHE 22 -2.176 1.389 1.026
136 HZ PHE 22 HZ PHE 22 -0.265 0.697 -0.365
137 H SER 23 H SER 23 -7.470 -2.374 0.571
138 HA SER 23 HA SER 23 -8.838 -4.596 -0.768
139 HB2 SER 23 1HB SER 23 -10.496 -4.475 0.888
140 HB3 SER 23 2HB SER 23 -9.013 -4.120 1.774
141 HG SER 23 HG SER 23 -9.705 -1.808 1.070
142 H VAL 24 H VAL 24 -8.237 -1.361 -1.212
143 HA VAL 24 HA VAL 24 -10.695 -1.025 -2.806
144 HB VAL 24 HB VAL 24 -9.105 1.230 -1.589
145 HG11 VAL 24 1HG1 VAL 24 -11.689 1.032 -3.094
146 HG12 VAL 24 2HG1 VAL 24 -11.362 2.392 -2.018
147 HG13 VAL 24 3HG1 VAL 24 -10.304 2.081 -3.395
148 HG21 VAL 24 3HG2 VAL 24 -10.011 0.714 0.378
149 HG22 VAL 24 1HG2 VAL 24 -11.585 1.091 -0.324
150 HG23 VAL 24 2HG2 VAL 24 -10.986 -0.568 -0.341
151 H TYR 25 H TYR 25 -10.504 -0.154 -4.854
152 HA TYR 25 HA TYR 25 -8.034 -0.603 -6.188
153 HB2 TYR 25 1HB TYR 25 -10.142 -0.961 -7.341
154 HB3 TYR 25 2HB TYR 25 -10.579 0.731 -7.134
155 HD1 TYR 25 HD2 TYR 25 -7.438 -0.925 -8.301
156 HD2 TYR 25 HD1 TYR 25 -10.621 1.750 -9.207
157 HE1 TYR 25 HE2 TYR 25 -6.369 -0.391 -10.451
158 HE2 TYR 25 HE1 TYR 25 -9.562 2.290 -11.360
159 HH TYR 25 HH TYR 25 -6.386 1.512 -12.092
160 H SER 26 H SER 26 -9.915 2.370 -5.606
161 HA SER 26 HA SER 26 -8.118 4.183 -6.695
162 HB2 SER 26 1HB SER 26 -10.358 4.864 -6.072
163 HB3 SER 26 2HB SER 26 -10.025 4.539 -4.371
164 HG SER 26 HG SER 26 -9.067 6.405 -4.215
165 H SER 27 H SER 27 -8.297 2.911 -3.393
166 HA SER 27 HA SER 27 -6.328 4.467 -2.207
167 HB2 SER 27 1HB SER 27 -7.111 1.593 -1.677
168 HB3 SER 27 2HB SER 27 -6.031 2.521 -0.636
169 HG SER 27 HG SER 27 -8.053 2.757 0.205
170 H LEU 28 H LEU 28 -6.012 1.466 -4.055
171 HA LEU 28 HA LEU 28 -3.285 1.019 -3.652
172 HB2 LEU 28 1HB LEU 28 -4.438 -0.743 -4.621
173 HB3 LEU 28 2HB LEU 28 -5.213 0.294 -5.817
174 HG LEU 28 HG LEU 28 -2.968 0.526 -6.924
175 HD11 LEU 28 1HD1 LEU 28 -2.225 -1.112 -4.626
176 HD12 LEU 28 2HD1 LEU 28 -1.226 -0.111 -5.679
177 HD13 LEU 28 3HD1 LEU 28 -1.654 -1.751 -6.168
178 HD21 LEU 28 3HD2 LEU 28 -3.392 -1.265 -8.257
179 HD22 LEU 28 1HD2 LEU 28 -4.900 -1.253 -7.341
180 HD23 LEU 28 2HD2 LEU 28 -3.608 -2.369 -6.897
181 H THR 29 H THR 29 -4.944 2.867 -6.189
182 HA THR 29 HA THR 29 -2.600 3.610 -7.588
183 HB THR 29 HB THR 29 -3.981 5.280 -8.711
184 HG1 THR 29 HG1 THR 29 -5.417 6.161 -7.405
185 HG21 THR 29 3HG2 THR 29 -5.687 3.804 -9.631
186 HG22 THR 29 1HG2 THR 29 -5.508 2.713 -8.258
187 HG23 THR 29 2HG2 THR 29 -4.178 2.923 -9.397
188 H THR 30 H THR 30 -4.587 5.346 -5.202
189 HA THR 30 HA THR 30 -3.076 7.707 -5.147
190 HB THR 30 HB THR 30 -4.551 6.585 -2.767
191 HG1 THR 30 HG1 THR 30 -6.300 7.959 -3.843
192 HG21 THR 30 3HG2 THR 30 -4.615 8.722 -1.959
193 HG22 THR 30 1HG2 THR 30 -4.586 9.448 -3.565
194 HG23 THR 30 2HG2 THR 30 -3.101 8.810 -2.859
195 H HIS 31 H HIS 31 -2.435 4.592 -3.854
196 HA HIS 31 HA HIS 31 -0.552 5.507 -1.861
197 HB2 HIS 31 1HB HIS 31 -1.477 3.522 -1.153
198 HB3 HIS 31 2HB HIS 31 -1.575 2.862 -2.782
199 HD1 HIS 31 HD1 HIS 31 0.884 3.392 0.024
200 HD2 HIS 31 HD2 HIS 31 0.561 1.300 -3.551
201 HE1 HIS 31 HE1 HIS 31 2.862 1.839 -0.028
202 H GLN 32 H GLN 32 -0.352 3.712 -4.931
203 HA GLN 32 HA GLN 32 2.346 3.353 -5.146
204 HB2 GLN 32 1HB GLN 32 0.324 4.049 -7.271
205 HB3 GLN 32 2HB GLN 32 1.992 3.643 -7.653
206 HG2 GLN 32 1HG GLN 32 1.748 1.444 -6.843
207 HG3 GLN 32 2HG GLN 32 0.214 1.823 -6.062
208 HE21 GLN 32 1HE2 GLN 32 1.479 0.200 -8.536
209 HE22 GLN 32 2HE2 GLN 32 0.182 0.283 -9.673
210 H VAL 33 H VAL 33 0.648 6.331 -5.152
211 HA VAL 33 HA VAL 33 2.277 8.007 -6.633
212 HB VAL 33 HB VAL 33 0.741 8.549 -4.096
213 HG11 VAL 33 1HG1 VAL 33 2.608 10.139 -4.295
214 HG12 VAL 33 2HG1 VAL 33 2.050 10.571 -5.913
215 HG13 VAL 33 3HG1 VAL 33 1.041 10.920 -4.508
216 HG21 VAL 33 3HG2 VAL 33 -0.148 9.895 -6.483
217 HG22 VAL 33 1HG2 VAL 33 -0.050 8.154 -6.745
218 HG23 VAL 33 2HG2 VAL 33 -1.028 8.793 -5.424
219 H ILE 34 H ILE 34 2.769 6.682 -3.425
220 HA ILE 34 HA ILE 34 4.872 8.347 -2.592
221 HB ILE 34 HB ILE 34 5.415 6.655 -0.965
222 HG12 ILE 34 1HG1 ILE 34 3.447 4.723 -2.116
223 HG13 ILE 34 2HG1 ILE 34 5.056 4.804 -2.825
224 HG21 ILE 34 1HG2 ILE 34 2.774 6.047 -0.485
225 HG22 ILE 34 2HG2 ILE 34 3.610 7.511 0.028
226 HG23 ILE 34 3HG2 ILE 34 2.679 7.506 -1.469
227 HD11 ILE 34 3HD1 ILE 34 6.050 4.303 -0.670
228 HD12 ILE 34 1HD1 ILE 34 4.451 4.272 0.074
229 HD13 ILE 34 2HD1 ILE 34 4.887 3.060 -1.131
230 H HIS 35 H HIS 35 4.771 6.220 -5.156
231 HA HIS 35 HA HIS 35 7.690 5.821 -5.099
232 HB2 HIS 35 1HB HIS 35 5.708 4.274 -6.772
233 HB3 HIS 35 2HB HIS 35 7.403 3.891 -6.488
234 HD1 HIS 35 HD1 HIS 35 7.777 3.720 -3.616
235 HD2 HIS 35 HD2 HIS 35 4.178 2.579 -5.351
236 HE1 HIS 35 HE1 HIS 35 6.686 2.181 -1.952
237 H THR 36 H THR 36 4.997 7.111 -6.874
238 HA THR 36 HA THR 36 6.187 7.454 -9.389
239 HB THR 36 HB THR 36 4.526 9.291 -9.715
240 HG1 THR 36 HG1 THR 36 3.573 10.140 -8.027
241 HG21 THR 36 3HG2 THR 36 4.100 6.642 -9.684
242 HG22 THR 36 1HG2 THR 36 2.836 7.812 -10.059
243 HG23 THR 36 2HG2 THR 36 2.955 7.132 -8.436
244 H GLY 37 H GLY 37 6.004 9.682 -6.615
245 HA2 GLY 37 1HA GLY 37 7.060 11.724 -6.291
246 HA3 GLY 37 2HA GLY 37 8.475 10.728 -6.599
247 H GLU 38 H GLU 38 6.051 12.780 -8.153
248 HA GLU 38 HA GLU 38 7.252 12.885 -10.692
249 HB2 GLU 38 1HB GLU 38 5.908 14.925 -11.030
250 HB3 GLU 38 2HB GLU 38 4.963 13.611 -10.344
251 HG2 GLU 38 1HG GLU 38 5.205 14.626 -8.119
252 HG3 GLU 38 2HG GLU 38 6.089 15.966 -8.847
253 H LYS 39 H LYS 39 7.782 14.742 -7.758
254 HA LYS 39 HA LYS 39 9.657 16.525 -9.081
255 HB2 LYS 39 1HB LYS 39 8.378 16.379 -6.399
256 HB3 LYS 39 2HB LYS 39 9.936 17.188 -6.508
257 HG2 LYS 39 1HG LYS 39 9.114 18.901 -7.790
258 HG3 LYS 39 2HG LYS 39 7.793 17.927 -8.439
259 HD2 LYS 39 1HD LYS 39 7.921 18.701 -5.538
260 HD3 LYS 39 2HD LYS 39 7.195 19.755 -6.754
261 HE2 LYS 39 1HE LYS 39 5.426 18.347 -7.112
262 HE3 LYS 39 2HE LYS 39 6.343 16.907 -6.674
263 HZ1 LYS 39 3HZ LYS 39 5.817 18.861 -4.568
264 HZ2 LYS 39 1HZ LYS 39 5.894 17.173 -4.482
265 HZ3 LYS 39 2HZ LYS 39 4.512 17.926 -5.099
266 HA PRO 40 HA PRO 40 13.307 14.256 -8.177
267 HB2 PRO 40 1HB PRO 40 15.090 16.280 -7.869
268 HB3 PRO 40 2HB PRO 40 14.432 15.811 -9.441
269 HG2 PRO 40 1HG PRO 40 13.615 18.058 -7.640
270 HG3 PRO 40 2HG PRO 40 13.825 18.055 -9.401
271 HD2 PRO 40 1HD PRO 40 11.393 17.880 -8.222
272 HD3 PRO 40 2HD PRO 40 11.763 17.093 -9.770
273 H SER 41 H SER 41 13.815 13.239 -6.351
274 HA SER 41 HA SER 41 14.124 14.823 -3.888
275 HB2 SER 41 1HB SER 41 12.717 12.172 -4.239
276 HB3 SER 41 2HB SER 41 13.227 12.784 -2.666
277 HG SER 41 HG SER 41 11.831 14.481 -2.874
278 H GLY 42 H GLY 42 15.151 13.196 -2.141
279 HA2 GLY 42 1HA GLY 42 17.567 12.125 -3.454
280 HA3 GLY 42 2HA GLY 42 17.529 12.800 -1.832
281 HA PRO 43 HA PRO 43 16.926 8.837 -0.072
282 HB2 PRO 43 1HB PRO 43 15.119 9.300 1.901
283 HB3 PRO 43 2HB PRO 43 16.796 9.854 1.985
284 HG2 PRO 43 1HG PRO 43 14.334 11.376 1.222
285 HG3 PRO 43 2HG PRO 43 15.686 11.879 2.253
286 HD2 PRO 43 1HD PRO 43 15.458 12.655 -0.331
287 HD3 PRO 43 2HD PRO 43 17.029 12.399 0.454
288 H SER 44 H SER 44 15.971 7.383 -1.391
289 HA SER 44 HA SER 44 13.033 7.273 -1.367
290 HB2 SER 44 1HB SER 44 14.868 7.318 -3.715
291 HB3 SER 44 2HB SER 44 13.461 6.258 -3.798
292 HG SER 44 HG SER 44 13.297 8.995 -3.089
293 H SER 45 H SER 45 12.232 5.345 -0.831
294 HA SER 45 HA SER 45 13.880 3.248 0.045
295 HB2 SER 45 1HB SER 45 11.658 3.507 0.958
296 HB3 SER 45 2HB SER 45 10.930 3.280 -0.632
297 HG SER 45 HG SER 45 11.120 1.414 0.968
298 H GLY 46 H GLY 46 11.970 3.620 -2.927
299 HA2 GLY 46 1HA GLY 46 13.804 2.088 -4.464
300 HA3 GLY 46 2HA GLY 46 12.394 1.122 -4.054
Start of MODEL 2
1 H1 GLY 1 H GLY 1 2.227 -29.829 2.384
2 HA2 GLY 1 1HA GLY 1 -0.191 -30.689 1.278
3 HA3 GLY 1 2HA GLY 1 0.052 -30.265 2.966
4 H SER 2 H SER 2 0.311 -28.184 0.112
5 HA SER 2 HA SER 2 -1.524 -26.305 1.365
6 HB2 SER 2 1HB SER 2 -0.780 -24.720 -0.295
7 HB3 SER 2 2HB SER 2 0.640 -25.553 0.338
8 HG SER 2 HG SER 2 0.281 -27.008 -1.564
9 H SER 3 H SER 3 -1.241 -28.152 -1.648
10 HA SER 3 HA SER 3 -2.746 -28.387 -3.389
11 HB2 SER 3 1HB SER 3 -3.264 -30.061 -1.455
12 HB3 SER 3 2HB SER 3 -4.715 -29.084 -1.230
13 HG SER 3 HG SER 3 -5.383 -29.606 -3.266
14 H GLY 4 H GLY 4 -2.662 -25.687 -2.619
15 HA2 GLY 4 1HA GLY 4 -4.192 -24.125 -3.799
16 HA3 GLY 4 2HA GLY 4 -5.499 -24.918 -2.933
17 H SER 5 H SER 5 -3.728 -22.192 -3.013
18 HA SER 5 HA SER 5 -3.146 -21.768 -0.260
19 HB2 SER 5 1HB SER 5 -2.887 -19.381 -0.936
20 HB3 SER 5 2HB SER 5 -1.971 -20.490 -1.956
21 HG SER 5 HG SER 5 -3.451 -18.722 -2.898
22 H SER 6 H SER 6 -5.111 -22.406 0.766
23 HA SER 6 HA SER 6 -7.321 -20.482 0.474
24 HB2 SER 6 1HB SER 6 -8.751 -22.217 1.498
25 HB3 SER 6 2HB SER 6 -7.974 -22.799 0.026
26 HG SER 6 HG SER 6 -7.945 -24.176 2.028
27 H GLY 7 H GLY 7 -6.221 -18.948 1.829
28 HA2 GLY 7 1HA GLY 7 -6.682 -19.507 4.669
29 HA3 GLY 7 2HA GLY 7 -5.077 -18.982 4.184
30 H THR 8 H THR 8 -5.814 -17.312 5.863
31 HA THR 8 HA THR 8 -7.551 -15.251 4.756
32 HB THR 8 HB THR 8 -7.229 -14.109 6.933
33 HG1 THR 8 HG1 THR 8 -5.098 -15.081 7.306
34 HG21 THR 8 3HG2 THR 8 -9.080 -15.671 6.668
35 HG22 THR 8 1HG2 THR 8 -8.432 -15.762 8.306
36 HG23 THR 8 2HG2 THR 8 -8.034 -17.014 7.129
37 H GLY 9 H GLY 9 -6.409 -14.288 3.108
38 HA2 GLY 9 1HA GLY 9 -4.853 -12.121 3.503
39 HA3 GLY 9 2HA GLY 9 -3.675 -13.425 3.513
40 H VAL 10 H VAL 10 -6.013 -11.677 1.580
41 HA VAL 10 HA VAL 10 -4.484 -12.125 -0.798
42 HB VAL 10 HB VAL 10 -5.759 -14.244 -0.693
43 HG11 VAL 10 1HG1 VAL 10 -8.095 -14.348 -0.759
44 HG12 VAL 10 2HG1 VAL 10 -7.752 -13.101 0.442
45 HG13 VAL 10 3HG1 VAL 10 -8.249 -12.645 -1.188
46 HG21 VAL 10 3HG2 VAL 10 -5.710 -14.231 -2.916
47 HG22 VAL 10 1HG2 VAL 10 -7.105 -13.154 -2.987
48 HG23 VAL 10 2HG2 VAL 10 -5.478 -12.484 -2.856
49 H LYS 11 H LYS 11 -4.742 -10.456 -2.157
50 HA LYS 11 HA LYS 11 -7.221 -8.912 -2.108
51 HB2 LYS 11 1HB LYS 11 -4.484 -7.810 -1.493
52 HB3 LYS 11 2HB LYS 11 -5.798 -6.789 -2.061
53 HG2 LYS 11 1HG LYS 11 -6.060 -6.517 0.175
54 HG3 LYS 11 2HG LYS 11 -7.079 -7.940 -0.054
55 HD2 LYS 11 1HD LYS 11 -5.488 -9.378 0.849
56 HD3 LYS 11 2HD LYS 11 -4.167 -8.237 0.585
57 HE2 LYS 11 1HE LYS 11 -4.665 -7.018 2.459
58 HE3 LYS 11 2HE LYS 11 -6.374 -7.445 2.415
59 HZ1 LYS 11 3HZ LYS 11 -4.935 -8.463 4.237
60 HZ2 LYS 11 1HZ LYS 11 -4.310 -9.466 3.027
61 HZ3 LYS 11 2HZ LYS 11 -5.962 -9.502 3.384
62 HA PRO 12 HA PRO 12 -6.556 -8.840 -6.459
63 HB2 PRO 12 1HB PRO 12 -8.136 -6.729 -7.104
64 HB3 PRO 12 2HB PRO 12 -8.783 -8.307 -6.640
65 HG2 PRO 12 1HG PRO 12 -8.459 -5.832 -4.987
66 HG3 PRO 12 2HG PRO 12 -9.826 -6.960 -5.058
67 HD2 PRO 12 1HD PRO 12 -7.985 -7.025 -3.074
68 HD3 PRO 12 2HD PRO 12 -8.802 -8.485 -3.666
69 H TYR 13 H TYR 13 -6.557 -5.602 -4.954
70 HA TYR 13 HA TYR 13 -4.564 -4.706 -6.888
71 HB2 TYR 13 1HB TYR 13 -5.804 -3.056 -4.689
72 HB3 TYR 13 2HB TYR 13 -5.046 -2.492 -6.174
73 HD1 TYR 13 HD1 TYR 13 -6.209 -3.086 -8.387
74 HD2 TYR 13 HD2 TYR 13 -8.115 -3.383 -4.595
75 HE1 TYR 13 HE1 TYR 13 -8.405 -3.034 -9.494
76 HE2 TYR 13 HE2 TYR 13 -10.316 -3.334 -5.691
77 HH TYR 13 HH TYR 13 -11.293 -2.526 -7.822
78 H MET 14 H MET 14 -2.625 -5.567 -6.304
79 HA MET 14 HA MET 14 -1.640 -4.888 -3.611
80 HB2 MET 14 1HB MET 14 -0.338 -6.873 -3.571
81 HB3 MET 14 2HB MET 14 -1.949 -7.351 -4.089
82 HG2 MET 14 1HG MET 14 -1.142 -7.302 -6.437
83 HG3 MET 14 2HG MET 14 0.480 -6.992 -5.824
84 HE1 MET 14 3HE MET 14 1.165 -8.726 -3.524
85 HE2 MET 14 1HE MET 14 -0.529 -8.896 -3.064
86 HE3 MET 14 2HE MET 14 0.443 -10.330 -3.393
87 H CYS 15 H CYS 15 0.500 -4.167 -3.420
88 HA CYS 15 HA CYS 15 1.584 -3.030 -5.897
89 HB2 CYS 15 1HB CYS 15 1.214 -1.359 -4.236
90 HB3 CYS 15 2HB CYS 15 1.985 -2.333 -2.988
91 H ASN 16 H ASN 16 3.538 -3.579 -6.685
92 HA ASN 16 HA ASN 16 4.965 -5.740 -5.314
93 HB2 ASN 16 1HB ASN 16 5.538 -4.789 -8.111
94 HB3 ASN 16 2HB ASN 16 5.842 -6.373 -7.403
95 HD21 ASN 16 1HD2 ASN 16 4.540 -5.992 -9.834
96 HD22 ASN 16 2HD2 ASN 16 2.901 -6.517 -9.671
97 H GLU 17 H GLU 17 5.243 -2.420 -6.188
98 HA GLU 17 HA GLU 17 8.000 -2.073 -6.306
99 HB2 GLU 17 1HB GLU 17 5.790 -0.260 -5.354
100 HB3 GLU 17 2HB GLU 17 7.467 0.263 -5.401
101 HG2 GLU 17 1HG GLU 17 6.084 0.916 -7.377
102 HG3 GLU 17 2HG GLU 17 7.569 0.044 -7.753
103 H CYS 18 H CYS 18 5.881 -1.707 -3.460
104 HA CYS 18 HA CYS 18 8.255 -2.051 -1.755
105 HB2 CYS 18 1HB CYS 18 7.103 -0.842 -0.034
106 HB3 CYS 18 2HB CYS 18 6.956 0.085 -1.523
107 H GLY 19 H GLY 19 4.833 -2.959 -2.064
108 HA2 GLY 19 1HA GLY 19 4.478 -5.435 -1.835
109 HA3 GLY 19 2HA GLY 19 5.405 -5.296 -0.348
110 H LYS 20 H LYS 20 3.225 -2.750 -1.191
111 HA LYS 20 HA LYS 20 1.578 -3.426 1.120
112 HB2 LYS 20 1HB LYS 20 2.586 -1.071 0.455
113 HB3 LYS 20 2HB LYS 20 1.127 -0.973 -0.521
114 HG2 LYS 20 1HG LYS 20 -0.250 -0.852 1.294
115 HG3 LYS 20 2HG LYS 20 0.856 -1.756 2.331
116 HD2 LYS 20 1HD LYS 20 2.357 0.188 2.401
117 HD3 LYS 20 2HD LYS 20 1.225 1.089 1.390
118 HE2 LYS 20 1HE LYS 20 0.200 -0.146 3.894
119 HE3 LYS 20 2HE LYS 20 1.212 1.291 4.031
120 HZ1 LYS 20 3HZ LYS 20 -1.337 1.538 3.800
121 HZ2 LYS 20 1HZ LYS 20 -1.052 1.278 2.152
122 HZ3 LYS 20 2HZ LYS 20 -0.323 2.585 2.940
123 H ALA 21 H ALA 21 -0.404 -4.258 0.976
124 HA ALA 21 HA ALA 21 -1.670 -4.358 -1.683
125 HB1 ALA 21 3HB ALA 21 -1.609 -6.311 0.580
126 HB2 ALA 21 1HB ALA 21 -2.942 -6.330 -0.576
127 HB3 ALA 21 2HB ALA 21 -1.286 -6.571 -1.134
128 H PHE 22 H PHE 22 -3.828 -3.849 -1.906
129 HA PHE 22 HA PHE 22 -5.215 -2.841 0.482
130 HB2 PHE 22 1HB PHE 22 -5.380 -1.448 -2.185
131 HB3 PHE 22 2HB PHE 22 -5.908 -0.857 -0.613
132 HD1 PHE 22 HD2 PHE 22 -2.769 -2.078 -2.225
133 HD2 PHE 22 HD1 PHE 22 -4.611 0.749 0.370
134 HE1 PHE 22 HE2 PHE 22 -0.605 -0.945 -1.929
135 HE2 PHE 22 HE1 PHE 22 -2.450 1.887 0.670
136 HZ PHE 22 HZ PHE 22 -0.443 1.040 -0.479
137 H SER 23 H SER 23 -7.590 -2.530 0.075
138 HA SER 23 HA SER 23 -8.583 -4.844 -1.409
139 HB2 SER 23 1HB SER 23 -10.690 -4.449 -0.147
140 HB3 SER 23 2HB SER 23 -9.297 -4.681 0.910
141 HG SER 23 HG SER 23 -10.355 -2.160 0.142
142 H VAL 24 H VAL 24 -8.957 -1.346 -1.211
143 HA VAL 24 HA VAL 24 -10.894 -1.340 -3.386
144 HB VAL 24 HB VAL 24 -9.690 1.094 -2.085
145 HG11 VAL 24 1HG1 VAL 24 -12.369 0.627 -3.391
146 HG12 VAL 24 2HG1 VAL 24 -11.754 2.161 -2.772
147 HG13 VAL 24 3HG1 VAL 24 -10.982 1.396 -4.162
148 HG21 VAL 24 3HG2 VAL 24 -12.095 0.791 -0.850
149 HG22 VAL 24 1HG2 VAL 24 -11.542 -0.881 -0.958
150 HG23 VAL 24 2HG2 VAL 24 -10.543 0.329 -0.152
151 H TYR 25 H TYR 25 -10.572 -0.120 -5.324
152 HA TYR 25 HA TYR 25 -8.027 -0.541 -6.504
153 HB2 TYR 25 1HB TYR 25 -10.451 -0.358 -7.556
154 HB3 TYR 25 2HB TYR 25 -9.998 1.333 -7.737
155 HD1 TYR 25 HD1 TYR 25 -7.157 1.168 -8.408
156 HD2 TYR 25 HD2 TYR 25 -10.399 -1.271 -9.691
157 HE1 TYR 25 HE1 TYR 25 -5.923 0.620 -10.464
158 HE2 TYR 25 HE2 TYR 25 -9.174 -1.827 -11.749
159 HH TYR 25 HH TYR 25 -6.382 -0.150 -12.736
160 H SER 26 H SER 26 -9.785 2.432 -5.635
161 HA SER 26 HA SER 26 -7.802 4.249 -6.390
162 HB2 SER 26 1HB SER 26 -10.167 4.831 -5.808
163 HB3 SER 26 2HB SER 26 -9.763 4.587 -4.109
164 HG SER 26 HG SER 26 -9.339 6.667 -4.298
165 H SER 27 H SER 27 -8.411 2.710 -3.248
166 HA SER 27 HA SER 27 -6.592 3.943 -1.644
167 HB2 SER 27 1HB SER 27 -6.454 1.881 -0.352
168 HB3 SER 27 2HB SER 27 -8.107 2.114 -0.921
169 HG SER 27 HG SER 27 -7.846 0.141 -1.623
170 H LEU 28 H LEU 28 -5.936 1.589 -4.163
171 HA LEU 28 HA LEU 28 -3.162 1.288 -3.494
172 HB2 LEU 28 1HB LEU 28 -4.168 -0.545 -4.579
173 HB3 LEU 28 2HB LEU 28 -4.841 0.476 -5.847
174 HG LEU 28 HG LEU 28 -2.356 0.899 -6.473
175 HD11 LEU 28 1HD1 LEU 28 -0.975 -0.068 -4.981
176 HD12 LEU 28 2HD1 LEU 28 -1.258 -1.506 -5.961
177 HD13 LEU 28 3HD1 LEU 28 -2.175 -1.257 -4.475
178 HD21 LEU 28 3HD2 LEU 28 -2.987 -0.313 -8.220
179 HD22 LEU 28 1HD2 LEU 28 -4.308 -0.988 -7.267
180 HD23 LEU 28 2HD2 LEU 28 -2.742 -1.799 -7.301
181 H THR 29 H THR 29 -5.034 3.245 -5.731
182 HA THR 29 HA THR 29 -2.794 4.263 -7.172
183 HB THR 29 HB THR 29 -4.388 5.974 -8.020
184 HG1 THR 29 HG1 THR 29 -5.808 6.292 -6.370
185 HG21 THR 29 3HG2 THR 29 -4.185 3.738 -9.073
186 HG22 THR 29 1HG2 THR 29 -5.792 4.440 -9.257
187 HG23 THR 29 2HG2 THR 29 -5.516 3.173 -8.063
188 H THR 30 H THR 30 -4.319 5.068 -4.180
189 HA THR 30 HA THR 30 -3.269 7.749 -4.044
190 HB THR 30 HB THR 30 -5.385 6.791 -2.857
191 HG1 THR 30 HG1 THR 30 -4.358 8.934 -2.601
192 HG21 THR 30 3HG2 THR 30 -3.542 5.183 -1.633
193 HG22 THR 30 1HG2 THR 30 -5.151 5.537 -1.006
194 HG23 THR 30 2HG2 THR 30 -3.761 6.464 -0.441
195 H HIS 31 H HIS 31 -2.148 4.591 -3.299
196 HA HIS 31 HA HIS 31 -0.084 5.565 -1.481
197 HB2 HIS 31 1HB HIS 31 -0.814 3.550 -0.645
198 HB3 HIS 31 2HB HIS 31 -1.143 2.884 -2.242
199 HD1 HIS 31 HD1 HIS 31 1.865 3.767 -0.091
200 HD2 HIS 31 HD2 HIS 31 0.739 1.133 -3.100
201 HE1 HIS 31 HE1 HIS 31 3.823 2.218 -0.395
202 H GLN 32 H GLN 32 -0.362 3.945 -4.626
203 HA GLN 32 HA GLN 32 2.324 3.650 -5.224
204 HB2 GLN 32 1HB GLN 32 -0.099 4.099 -6.938
205 HB3 GLN 32 2HB GLN 32 1.499 3.979 -7.663
206 HG2 GLN 32 1HG GLN 32 1.693 1.774 -6.356
207 HG3 GLN 32 2HG GLN 32 -0.057 1.897 -6.184
208 HE21 GLN 32 1HE2 GLN 32 0.504 -0.245 -7.402
209 HE22 GLN 32 2HE2 GLN 32 0.366 -0.147 -9.121
210 H VAL 33 H VAL 33 0.562 6.518 -4.824
211 HA VAL 33 HA VAL 33 1.691 8.306 -6.598
212 HB VAL 33 HB VAL 33 -0.114 8.760 -4.862
213 HG11 VAL 33 1HG1 VAL 33 2.055 8.285 -3.111
214 HG12 VAL 33 2HG1 VAL 33 1.600 9.981 -2.943
215 HG13 VAL 33 3HG1 VAL 33 0.395 8.716 -2.703
216 HG21 VAL 33 3HG2 VAL 33 0.139 11.008 -5.163
217 HG22 VAL 33 1HG2 VAL 33 1.855 10.980 -4.756
218 HG23 VAL 33 2HG2 VAL 33 1.316 10.430 -6.342
219 H ILE 34 H ILE 34 3.172 6.664 -3.960
220 HA ILE 34 HA ILE 34 5.406 8.503 -3.771
221 HB ILE 34 HB ILE 34 6.287 7.041 -2.073
222 HG12 ILE 34 1HG1 ILE 34 3.991 5.140 -2.426
223 HG13 ILE 34 2HG1 ILE 34 5.450 4.950 -3.393
224 HG21 ILE 34 1HG2 ILE 34 3.539 6.804 -1.178
225 HG22 ILE 34 2HG2 ILE 34 4.848 7.805 -0.554
226 HG23 ILE 34 3HG2 ILE 34 3.872 8.375 -1.907
227 HD11 ILE 34 3HD1 ILE 34 5.007 3.875 -0.915
228 HD12 ILE 34 1HD1 ILE 34 6.577 4.064 -1.695
229 HD13 ILE 34 2HD1 ILE 34 6.003 5.286 -0.560
230 H HIS 35 H HIS 35 4.570 5.605 -5.452
231 HA HIS 35 HA HIS 35 7.331 4.987 -6.131
232 HB2 HIS 35 1HB HIS 35 4.720 3.671 -6.901
233 HB3 HIS 35 2HB HIS 35 6.303 3.109 -7.431
234 HD1 HIS 35 HD1 HIS 35 7.921 3.119 -4.913
235 HD2 HIS 35 HD2 HIS 35 3.946 1.912 -5.004
236 HE1 HIS 35 HE1 HIS 35 7.621 1.641 -2.901
237 H THR 36 H THR 36 4.441 6.332 -7.605
238 HA THR 36 HA THR 36 5.788 6.598 -10.182
239 HB THR 36 HB THR 36 3.506 5.858 -10.331
240 HG1 THR 36 HG1 THR 36 4.293 7.514 -11.846
241 HG21 THR 36 3HG2 THR 36 1.987 6.480 -8.827
242 HG22 THR 36 1HG2 THR 36 2.013 8.114 -9.489
243 HG23 THR 36 2HG2 THR 36 3.102 7.678 -8.171
244 H GLY 37 H GLY 37 5.997 8.240 -7.449
245 HA2 GLY 37 1HA GLY 37 6.325 10.804 -8.854
246 HA3 GLY 37 2HA GLY 37 5.423 10.755 -7.347
247 H GLU 38 H GLU 38 8.233 11.718 -8.491
248 HA GLU 38 HA GLU 38 9.547 11.473 -5.928
249 HB2 GLU 38 1HB GLU 38 10.146 9.436 -7.450
250 HB3 GLU 38 2HB GLU 38 11.156 10.597 -8.300
251 HG2 GLU 38 1HG GLU 38 12.012 11.113 -5.860
252 HG3 GLU 38 2HG GLU 38 11.440 9.472 -5.570
253 H LYS 39 H LYS 39 10.107 13.497 -5.516
254 HA LYS 39 HA LYS 39 10.353 15.526 -7.443
255 HB2 LYS 39 1HB LYS 39 11.186 15.324 -4.558
256 HB3 LYS 39 2HB LYS 39 11.509 16.770 -5.507
257 HG2 LYS 39 1HG LYS 39 8.751 15.617 -5.251
258 HG3 LYS 39 2HG LYS 39 9.412 16.760 -4.078
259 HD2 LYS 39 1HD LYS 39 9.412 17.357 -7.020
260 HD3 LYS 39 2HD LYS 39 8.001 17.690 -6.014
261 HE2 LYS 39 1HE LYS 39 9.046 19.366 -4.864
262 HE3 LYS 39 2HE LYS 39 10.647 18.658 -5.071
263 HZ1 LYS 39 3HZ LYS 39 10.296 19.262 -7.531
264 HZ2 LYS 39 1HZ LYS 39 10.701 20.495 -6.444
265 HZ3 LYS 39 2HZ LYS 39 9.100 20.312 -6.956
266 HA PRO 40 HA PRO 40 14.461 15.192 -8.956
267 HB2 PRO 40 1HB PRO 40 15.113 17.804 -9.303
268 HB3 PRO 40 2HB PRO 40 13.967 16.954 -10.346
269 HG2 PRO 40 1HG PRO 40 13.431 18.790 -8.043
270 HG3 PRO 40 2HG PRO 40 12.629 18.714 -9.623
271 HD2 PRO 40 1HD PRO 40 11.555 17.622 -7.390
272 HD3 PRO 40 2HD PRO 40 11.306 16.930 -9.006
273 H SER 41 H SER 41 16.510 15.050 -8.198
274 HA SER 41 HA SER 41 17.059 16.307 -5.592
275 HB2 SER 41 1HB SER 41 17.748 13.655 -6.758
276 HB3 SER 41 2HB SER 41 18.934 14.400 -5.686
277 HG SER 41 HG SER 41 17.258 14.575 -4.117
278 H GLY 42 H GLY 42 18.964 17.406 -5.250
279 HA2 GLY 42 1HA GLY 42 21.162 17.418 -7.025
280 HA3 GLY 42 2HA GLY 42 20.109 18.775 -7.397
281 HA PRO 43 HA PRO 43 23.133 20.095 -4.129
282 HB2 PRO 43 1HB PRO 43 23.824 22.411 -5.364
283 HB3 PRO 43 2HB PRO 43 24.622 20.870 -5.697
284 HG2 PRO 43 1HG PRO 43 22.471 22.262 -7.244
285 HG3 PRO 43 2HG PRO 43 23.922 21.435 -7.841
286 HD2 PRO 43 1HD PRO 43 21.472 20.282 -7.871
287 HD3 PRO 43 2HD PRO 43 22.964 19.347 -7.648
288 H SER 44 H SER 44 20.377 21.476 -5.708
289 HA SER 44 HA SER 44 19.878 23.134 -3.327
290 HB2 SER 44 1HB SER 44 20.570 24.408 -5.470
291 HB3 SER 44 2HB SER 44 18.968 23.980 -6.069
292 HG SER 44 HG SER 44 19.144 26.051 -4.949
293 H SER 45 H SER 45 18.927 20.602 -3.444
294 HA SER 45 HA SER 45 16.444 20.229 -4.682
295 HB2 SER 45 1HB SER 45 17.841 18.427 -3.642
296 HB3 SER 45 2HB SER 45 17.338 19.017 -2.057
297 HG SER 45 HG SER 45 16.101 17.242 -3.388
298 H GLY 46 H GLY 46 14.374 19.848 -3.351
299 HA2 GLY 46 1HA GLY 46 13.865 22.328 -1.869
300 HA3 GLY 46 2HA GLY 46 12.646 21.300 -2.607
Start of MODEL 3
1 H1 GLY 1 H GLY 1 0.912 -27.778 -4.417
2 HA2 GLY 1 1HA GLY 1 -1.234 -26.493 -5.621
3 HA3 GLY 1 2HA GLY 1 -1.872 -27.273 -4.182
4 H SER 2 H SER 2 -2.272 -25.562 -2.889
5 HA SER 2 HA SER 2 0.034 -23.863 -2.197
6 HB2 SER 2 1HB SER 2 -1.897 -22.772 -3.536
7 HB3 SER 2 2HB SER 2 -2.805 -22.878 -2.028
8 HG SER 2 HG SER 2 -1.690 -21.269 -1.271
9 H SER 3 H SER 3 -0.074 -22.928 -0.014
10 HA SER 3 HA SER 3 -1.394 -24.783 1.856
11 HB2 SER 3 1HB SER 3 0.410 -24.258 3.443
12 HB3 SER 3 2HB SER 3 1.061 -24.894 1.933
13 HG SER 3 HG SER 3 1.371 -22.420 3.077
14 H GLY 4 H GLY 4 -3.315 -23.651 2.100
15 HA2 GLY 4 1HA GLY 4 -4.732 -21.985 2.822
16 HA3 GLY 4 2HA GLY 4 -3.566 -21.835 4.129
17 H SER 5 H SER 5 -4.283 -19.569 4.095
18 HA SER 5 HA SER 5 -3.214 -17.999 1.866
19 HB2 SER 5 1HB SER 5 -5.146 -17.398 4.092
20 HB3 SER 5 2HB SER 5 -4.380 -16.094 3.184
21 HG SER 5 HG SER 5 -5.187 -17.496 1.294
22 H SER 6 H SER 6 -1.715 -16.345 2.157
23 HA SER 6 HA SER 6 0.090 -16.753 4.389
24 HB2 SER 6 1HB SER 6 1.589 -15.225 3.167
25 HB3 SER 6 2HB SER 6 1.013 -16.527 2.126
26 HG SER 6 HG SER 6 0.462 -14.933 0.866
27 H GLY 7 H GLY 7 -1.199 -15.926 6.100
28 HA2 GLY 7 1HA GLY 7 -1.018 -13.990 7.568
29 HA3 GLY 7 2HA GLY 7 -1.260 -12.974 6.154
30 H THR 8 H THR 8 -3.090 -11.904 6.622
31 HA THR 8 HA THR 8 -5.467 -13.521 7.280
32 HB THR 8 HB THR 8 -6.393 -11.471 8.366
33 HG1 THR 8 HG1 THR 8 -5.315 -9.707 7.895
34 HG21 THR 8 3HG2 THR 8 -3.853 -11.956 9.806
35 HG22 THR 8 1HG2 THR 8 -4.839 -13.372 9.445
36 HG23 THR 8 2HG2 THR 8 -5.517 -12.042 10.383
37 H GLY 9 H GLY 9 -6.548 -13.745 5.411
38 HA2 GLY 9 1HA GLY 9 -7.849 -13.150 3.611
39 HA3 GLY 9 2HA GLY 9 -7.812 -11.502 4.220
40 H VAL 10 H VAL 10 -7.801 -11.839 1.551
41 HA VAL 10 HA VAL 10 -5.112 -10.925 0.839
42 HB VAL 10 HB VAL 10 -5.224 -13.316 0.223
43 HG11 VAL 10 1HG1 VAL 10 -6.710 -13.966 -1.667
44 HG12 VAL 10 2HG1 VAL 10 -7.574 -13.585 -0.176
45 HG13 VAL 10 3HG1 VAL 10 -7.531 -12.415 -1.495
46 HG21 VAL 10 3HG2 VAL 10 -4.741 -12.937 -2.272
47 HG22 VAL 10 1HG2 VAL 10 -5.042 -11.234 -1.928
48 HG23 VAL 10 2HG2 VAL 10 -3.740 -12.084 -1.096
49 H LYS 11 H LYS 11 -5.071 -9.304 -0.643
50 HA LYS 11 HA LYS 11 -7.679 -8.402 -1.674
51 HB2 LYS 11 1HB LYS 11 -5.204 -6.807 -0.990
52 HB3 LYS 11 2HB LYS 11 -6.638 -6.134 -1.754
53 HG2 LYS 11 1HG LYS 11 -7.087 -5.601 0.403
54 HG3 LYS 11 2HG LYS 11 -7.821 -7.206 0.355
55 HD2 LYS 11 1HD LYS 11 -5.402 -7.967 1.065
56 HD3 LYS 11 2HD LYS 11 -5.290 -6.305 1.648
57 HE2 LYS 11 1HE LYS 11 -7.607 -6.852 2.736
58 HE3 LYS 11 2HE LYS 11 -7.074 -8.523 2.550
59 HZ1 LYS 11 3HZ LYS 11 -4.910 -7.411 3.641
60 HZ2 LYS 11 1HZ LYS 11 -6.139 -8.148 4.540
61 HZ3 LYS 11 2HZ LYS 11 -6.118 -6.467 4.354
62 HA PRO 12 HA PRO 12 -6.216 -9.036 -5.777
63 HB2 PRO 12 1HB PRO 12 -7.841 -7.301 -7.088
64 HB3 PRO 12 2HB PRO 12 -8.410 -8.839 -6.429
65 HG2 PRO 12 1HG PRO 12 -8.641 -6.085 -5.280
66 HG3 PRO 12 2HG PRO 12 -9.856 -7.374 -5.347
67 HD2 PRO 12 1HD PRO 12 -8.423 -6.838 -3.113
68 HD3 PRO 12 2HD PRO 12 -8.971 -8.476 -3.526
69 H TYR 13 H TYR 13 -6.518 -5.721 -4.578
70 HA TYR 13 HA TYR 13 -4.596 -4.764 -6.549
71 HB2 TYR 13 1HB TYR 13 -5.807 -3.104 -4.353
72 HB3 TYR 13 2HB TYR 13 -5.209 -2.581 -5.923
73 HD1 TYR 13 HD1 TYR 13 -6.505 -3.565 -7.992
74 HD2 TYR 13 HD2 TYR 13 -8.090 -3.335 -4.050
75 HE1 TYR 13 HE1 TYR 13 -8.785 -3.691 -8.907
76 HE2 TYR 13 HE2 TYR 13 -10.373 -3.461 -4.954
77 HH TYR 13 HH TYR 13 -11.154 -4.536 -7.835
78 H MET 14 H MET 14 -2.557 -5.317 -6.061
79 HA MET 14 HA MET 14 -1.560 -4.577 -3.392
80 HB2 MET 14 1HB MET 14 -1.175 -7.115 -4.922
81 HB3 MET 14 2HB MET 14 0.131 -6.538 -3.895
82 HG2 MET 14 1HG MET 14 -1.236 -6.650 -1.955
83 HG3 MET 14 2HG MET 14 -2.680 -6.947 -2.919
84 HE1 MET 14 3HE MET 14 -2.317 -9.535 -0.642
85 HE2 MET 14 1HE MET 14 -3.436 -8.601 -1.635
86 HE3 MET 14 2HE MET 14 -3.131 -10.297 -2.009
87 H CYS 15 H CYS 15 0.019 -3.128 -3.466
88 HA CYS 15 HA CYS 15 1.068 -2.125 -5.876
89 HB2 CYS 15 1HB CYS 15 0.962 -0.722 -3.912
90 HB3 CYS 15 2HB CYS 15 2.024 -1.811 -3.025
91 H ASN 16 H ASN 16 2.992 -2.426 -6.925
92 HA ASN 16 HA ASN 16 4.485 -4.833 -6.165
93 HB2 ASN 16 1HB ASN 16 3.733 -5.024 -8.392
94 HB3 ASN 16 2HB ASN 16 4.149 -3.353 -8.766
95 HD21 ASN 16 1HD2 ASN 16 5.744 -6.292 -7.572
96 HD22 ASN 16 2HD2 ASN 16 7.148 -6.137 -8.568
97 H GLU 17 H GLU 17 4.810 -1.398 -6.653
98 HA GLU 17 HA GLU 17 7.538 -1.090 -6.915
99 HB2 GLU 17 1HB GLU 17 5.413 0.576 -5.618
100 HB3 GLU 17 2HB GLU 17 7.098 1.062 -5.488
101 HG2 GLU 17 1HG GLU 17 5.856 2.137 -7.349
102 HG3 GLU 17 2HG GLU 17 7.304 1.265 -7.848
103 H CYS 18 H CYS 18 5.661 -1.395 -3.913
104 HA CYS 18 HA CYS 18 8.186 -1.927 -2.488
105 HB2 CYS 18 1HB CYS 18 7.059 -1.150 -0.447
106 HB3 CYS 18 2HB CYS 18 7.071 0.100 -1.687
107 H GLY 19 H GLY 19 4.749 -2.808 -2.676
108 HA2 GLY 19 1HA GLY 19 4.269 -5.219 -2.830
109 HA3 GLY 19 2HA GLY 19 5.487 -5.454 -1.585
110 H LYS 20 H LYS 20 2.586 -3.422 -2.017
111 HA LYS 20 HA LYS 20 1.793 -4.165 0.721
112 HB2 LYS 20 1HB LYS 20 1.406 -1.658 -0.882
113 HB3 LYS 20 2HB LYS 20 0.311 -2.042 0.439
114 HG2 LYS 20 1HG LYS 20 2.273 -2.180 1.952
115 HG3 LYS 20 2HG LYS 20 3.288 -1.634 0.615
116 HD2 LYS 20 1HD LYS 20 2.865 0.376 1.611
117 HD3 LYS 20 2HD LYS 20 1.481 0.300 0.518
118 HE2 LYS 20 1HE LYS 20 1.228 -0.880 3.241
119 HE3 LYS 20 2HE LYS 20 1.182 0.874 3.073
120 HZ1 LYS 20 3HZ LYS 20 -0.839 -1.028 2.494
121 HZ2 LYS 20 1HZ LYS 20 -0.487 -0.114 1.115
122 HZ3 LYS 20 2HZ LYS 20 -0.946 0.659 2.548
123 H ALA 21 H ALA 21 -0.766 -3.663 0.883
124 HA ALA 21 HA ALA 21 -2.170 -4.763 -1.424
125 HB1 ALA 21 3HB ALA 21 -2.744 -6.745 -0.544
126 HB2 ALA 21 1HB ALA 21 -1.340 -6.500 0.494
127 HB3 ALA 21 2HB ALA 21 -2.951 -6.080 1.076
128 H PHE 22 H PHE 22 -4.076 -3.793 -1.703
129 HA PHE 22 HA PHE 22 -5.341 -2.490 0.613
130 HB2 PHE 22 1HB PHE 22 -5.480 -1.284 -2.133
131 HB3 PHE 22 2HB PHE 22 -5.750 -0.515 -0.573
132 HD1 PHE 22 HD2 PHE 22 -3.052 -2.174 -2.534
133 HD2 PHE 22 HD1 PHE 22 -4.093 0.808 0.319
134 HE1 PHE 22 HE2 PHE 22 -0.728 -1.366 -2.536
135 HE2 PHE 22 HE1 PHE 22 -1.771 1.622 0.321
136 HZ PHE 22 HZ PHE 22 -0.085 0.534 -1.107
137 H SER 23 H SER 23 -7.582 -2.475 0.659
138 HA SER 23 HA SER 23 -8.853 -4.606 -0.766
139 HB2 SER 23 1HB SER 23 -9.368 -3.888 1.617
140 HB3 SER 23 2HB SER 23 -10.223 -2.510 0.924
141 HG SER 23 HG SER 23 -11.401 -4.201 -0.321
142 H VAL 24 H VAL 24 -9.027 -1.075 -0.857
143 HA VAL 24 HA VAL 24 -10.983 -1.118 -2.998
144 HB VAL 24 HB VAL 24 -9.526 1.212 -1.741
145 HG11 VAL 24 1HG1 VAL 24 -11.581 2.419 -2.788
146 HG12 VAL 24 2HG1 VAL 24 -10.182 2.041 -3.795
147 HG13 VAL 24 3HG1 VAL 24 -11.620 1.023 -3.864
148 HG21 VAL 24 3HG2 VAL 24 -12.256 1.292 -1.135
149 HG22 VAL 24 1HG2 VAL 24 -11.758 -0.378 -0.868
150 HG23 VAL 24 2HG2 VAL 24 -10.925 0.934 -0.035
151 H TYR 25 H TYR 25 -10.634 -0.261 -5.084
152 HA TYR 25 HA TYR 25 -8.133 -0.961 -6.234
153 HB2 TYR 25 1HB TYR 25 -10.121 -1.217 -7.555
154 HB3 TYR 25 2HB TYR 25 -10.540 0.481 -7.356
155 HD1 TYR 25 HD2 TYR 25 -7.368 -1.227 -8.355
156 HD2 TYR 25 HD1 TYR 25 -10.435 1.526 -9.413
157 HE1 TYR 25 HE2 TYR 25 -6.164 -0.693 -10.432
158 HE2 TYR 25 HE1 TYR 25 -9.240 2.067 -11.493
159 HH TYR 25 HH TYR 25 -7.547 0.899 -13.000
160 H SER 26 H SER 26 -9.796 2.190 -6.021
161 HA SER 26 HA SER 26 -7.733 3.767 -6.995
162 HB2 SER 26 1HB SER 26 -9.961 4.670 -6.682
163 HB3 SER 26 2HB SER 26 -9.847 4.445 -4.936
164 HG SER 26 HG SER 26 -7.863 5.971 -6.155
165 H SER 27 H SER 27 -8.375 2.715 -3.677
166 HA SER 27 HA SER 27 -6.557 4.180 -2.256
167 HB2 SER 27 1HB SER 27 -7.405 1.302 -1.960
168 HB3 SER 27 2HB SER 27 -6.310 2.071 -0.811
169 HG SER 27 HG SER 27 -8.656 3.431 -1.439
170 H LEU 28 H LEU 28 -5.920 1.234 -4.123
171 HA LEU 28 HA LEU 28 -3.233 0.900 -3.454
172 HB2 LEU 28 1HB LEU 28 -4.184 -0.888 -4.573
173 HB3 LEU 28 2HB LEU 28 -4.901 0.140 -5.812
174 HG LEU 28 HG LEU 28 -2.693 0.463 -6.820
175 HD11 LEU 28 1HD1 LEU 28 -1.053 -1.453 -5.818
176 HD12 LEU 28 2HD1 LEU 28 -1.835 -0.865 -4.352
177 HD13 LEU 28 3HD1 LEU 28 -0.971 0.259 -5.401
178 HD21 LEU 28 3HD2 LEU 28 -2.502 -1.679 -7.816
179 HD22 LEU 28 1HD2 LEU 28 -4.208 -1.456 -7.428
180 HD23 LEU 28 2HD2 LEU 28 -3.197 -2.475 -6.403
181 H THR 29 H THR 29 -4.692 2.718 -6.134
182 HA THR 29 HA THR 29 -2.245 3.602 -7.245
183 HB THR 29 HB THR 29 -3.547 5.159 -8.549
184 HG1 THR 29 HG1 THR 29 -5.984 5.002 -7.912
185 HG21 THR 29 3HG2 THR 29 -5.491 2.926 -8.369
186 HG22 THR 29 1HG2 THR 29 -3.814 2.507 -8.717
187 HG23 THR 29 2HG2 THR 29 -4.685 3.614 -9.778
188 H THR 30 H THR 30 -4.484 5.039 -4.912
189 HA THR 30 HA THR 30 -3.295 7.561 -4.705
190 HB THR 30 HB THR 30 -4.563 6.141 -2.370
191 HG1 THR 30 HG1 THR 30 -6.556 7.087 -3.314
192 HG21 THR 30 3HG2 THR 30 -4.907 8.208 -1.486
193 HG22 THR 30 1HG2 THR 30 -5.117 8.968 -3.062
194 HG23 THR 30 2HG2 THR 30 -3.497 8.598 -2.471
195 H HIS 31 H HIS 31 -2.184 4.503 -3.662
196 HA HIS 31 HA HIS 31 -0.368 5.627 -1.675
197 HB2 HIS 31 1HB HIS 31 -1.122 3.624 -0.832
198 HB3 HIS 31 2HB HIS 31 -1.252 2.880 -2.423
199 HD1 HIS 31 HD1 HIS 31 1.113 3.414 0.397
200 HD2 HIS 31 HD2 HIS 31 1.126 1.708 -3.390
201 HE1 HIS 31 HE1 HIS 31 3.230 2.062 0.277
202 H GLN 32 H GLN 32 -0.253 3.903 -4.770
203 HA GLN 32 HA GLN 32 2.459 3.597 -5.087
204 HB2 GLN 32 1HB GLN 32 0.287 4.187 -7.084
205 HB3 GLN 32 2HB GLN 32 1.954 3.940 -7.586
206 HG2 GLN 32 1HG GLN 32 1.906 1.721 -6.490
207 HG3 GLN 32 2HG GLN 32 0.197 1.973 -6.142
208 HE21 GLN 32 1HE2 GLN 32 1.068 -0.187 -7.603
209 HE22 GLN 32 2HE2 GLN 32 0.537 -0.025 -9.239
210 H VAL 33 H VAL 33 0.699 6.509 -4.903
211 HA VAL 33 HA VAL 33 2.224 8.242 -6.474
212 HB VAL 33 HB VAL 33 0.041 8.748 -5.261
213 HG11 VAL 33 1HG1 VAL 33 1.477 9.944 -3.017
214 HG12 VAL 33 2HG1 VAL 33 -0.039 9.042 -3.043
215 HG13 VAL 33 3HG1 VAL 33 1.500 8.181 -3.013
216 HG21 VAL 33 3HG2 VAL 33 0.382 10.908 -5.763
217 HG22 VAL 33 1HG2 VAL 33 1.757 11.044 -4.667
218 HG23 VAL 33 2HG2 VAL 33 1.981 10.374 -6.283
219 H ILE 34 H ILE 34 3.123 6.510 -3.717
220 HA ILE 34 HA ILE 34 5.103 8.399 -2.777
221 HB ILE 34 HB ILE 34 5.700 6.747 -1.137
222 HG12 ILE 34 1HG1 ILE 34 3.748 4.775 -2.272
223 HG13 ILE 34 2HG1 ILE 34 5.386 4.848 -2.914
224 HG21 ILE 34 1HG2 ILE 34 3.855 7.810 -0.309
225 HG22 ILE 34 2HG2 ILE 34 2.817 7.272 -1.627
226 HG23 ILE 34 3HG2 ILE 34 3.256 6.152 -0.338
227 HD11 ILE 34 3HD1 ILE 34 6.313 4.009 -1.017
228 HD12 ILE 34 1HD1 ILE 34 5.051 4.664 0.026
229 HD13 ILE 34 2HD1 ILE 34 4.733 3.228 -0.947
230 H HIS 35 H HIS 35 4.928 6.297 -5.335
231 HA HIS 35 HA HIS 35 7.847 5.892 -5.365
232 HB2 HIS 35 1HB HIS 35 5.784 4.296 -6.893
233 HB3 HIS 35 2HB HIS 35 7.506 3.952 -6.759
234 HD1 HIS 35 HD1 HIS 35 8.170 3.753 -3.967
235 HD2 HIS 35 HD2 HIS 35 4.393 2.641 -5.293
236 HE1 HIS 35 HE1 HIS 35 7.259 2.220 -2.193
237 H THR 36 H THR 36 5.966 8.129 -6.342
238 HA THR 36 HA THR 36 7.095 8.282 -9.060
239 HB THR 36 HB THR 36 5.113 9.561 -9.768
240 HG1 THR 36 HG1 THR 36 3.254 9.159 -8.147
241 HG21 THR 36 3HG2 THR 36 3.585 7.708 -9.948
242 HG22 THR 36 1HG2 THR 36 4.328 6.905 -8.565
243 HG23 THR 36 2HG2 THR 36 5.232 7.090 -10.068
244 H GLY 37 H GLY 37 8.875 9.461 -8.194
245 HA2 GLY 37 1HA GLY 37 8.890 12.150 -8.478
246 HA3 GLY 37 2HA GLY 37 8.395 11.949 -6.804
247 H GLU 38 H GLU 38 10.942 12.801 -8.456
248 HA GLU 38 HA GLU 38 13.025 11.084 -7.665
249 HB2 GLU 38 1HB GLU 38 13.253 12.795 -9.428
250 HB3 GLU 38 2HB GLU 38 13.141 14.056 -8.208
251 HG2 GLU 38 1HG GLU 38 15.409 13.904 -8.554
252 HG3 GLU 38 2HG GLU 38 15.177 12.876 -7.141
253 H LYS 39 H LYS 39 14.270 10.964 -5.867
254 HA LYS 39 HA LYS 39 13.482 12.674 -3.602
255 HB2 LYS 39 1HB LYS 39 14.644 9.882 -3.601
256 HB3 LYS 39 2HB LYS 39 14.302 10.829 -2.158
257 HG2 LYS 39 1HG LYS 39 12.149 10.228 -4.149
258 HG3 LYS 39 2HG LYS 39 12.601 9.057 -2.907
259 HD2 LYS 39 1HD LYS 39 12.107 10.673 -1.166
260 HD3 LYS 39 2HD LYS 39 11.744 11.903 -2.378
261 HE2 LYS 39 1HE LYS 39 9.639 11.136 -1.786
262 HE3 LYS 39 2HE LYS 39 9.997 10.198 -3.235
263 HZ1 LYS 39 3HZ LYS 39 9.192 9.152 -0.894
264 HZ2 LYS 39 1HZ LYS 39 10.870 8.967 -0.776
265 HZ3 LYS 39 2HZ LYS 39 10.035 8.297 -2.085
266 HA PRO 40 HA PRO 40 17.534 14.370 -3.434
267 HB2 PRO 40 1HB PRO 40 17.690 14.958 -0.788
268 HB3 PRO 40 2HB PRO 40 16.691 15.878 -1.920
269 HG2 PRO 40 1HG PRO 40 15.891 13.714 -0.012
270 HG3 PRO 40 2HG PRO 40 15.074 15.246 -0.372
271 HD2 PRO 40 1HD PRO 40 14.278 12.887 -1.435
272 HD3 PRO 40 2HD PRO 40 14.116 14.428 -2.302
273 H SER 41 H SER 41 16.702 11.454 -1.953
274 HA SER 41 HA SER 41 19.320 10.992 -0.768
275 HB2 SER 41 1HB SER 41 16.699 9.557 -0.753
276 HB3 SER 41 2HB SER 41 18.164 8.630 -0.435
277 HG SER 41 HG SER 41 16.999 10.699 1.053
278 H GLY 42 H GLY 42 17.272 9.487 -3.270
279 HA2 GLY 42 1HA GLY 42 18.317 9.013 -5.438
280 HA3 GLY 42 2HA GLY 42 19.757 8.531 -4.553
281 HA PRO 43 HA PRO 43 18.382 4.370 -4.844
282 HB2 PRO 43 1HB PRO 43 19.784 3.296 -2.781
283 HB3 PRO 43 2HB PRO 43 20.536 3.775 -4.308
284 HG2 PRO 43 1HG PRO 43 20.433 5.247 -1.703
285 HG3 PRO 43 2HG PRO 43 21.795 5.044 -2.820
286 HD2 PRO 43 1HD PRO 43 20.310 7.306 -2.731
287 HD3 PRO 43 2HD PRO 43 21.052 6.708 -4.230
288 H SER 44 H SER 44 16.256 4.178 -4.323
289 HA SER 44 HA SER 44 15.498 4.282 -1.488
290 HB2 SER 44 1HB SER 44 13.237 4.638 -2.212
291 HB3 SER 44 2HB SER 44 14.264 5.719 -3.153
292 HG SER 44 HG SER 44 14.213 3.659 -4.623
293 H SER 45 H SER 45 14.254 2.623 -0.554
294 HA SER 45 HA SER 45 14.423 0.047 -1.978
295 HB2 SER 45 1HB SER 45 14.636 -1.027 0.225
296 HB3 SER 45 2HB SER 45 15.923 0.150 -0.032
297 HG SER 45 HG SER 45 13.526 0.685 1.389
298 H GLY 46 H GLY 46 12.409 -0.148 -2.828
299 HA2 GLY 46 1HA GLY 46 10.168 -0.659 -2.852
300 HA3 GLY 46 2HA GLY 46 10.284 -0.912 -1.117
Start of MODEL 4
1 H1 GLY 1 H GLY 1 8.302 -23.358 13.105
2 HA2 GLY 1 1HA GLY 1 8.378 -20.700 14.257
3 HA3 GLY 1 2HA GLY 1 8.427 -21.100 12.547
4 H SER 2 H SER 2 6.941 -19.202 12.492
5 HA SER 2 HA SER 2 4.248 -20.116 12.220
6 HB2 SER 2 1HB SER 2 4.370 -19.669 14.679
7 HB3 SER 2 2HB SER 2 4.745 -17.985 14.311
8 HG SER 2 HG SER 2 2.510 -18.310 14.695
9 H SER 3 H SER 3 2.803 -18.371 11.416
10 HA SER 3 HA SER 3 4.148 -16.008 10.379
11 HB2 SER 3 1HB SER 3 3.163 -18.270 8.687
12 HB3 SER 3 2HB SER 3 3.008 -16.622 8.078
13 HG SER 3 HG SER 3 5.019 -17.800 7.568
14 H GLY 4 H GLY 4 2.759 -14.316 9.876
15 HA2 GLY 4 1HA GLY 4 0.061 -14.335 9.421
16 HA3 GLY 4 2HA GLY 4 0.200 -14.419 11.171
17 H SER 5 H SER 5 1.535 -12.562 8.436
18 HA SER 5 HA SER 5 1.989 -10.256 10.096
19 HB2 SER 5 1HB SER 5 2.219 -10.703 7.114
20 HB3 SER 5 2HB SER 5 2.599 -9.170 7.899
21 HG SER 5 HG SER 5 4.166 -11.272 7.617
22 H SER 6 H SER 6 -0.159 -9.906 10.882
23 HA SER 6 HA SER 6 -2.363 -9.213 10.768
24 HB2 SER 6 1HB SER 6 -0.877 -7.166 10.848
25 HB3 SER 6 2HB SER 6 -1.098 -7.028 9.104
26 HG SER 6 HG SER 6 -2.824 -6.421 11.150
27 H GLY 7 H GLY 7 -2.026 -11.172 8.853
28 HA2 GLY 7 1HA GLY 7 -3.471 -10.086 6.517
29 HA3 GLY 7 2HA GLY 7 -2.442 -11.509 6.467
30 H THR 8 H THR 8 -5.533 -10.231 7.497
31 HA THR 8 HA THR 8 -6.505 -12.710 8.551
32 HB THR 8 HB THR 8 -7.436 -10.590 9.333
33 HG1 THR 8 HG1 THR 8 -9.014 -12.568 8.166
34 HG21 THR 8 3HG2 THR 8 -7.253 -9.539 6.984
35 HG22 THR 8 1HG2 THR 8 -8.626 -9.089 7.994
36 HG23 THR 8 2HG2 THR 8 -8.833 -10.265 6.696
37 H GLY 9 H GLY 9 -6.909 -10.951 5.496
38 HA2 GLY 9 1HA GLY 9 -7.914 -13.460 4.311
39 HA3 GLY 9 2HA GLY 9 -8.703 -11.926 3.974
40 H VAL 10 H VAL 10 -8.195 -11.116 2.064
41 HA VAL 10 HA VAL 10 -5.503 -10.762 1.214
42 HB VAL 10 HB VAL 10 -5.704 -13.143 0.663
43 HG11 VAL 10 1HG1 VAL 10 -7.273 -13.760 -1.222
44 HG12 VAL 10 2HG1 VAL 10 -8.028 -13.444 0.341
45 HG13 VAL 10 3HG1 VAL 10 -8.084 -12.222 -0.930
46 HG21 VAL 10 3HG2 VAL 10 -4.262 -11.858 -0.739
47 HG22 VAL 10 1HG2 VAL 10 -5.173 -12.953 -1.779
48 HG23 VAL 10 2HG2 VAL 10 -5.624 -11.251 -1.681
49 H LYS 11 H LYS 11 -5.337 -9.276 -0.428
50 HA LYS 11 HA LYS 11 -7.886 -8.230 -1.476
51 HB2 LYS 11 1HB LYS 11 -5.329 -6.771 -0.793
52 HB3 LYS 11 2HB LYS 11 -6.676 -6.035 -1.653
53 HG2 LYS 11 1HG LYS 11 -7.131 -5.360 0.475
54 HG3 LYS 11 2HG LYS 11 -8.042 -6.872 0.429
55 HD2 LYS 11 1HD LYS 11 -5.734 -7.859 1.276
56 HD3 LYS 11 2HD LYS 11 -5.521 -6.207 1.861
57 HE2 LYS 11 1HE LYS 11 -7.232 -6.376 3.369
58 HE3 LYS 11 2HE LYS 11 -8.109 -7.563 2.406
59 HZ1 LYS 11 3HZ LYS 11 -7.329 -9.022 3.882
60 HZ2 LYS 11 1HZ LYS 11 -6.144 -7.966 4.467
61 HZ3 LYS 11 2HZ LYS 11 -5.848 -8.882 3.077
62 HA PRO 12 HA PRO 12 -6.421 -9.136 -5.529
63 HB2 PRO 12 1HB PRO 12 -7.970 -7.405 -6.934
64 HB3 PRO 12 2HB PRO 12 -8.602 -8.887 -6.208
65 HG2 PRO 12 1HG PRO 12 -8.735 -6.074 -5.192
66 HG3 PRO 12 2HG PRO 12 -9.998 -7.319 -5.208
67 HD2 PRO 12 1HD PRO 12 -8.559 -6.732 -2.990
68 HD3 PRO 12 2HD PRO 12 -9.167 -8.365 -3.330
69 H TYR 13 H TYR 13 -6.713 -5.710 -4.629
70 HA TYR 13 HA TYR 13 -4.737 -4.923 -6.594
71 HB2 TYR 13 1HB TYR 13 -5.880 -3.173 -4.423
72 HB3 TYR 13 2HB TYR 13 -5.220 -2.687 -5.981
73 HD1 TYR 13 HD1 TYR 13 -6.507 -3.467 -8.082
74 HD2 TYR 13 HD2 TYR 13 -8.177 -3.461 -4.169
75 HE1 TYR 13 HE1 TYR 13 -8.766 -3.498 -9.053
76 HE2 TYR 13 HE2 TYR 13 -10.441 -3.492 -5.129
77 HH TYR 13 HH TYR 13 -11.194 -4.389 -8.037
78 H MET 14 H MET 14 -2.667 -5.336 -6.189
79 HA MET 14 HA MET 14 -1.618 -4.679 -3.521
80 HB2 MET 14 1HB MET 14 -0.801 -7.056 -5.202
81 HB3 MET 14 2HB MET 14 -0.089 -6.594 -3.662
82 HG2 MET 14 1HG MET 14 -2.240 -6.976 -2.559
83 HG3 MET 14 2HG MET 14 -2.936 -7.460 -4.104
84 HE1 MET 14 3HE MET 14 -3.369 -9.561 -1.855
85 HE2 MET 14 1HE MET 14 -1.945 -10.446 -1.307
86 HE3 MET 14 2HE MET 14 -2.094 -8.721 -0.970
87 H CYS 15 H CYS 15 0.388 -3.714 -3.460
88 HA CYS 15 HA CYS 15 1.301 -2.596 -5.988
89 HB2 CYS 15 1HB CYS 15 1.053 -0.998 -4.228
90 HB3 CYS 15 2HB CYS 15 1.978 -1.994 -3.108
91 H ASN 16 H ASN 16 3.291 -2.929 -6.889
92 HA ASN 16 HA ASN 16 4.791 -5.217 -5.845
93 HB2 ASN 16 1HB ASN 16 4.571 -3.931 -8.550
94 HB3 ASN 16 2HB ASN 16 5.938 -4.974 -8.170
95 HD21 ASN 16 1HD2 ASN 16 2.405 -4.952 -7.822
96 HD22 ASN 16 2HD2 ASN 16 2.179 -6.596 -8.300
97 H GLU 17 H GLU 17 5.124 -1.824 -6.660
98 HA GLU 17 HA GLU 17 7.815 -1.419 -6.708
99 HB2 GLU 17 1HB GLU 17 5.649 0.234 -5.420
100 HB3 GLU 17 2HB GLU 17 7.318 0.782 -5.506
101 HG2 GLU 17 1HG GLU 17 6.193 1.770 -7.322
102 HG3 GLU 17 2HG GLU 17 7.181 0.475 -7.995
103 H CYS 18 H CYS 18 5.843 -1.427 -3.735
104 HA CYS 18 HA CYS 18 8.303 -1.951 -2.206
105 HB2 CYS 18 1HB CYS 18 7.135 -1.048 -0.263
106 HB3 CYS 18 2HB CYS 18 7.109 0.115 -1.585
107 H GLY 19 H GLY 19 4.920 -2.921 -2.595
108 HA2 GLY 19 1HA GLY 19 4.436 -5.312 -2.595
109 HA3 GLY 19 2HA GLY 19 5.620 -5.485 -1.307
110 H LYS 20 H LYS 20 2.718 -3.498 -1.914
111 HA LYS 20 HA LYS 20 1.825 -4.175 0.812
112 HB2 LYS 20 1HB LYS 20 1.751 -1.643 -0.749
113 HB3 LYS 20 2HB LYS 20 0.385 -1.980 0.307
114 HG2 LYS 20 1HG LYS 20 2.068 -2.337 2.157
115 HG3 LYS 20 2HG LYS 20 3.274 -1.657 1.061
116 HD2 LYS 20 1HD LYS 20 1.582 0.298 0.824
117 HD3 LYS 20 2HD LYS 20 0.901 -0.337 2.324
118 HE2 LYS 20 1HE LYS 20 3.840 0.170 2.104
119 HE3 LYS 20 2HE LYS 20 2.734 1.508 2.411
120 HZ1 LYS 20 3HZ LYS 20 3.807 -0.024 4.322
121 HZ2 LYS 20 1HZ LYS 20 2.334 -0.821 4.082
122 HZ3 LYS 20 2HZ LYS 20 2.351 0.819 4.495
123 H ALA 21 H ALA 21 -0.710 -3.642 0.906
124 HA ALA 21 HA ALA 21 -2.051 -4.715 -1.461
125 HB1 ALA 21 3HB ALA 21 -2.130 -6.750 -0.537
126 HB2 ALA 21 1HB ALA 21 -1.673 -6.146 1.056
127 HB3 ALA 21 2HB ALA 21 -3.355 -6.065 0.531
128 H PHE 22 H PHE 22 -4.185 -4.092 -1.682
129 HA PHE 22 HA PHE 22 -5.423 -2.543 0.459
130 HB2 PHE 22 1HB PHE 22 -5.300 -1.391 -2.321
131 HB3 PHE 22 2HB PHE 22 -5.777 -0.592 -0.827
132 HD1 PHE 22 HD2 PHE 22 -2.895 -1.991 -2.669
133 HD2 PHE 22 HD1 PHE 22 -4.199 0.507 0.521
134 HE1 PHE 22 HE2 PHE 22 -0.599 -1.151 -2.392
135 HE2 PHE 22 HE1 PHE 22 -1.905 1.352 0.802
136 HZ PHE 22 HZ PHE 22 -0.101 0.522 -0.654
137 H SER 23 H SER 23 -7.629 -2.625 0.465
138 HA SER 23 HA SER 23 -8.850 -4.660 -1.147
139 HB2 SER 23 1HB SER 23 -9.397 -4.161 1.287
140 HB3 SER 23 2HB SER 23 -10.270 -2.743 0.707
141 HG SER 23 HG SER 23 -11.831 -3.986 0.026
142 H VAL 24 H VAL 24 -8.964 -1.142 -0.990
143 HA VAL 24 HA VAL 24 -10.949 -1.004 -3.110
144 HB VAL 24 HB VAL 24 -9.468 1.247 -1.743
145 HG11 VAL 24 1HG1 VAL 24 -11.597 1.119 -3.807
146 HG12 VAL 24 2HG1 VAL 24 -11.712 2.385 -2.583
147 HG13 VAL 24 3HG1 VAL 24 -10.280 2.274 -3.608
148 HG21 VAL 24 3HG2 VAL 24 -11.476 -0.472 -0.731
149 HG22 VAL 24 1HG2 VAL 24 -10.800 0.978 0.012
150 HG23 VAL 24 2HG2 VAL 24 -12.222 1.099 -1.024
151 H TYR 25 H TYR 25 -10.576 -0.394 -5.190
152 HA TYR 25 HA TYR 25 -8.055 -0.858 -6.323
153 HB2 TYR 25 1HB TYR 25 -9.937 -1.154 -7.725
154 HB3 TYR 25 2HB TYR 25 -10.551 0.459 -7.379
155 HD1 TYR 25 HD2 TYR 25 -7.293 -0.916 -8.612
156 HD2 TYR 25 HD1 TYR 25 -10.484 1.832 -9.223
157 HE1 TYR 25 HE2 TYR 25 -6.165 -0.062 -10.623
158 HE2 TYR 25 HE1 TYR 25 -9.365 2.693 -11.237
159 HH TYR 25 HH TYR 25 -6.488 2.572 -11.937
160 H SER 26 H SER 26 -9.761 2.183 -5.652
161 HA SER 26 HA SER 26 -7.833 3.919 -6.710
162 HB2 SER 26 1HB SER 26 -10.266 4.368 -5.833
163 HB3 SER 26 2HB SER 26 -9.447 4.695 -4.305
164 HG SER 26 HG SER 26 -9.797 6.495 -5.912
165 H SER 27 H SER 27 -8.223 2.598 -3.447
166 HA SER 27 HA SER 27 -6.342 4.002 -2.046
167 HB2 SER 27 1HB SER 27 -7.325 1.189 -1.896
168 HB3 SER 27 2HB SER 27 -5.914 1.624 -0.932
169 HG SER 27 HG SER 27 -8.341 3.088 -0.899
170 H LEU 28 H LEU 28 -5.792 1.323 -4.277
171 HA LEU 28 HA LEU 28 -3.059 0.947 -3.784
172 HB2 LEU 28 1HB LEU 28 -4.215 -0.704 -5.016
173 HB3 LEU 28 2HB LEU 28 -4.771 0.469 -6.207
174 HG LEU 28 HG LEU 28 -2.415 0.706 -6.980
175 HD11 LEU 28 1HD1 LEU 28 -1.224 -1.629 -6.146
176 HD12 LEU 28 2HD1 LEU 28 -1.970 -1.009 -4.674
177 HD13 LEU 28 3HD1 LEU 28 -0.836 -0.005 -5.578
178 HD21 LEU 28 3HD2 LEU 28 -3.661 -2.038 -7.073
179 HD22 LEU 28 1HD2 LEU 28 -2.339 -1.504 -8.111
180 HD23 LEU 28 2HD2 LEU 28 -3.912 -0.712 -8.210
181 H THR 29 H THR 29 -4.695 2.952 -6.224
182 HA THR 29 HA THR 29 -2.329 4.008 -7.353
183 HB THR 29 HB THR 29 -3.748 5.671 -8.418
184 HG1 THR 29 HG1 THR 29 -6.130 5.362 -7.784
185 HG21 THR 29 3HG2 THR 29 -5.667 3.932 -9.118
186 HG22 THR 29 1HG2 THR 29 -4.538 2.819 -8.349
187 HG23 THR 29 2HG2 THR 29 -4.008 3.816 -9.704
188 H THR 30 H THR 30 -4.475 5.146 -4.786
189 HA THR 30 HA THR 30 -3.376 7.687 -4.411
190 HB THR 30 HB THR 30 -4.511 5.925 -2.233
191 HG1 THR 30 HG1 THR 30 -5.747 6.496 -4.372
192 HG21 THR 30 3HG2 THR 30 -3.340 8.086 -1.613
193 HG22 THR 30 1HG2 THR 30 -5.013 7.935 -1.079
194 HG23 THR 30 2HG2 THR 30 -4.623 8.925 -2.485
195 H HIS 31 H HIS 31 -2.276 4.539 -3.379
196 HA HIS 31 HA HIS 31 -0.288 5.623 -1.573
197 HB2 HIS 31 1HB HIS 31 -0.979 3.585 -0.758
198 HB3 HIS 31 2HB HIS 31 -1.196 2.895 -2.363
199 HD1 HIS 31 HD1 HIS 31 1.513 3.680 0.143
200 HD2 HIS 31 HD2 HIS 31 0.942 1.455 -3.319
201 HE1 HIS 31 HE1 HIS 31 3.582 2.271 -0.100
202 H GLN 32 H GLN 32 -0.329 3.941 -4.701
203 HA GLN 32 HA GLN 32 2.351 3.693 -5.200
204 HB2 GLN 32 1HB GLN 32 0.044 4.297 -7.029
205 HB3 GLN 32 2HB GLN 32 1.678 4.130 -7.657
206 HG2 GLN 32 1HG GLN 32 1.809 1.871 -6.786
207 HG3 GLN 32 2HG GLN 32 0.200 2.033 -6.084
208 HE21 GLN 32 1HE2 GLN 32 1.257 0.154 -8.086
209 HE22 GLN 32 2HE2 GLN 32 0.228 0.315 -9.464
210 H VAL 33 H VAL 33 0.556 6.587 -4.880
211 HA VAL 33 HA VAL 33 1.977 8.375 -6.471
212 HB VAL 33 HB VAL 33 -0.132 8.805 -5.080
213 HG11 VAL 33 1HG1 VAL 33 1.577 9.957 -2.969
214 HG12 VAL 33 2HG1 VAL 33 -0.025 9.225 -2.862
215 HG13 VAL 33 3HG1 VAL 33 1.408 8.202 -2.960
216 HG21 VAL 33 3HG2 VAL 33 0.118 11.024 -5.473
217 HG22 VAL 33 1HG2 VAL 33 1.693 11.097 -4.682
218 HG23 VAL 33 2HG2 VAL 33 1.560 10.468 -6.324
219 H ILE 34 H ILE 34 3.043 6.600 -3.790
220 HA ILE 34 HA ILE 34 5.076 8.479 -2.953
221 HB ILE 34 HB ILE 34 5.778 6.799 -1.376
222 HG12 ILE 34 1HG1 ILE 34 3.722 4.846 -2.306
223 HG13 ILE 34 2HG1 ILE 34 5.239 4.939 -3.193
224 HG21 ILE 34 1HG2 ILE 34 4.080 7.529 -0.147
225 HG22 ILE 34 2HG2 ILE 34 3.080 7.751 -1.582
226 HG23 ILE 34 3HG2 ILE 34 3.113 6.189 -0.762
227 HD11 ILE 34 3HD1 ILE 34 4.753 4.112 -0.366
228 HD12 ILE 34 1HD1 ILE 34 5.628 3.271 -1.646
229 HD13 ILE 34 2HD1 ILE 34 6.339 4.690 -0.876
230 H HIS 35 H HIS 35 4.756 5.941 -5.245
231 HA HIS 35 HA HIS 35 7.649 5.620 -5.512
232 HB2 HIS 35 1HB HIS 35 5.382 4.198 -6.923
233 HB3 HIS 35 2HB HIS 35 7.092 3.815 -7.098
234 HD1 HIS 35 HD1 HIS 35 8.232 3.293 -4.557
235 HD2 HIS 35 HD2 HIS 35 4.186 2.561 -5.152
236 HE1 HIS 35 HE1 HIS 35 7.568 1.678 -2.748
237 H THR 36 H THR 36 4.901 7.039 -7.114
238 HA THR 36 HA THR 36 6.711 8.084 -9.192
239 HB THR 36 HB THR 36 5.382 6.683 -10.471
240 HG1 THR 36 HG1 THR 36 4.412 8.119 -11.732
241 HG21 THR 36 3HG2 THR 36 3.880 6.017 -8.618
242 HG22 THR 36 1HG2 THR 36 3.017 6.280 -10.133
243 HG23 THR 36 2HG2 THR 36 2.961 7.502 -8.861
244 H GLY 37 H GLY 37 7.056 10.145 -8.609
245 HA2 GLY 37 1HA GLY 37 5.158 11.728 -7.193
246 HA3 GLY 37 2HA GLY 37 6.653 12.302 -7.916
247 H GLU 38 H GLU 38 5.295 14.202 -8.404
248 HA GLU 38 HA GLU 38 3.399 13.819 -10.592
249 HB2 GLU 38 1HB GLU 38 4.127 16.309 -9.040
250 HB3 GLU 38 2HB GLU 38 2.870 16.206 -10.265
251 HG2 GLU 38 1HG GLU 38 1.868 14.363 -8.779
252 HG3 GLU 38 2HG GLU 38 2.929 15.007 -7.526
253 H LYS 39 H LYS 39 4.808 13.299 -12.281
254 HA LYS 39 HA LYS 39 6.695 15.406 -13.088
255 HB2 LYS 39 1HB LYS 39 7.292 12.840 -12.779
256 HB3 LYS 39 2HB LYS 39 6.647 12.732 -14.411
257 HG2 LYS 39 1HG LYS 39 8.318 14.084 -15.296
258 HG3 LYS 39 2HG LYS 39 8.741 14.755 -13.719
259 HD2 LYS 39 1HD LYS 39 9.298 12.212 -13.206
260 HD3 LYS 39 2HD LYS 39 9.510 12.163 -14.957
261 HE2 LYS 39 1HE LYS 39 11.625 12.750 -14.346
262 HE3 LYS 39 2HE LYS 39 10.912 14.357 -14.478
263 HZ1 LYS 39 3HZ LYS 39 11.920 12.996 -12.166
264 HZ2 LYS 39 1HZ LYS 39 10.369 13.625 -11.921
265 HZ3 LYS 39 2HZ LYS 39 11.628 14.645 -12.405
266 HA PRO 40 HA PRO 40 4.030 16.538 -16.410
267 HB2 PRO 40 1HB PRO 40 5.860 17.757 -18.002
268 HB3 PRO 40 2HB PRO 40 5.244 18.486 -16.514
269 HG2 PRO 40 1HG PRO 40 7.810 17.017 -16.981
270 HG3 PRO 40 2HG PRO 40 7.524 18.505 -16.059
271 HD2 PRO 40 1HD PRO 40 7.803 16.086 -14.873
272 HD3 PRO 40 2HD PRO 40 6.760 17.361 -14.210
273 H SER 41 H SER 41 6.421 14.196 -16.600
274 HA SER 41 HA SER 41 5.772 13.589 -19.409
275 HB2 SER 41 1HB SER 41 8.200 12.880 -17.753
276 HB3 SER 41 2HB SER 41 7.870 12.182 -19.338
277 HG SER 41 HG SER 41 8.572 13.949 -20.218
278 H GLY 42 H GLY 42 4.472 11.919 -19.750
279 HA2 GLY 42 1HA GLY 42 4.188 9.916 -17.601
280 HA3 GLY 42 2HA GLY 42 2.925 10.340 -18.746
281 HA PRO 43 HA PRO 43 4.077 6.821 -21.110
282 HB2 PRO 43 1HB PRO 43 3.039 7.545 -23.511
283 HB3 PRO 43 2HB PRO 43 2.038 7.033 -22.147
284 HG2 PRO 43 1HG PRO 43 2.665 9.800 -23.103
285 HG3 PRO 43 2HG PRO 43 1.116 9.127 -22.563
286 HD2 PRO 43 1HD PRO 43 2.670 10.668 -20.968
287 HD3 PRO 43 2HD PRO 43 1.647 9.363 -20.333
288 H SER 44 H SER 44 6.388 7.430 -20.906
289 HA SER 44 HA SER 44 7.500 7.962 -23.545
290 HB2 SER 44 1HB SER 44 7.332 10.105 -21.993
291 HB3 SER 44 2HB SER 44 8.786 9.414 -21.273
292 HG SER 44 HG SER 44 8.682 9.545 -24.051
293 H SER 45 H SER 45 9.926 7.601 -23.526
294 HA SER 45 HA SER 45 10.441 5.057 -22.337
295 HB2 SER 45 1HB SER 45 12.398 6.887 -23.744
296 HB3 SER 45 2HB SER 45 12.573 5.152 -23.483
297 HG SER 45 HG SER 45 10.981 4.764 -24.941
298 H GLY 46 H GLY 46 12.795 4.802 -21.347
299 HA2 GLY 46 1HA GLY 46 12.758 5.697 -18.758
300 HA3 GLY 46 2HA GLY 46 14.230 5.230 -19.598
Start of MODEL 5
1 H1 GLY 1 H GLY 1 11.118 -31.825 7.303
2 HA2 GLY 1 1HA GLY 1 9.982 -31.254 4.645
3 HA3 GLY 1 2HA GLY 1 8.916 -31.550 6.010
4 H SER 2 H SER 2 10.101 -29.171 4.173
5 HA SER 2 HA SER 2 9.957 -27.220 6.373
6 HB2 SER 2 1HB SER 2 11.900 -27.328 4.072
7 HB3 SER 2 2HB SER 2 11.551 -25.817 4.912
8 HG SER 2 HG SER 2 13.352 -26.888 5.817
9 H SER 3 H SER 3 8.115 -26.147 6.135
10 HA SER 3 HA SER 3 7.478 -25.007 3.517
11 HB2 SER 3 1HB SER 3 5.657 -26.762 5.157
12 HB3 SER 3 2HB SER 3 5.017 -25.591 4.004
13 HG SER 3 HG SER 3 5.310 -27.679 3.083
14 H GLY 4 H GLY 4 6.091 -23.159 3.607
15 HA2 GLY 4 1HA GLY 4 5.239 -22.098 6.138
16 HA3 GLY 4 2HA GLY 4 6.663 -21.284 5.507
17 H SER 5 H SER 5 3.441 -22.348 4.415
18 HA SER 5 HA SER 5 3.196 -19.773 3.003
19 HB2 SER 5 1HB SER 5 2.155 -22.478 2.126
20 HB3 SER 5 2HB SER 5 1.797 -20.951 1.318
21 HG SER 5 HG SER 5 4.204 -22.383 1.446
22 H SER 6 H SER 6 2.077 -18.776 4.670
23 HA SER 6 HA SER 6 -0.736 -19.319 4.760
24 HB2 SER 6 1HB SER 6 0.954 -19.818 7.217
25 HB3 SER 6 2HB SER 6 -0.791 -19.565 7.275
26 HG SER 6 HG SER 6 -0.548 -21.730 7.136
27 H GLY 7 H GLY 7 -1.911 -17.705 6.065
28 HA2 GLY 7 1HA GLY 7 -1.531 -15.635 7.458
29 HA3 GLY 7 2HA GLY 7 -0.361 -15.195 6.223
30 H THR 8 H THR 8 -1.172 -13.517 5.151
31 HA THR 8 HA THR 8 -3.762 -13.832 3.843
32 HB THR 8 HB THR 8 -4.410 -11.489 4.452
33 HG1 THR 8 HG1 THR 8 -3.148 -10.344 5.720
34 HG21 THR 8 3HG2 THR 8 -5.503 -13.300 5.583
35 HG22 THR 8 1HG2 THR 8 -5.126 -12.063 6.781
36 HG23 THR 8 2HG2 THR 8 -4.132 -13.517 6.670
37 H GLY 9 H GLY 9 -3.302 -13.577 1.758
38 HA2 GLY 9 1HA GLY 9 -2.159 -11.143 0.786
39 HA3 GLY 9 2HA GLY 9 -1.037 -12.488 0.641
40 H VAL 10 H VAL 10 -4.478 -11.806 -0.011
41 HA VAL 10 HA VAL 10 -4.126 -13.117 -2.627
42 HB VAL 10 HB VAL 10 -5.448 -14.587 -1.236
43 HG11 VAL 10 1HG1 VAL 10 -6.263 -12.447 0.123
44 HG12 VAL 10 2HG1 VAL 10 -7.666 -12.647 -0.929
45 HG13 VAL 10 3HG1 VAL 10 -7.157 -13.966 0.126
46 HG21 VAL 10 3HG2 VAL 10 -6.052 -14.339 -3.620
47 HG22 VAL 10 1HG2 VAL 10 -7.425 -14.793 -2.611
48 HG23 VAL 10 2HG2 VAL 10 -7.251 -13.128 -3.166
49 H LYS 11 H LYS 11 -5.046 -10.350 -0.918
50 HA LYS 11 HA LYS 11 -7.078 -9.142 -2.222
51 HB2 LYS 11 1HB LYS 11 -4.432 -7.956 -1.390
52 HB3 LYS 11 2HB LYS 11 -5.774 -6.977 -1.968
53 HG2 LYS 11 1HG LYS 11 -6.278 -8.877 0.259
54 HG3 LYS 11 2HG LYS 11 -5.374 -7.398 0.598
55 HD2 LYS 11 1HD LYS 11 -7.169 -6.044 0.181
56 HD3 LYS 11 2HD LYS 11 -7.886 -7.168 -0.976
57 HE2 LYS 11 1HE LYS 11 -8.151 -8.665 1.183
58 HE3 LYS 11 2HE LYS 11 -8.085 -7.101 1.993
59 HZ1 LYS 11 3HZ LYS 11 -9.890 -7.426 -0.295
60 HZ2 LYS 11 1HZ LYS 11 -10.045 -6.432 1.065
61 HZ3 LYS 11 2HZ LYS 11 -10.344 -8.092 1.192
62 HA PRO 12 HA PRO 12 -6.078 -8.898 -6.503
63 HB2 PRO 12 1HB PRO 12 -7.705 -6.841 -7.204
64 HB3 PRO 12 2HB PRO 12 -8.308 -8.463 -6.845
65 HG2 PRO 12 1HG PRO 12 -8.238 -6.037 -5.092
66 HG3 PRO 12 2HG PRO 12 -9.537 -7.224 -5.308
67 HD2 PRO 12 1HD PRO 12 -7.855 -7.275 -3.186
68 HD3 PRO 12 2HD PRO 12 -8.551 -8.749 -3.889
69 H TYR 13 H TYR 13 -6.374 -5.709 -4.922
70 HA TYR 13 HA TYR 13 -4.361 -4.596 -6.687
71 HB2 TYR 13 1HB TYR 13 -5.541 -3.150 -4.336
72 HB3 TYR 13 2HB TYR 13 -4.979 -2.495 -5.870
73 HD1 TYR 13 HD1 TYR 13 -6.342 -3.141 -7.974
74 HD2 TYR 13 HD2 TYR 13 -7.812 -3.536 -4.001
75 HE1 TYR 13 HE1 TYR 13 -8.646 -3.170 -8.835
76 HE2 TYR 13 HE2 TYR 13 -10.119 -3.567 -4.851
77 HH TYR 13 HH TYR 13 -10.804 -3.608 -8.308
78 H MET 14 H MET 14 -2.417 -5.527 -6.167
79 HA MET 14 HA MET 14 -1.385 -4.908 -3.479
80 HB2 MET 14 1HB MET 14 -1.739 -7.301 -3.618
81 HB3 MET 14 2HB MET 14 -0.860 -7.378 -5.139
82 HG2 MET 14 1HG MET 14 1.185 -6.686 -3.981
83 HG3 MET 14 2HG MET 14 0.298 -6.649 -2.459
84 HE1 MET 14 3HE MET 14 0.079 -8.126 -1.020
85 HE2 MET 14 1HE MET 14 -0.035 -9.881 -1.162
86 HE3 MET 14 2HE MET 14 1.541 -9.112 -0.972
87 H CYS 15 H CYS 15 0.143 -3.414 -3.620
88 HA CYS 15 HA CYS 15 1.401 -2.640 -6.014
89 HB2 CYS 15 1HB CYS 15 1.168 -1.086 -4.166
90 HB3 CYS 15 2HB CYS 15 2.168 -2.107 -3.138
91 H ASN 16 H ASN 16 3.462 -2.981 -6.812
92 HA ASN 16 HA ASN 16 4.802 -5.378 -5.769
93 HB2 ASN 16 1HB ASN 16 4.552 -4.157 -8.483
94 HB3 ASN 16 2HB ASN 16 5.996 -5.098 -8.119
95 HD21 ASN 16 1HD2 ASN 16 2.497 -5.193 -8.298
96 HD22 ASN 16 2HD2 ASN 16 2.366 -6.903 -8.504
97 H GLU 17 H GLU 17 5.188 -1.988 -6.298
98 HA GLU 17 HA GLU 17 7.968 -1.759 -6.383
99 HB2 GLU 17 1HB GLU 17 5.822 0.079 -5.341
100 HB3 GLU 17 2HB GLU 17 7.521 0.529 -5.315
101 HG2 GLU 17 1HG GLU 17 5.812 -0.053 -7.715
102 HG3 GLU 17 2HG GLU 17 6.551 1.480 -7.258
103 H CYS 18 H CYS 18 5.787 -1.672 -3.571
104 HA CYS 18 HA CYS 18 8.126 -2.167 -1.849
105 HB2 CYS 18 1HB CYS 18 6.882 -1.134 -0.029
106 HB3 CYS 18 2HB CYS 18 6.964 -0.033 -1.401
107 H GLY 19 H GLY 19 4.722 -3.000 -2.387
108 HA2 GLY 19 1HA GLY 19 4.121 -5.363 -2.341
109 HA3 GLY 19 2HA GLY 19 5.244 -5.556 -1.003
110 H LYS 20 H LYS 20 2.565 -3.309 -1.701
111 HA LYS 20 HA LYS 20 1.457 -3.989 0.944
112 HB2 LYS 20 1HB LYS 20 1.745 -1.405 -0.502
113 HB3 LYS 20 2HB LYS 20 0.296 -1.628 0.469
114 HG2 LYS 20 1HG LYS 20 1.558 -1.914 2.452
115 HG3 LYS 20 2HG LYS 20 3.069 -2.048 1.548
116 HD2 LYS 20 1HD LYS 20 3.122 0.227 1.060
117 HD3 LYS 20 2HD LYS 20 1.395 0.430 1.363
118 HE2 LYS 20 1HE LYS 20 2.500 1.427 3.196
119 HE3 LYS 20 2HE LYS 20 1.888 -0.120 3.781
120 HZ1 LYS 20 3HZ LYS 20 4.639 0.102 2.744
121 HZ2 LYS 20 1HZ LYS 20 3.995 -1.033 3.820
122 HZ3 LYS 20 2HZ LYS 20 4.287 0.550 4.337
123 H ALA 21 H ALA 21 -0.600 -4.684 1.068
124 HA ALA 21 HA ALA 21 -2.070 -4.975 -1.451
125 HB1 ALA 21 3HB ALA 21 -1.859 -7.066 -0.445
126 HB2 ALA 21 1HB ALA 21 -2.173 -6.428 1.169
127 HB3 ALA 21 2HB ALA 21 -3.487 -6.554 -0.001
128 H PHE 22 H PHE 22 -4.018 -4.053 -1.804
129 HA PHE 22 HA PHE 22 -5.290 -2.611 0.421
130 HB2 PHE 22 1HB PHE 22 -5.178 -1.492 -2.375
131 HB3 PHE 22 2HB PHE 22 -5.635 -0.668 -0.888
132 HD1 PHE 22 HD1 PHE 22 -3.950 0.109 0.674
133 HD2 PHE 22 HD2 PHE 22 -2.868 -1.820 -2.962
134 HE1 PHE 22 HE1 PHE 22 -1.642 0.920 0.935
135 HE2 PHE 22 HE2 PHE 22 -0.558 -1.013 -2.707
136 HZ PHE 22 HZ PHE 22 0.058 0.359 -0.756
137 H SER 23 H SER 23 -7.493 -2.658 0.477
138 HA SER 23 HA SER 23 -8.778 -4.622 -1.210
139 HB2 SER 23 1HB SER 23 -10.736 -4.257 0.257
140 HB3 SER 23 2HB SER 23 -9.275 -4.597 1.184
141 HG SER 23 HG SER 23 -10.299 -2.001 0.662
142 H VAL 24 H VAL 24 -8.601 -1.170 -0.949
143 HA VAL 24 HA VAL 24 -10.829 -0.823 -2.821
144 HB VAL 24 HB VAL 24 -9.237 1.281 -1.348
145 HG11 VAL 24 1HG1 VAL 24 -10.435 2.866 -2.395
146 HG12 VAL 24 2HG1 VAL 24 -10.706 1.616 -3.611
147 HG13 VAL 24 3HG1 VAL 24 -11.916 1.910 -2.361
148 HG21 VAL 24 3HG2 VAL 24 -11.981 1.073 -0.546
149 HG22 VAL 24 1HG2 VAL 24 -11.185 -0.490 -0.368
150 HG23 VAL 24 2HG2 VAL 24 -10.521 0.934 0.433
151 H TYR 25 H TYR 25 -10.501 -0.446 -4.913
152 HA TYR 25 HA TYR 25 -8.053 -0.674 -6.172
153 HB2 TYR 25 1HB TYR 25 -10.036 -0.973 -7.458
154 HB3 TYR 25 2HB TYR 25 -10.611 0.646 -7.076
155 HD1 TYR 25 HD2 TYR 25 -7.267 -0.492 -8.272
156 HD2 TYR 25 HD1 TYR 25 -10.782 1.754 -9.112
157 HE1 TYR 25 HE2 TYR 25 -6.225 0.359 -10.331
158 HE2 TYR 25 HE1 TYR 25 -9.750 2.610 -11.174
159 HH TYR 25 HH TYR 25 -6.393 2.064 -11.912
160 H SER 26 H SER 26 -9.832 2.307 -5.396
161 HA SER 26 HA SER 26 -8.027 4.135 -6.463
162 HB2 SER 26 1HB SER 26 -9.778 4.474 -4.016
163 HB3 SER 26 2HB SER 26 -9.044 5.781 -4.944
164 HG SER 26 HG SER 26 -10.473 5.504 -6.499
165 H SER 27 H SER 27 -8.154 2.721 -3.213
166 HA SER 27 HA SER 27 -6.163 4.138 -1.957
167 HB2 SER 27 1HB SER 27 -7.018 1.262 -1.721
168 HB3 SER 27 2HB SER 27 -5.712 1.905 -0.727
169 HG SER 27 HG SER 27 -8.207 3.211 -0.878
170 H LEU 28 H LEU 28 -5.829 1.429 -4.193
171 HA LEU 28 HA LEU 28 -3.086 0.978 -3.901
172 HB2 LEU 28 1HB LEU 28 -4.381 -0.615 -5.076
173 HB3 LEU 28 2HB LEU 28 -4.959 0.594 -6.220
174 HG LEU 28 HG LEU 28 -2.579 0.762 -7.054
175 HD11 LEU 28 1HD1 LEU 28 -2.273 -1.787 -5.475
176 HD12 LEU 28 2HD1 LEU 28 -1.503 -0.247 -5.095
177 HD13 LEU 28 3HD1 LEU 28 -1.091 -1.095 -6.586
178 HD21 LEU 28 3HD2 LEU 28 -4.603 -1.202 -7.548
179 HD22 LEU 28 1HD2 LEU 28 -3.009 -1.913 -7.802
180 HD23 LEU 28 2HD2 LEU 28 -3.473 -0.455 -8.679
181 H THR 29 H THR 29 -4.812 3.071 -6.201
182 HA THR 29 HA THR 29 -2.466 4.078 -7.438
183 HB THR 29 HB THR 29 -3.898 5.747 -8.465
184 HG1 THR 29 HG1 THR 29 -6.153 4.841 -7.061
185 HG21 THR 29 3HG2 THR 29 -4.039 3.599 -9.491
186 HG22 THR 29 1HG2 THR 29 -5.682 4.232 -9.395
187 HG23 THR 29 2HG2 THR 29 -5.141 3.008 -8.246
188 H THR 30 H THR 30 -4.499 5.224 -4.786
189 HA THR 30 HA THR 30 -3.287 7.747 -4.465
190 HB THR 30 HB THR 30 -4.506 6.141 -2.222
191 HG1 THR 30 HG1 THR 30 -6.493 7.229 -2.967
192 HG21 THR 30 3HG2 THR 30 -4.742 9.093 -2.705
193 HG22 THR 30 1HG2 THR 30 -3.338 8.416 -1.882
194 HG23 THR 30 2HG2 THR 30 -4.950 8.196 -1.202
195 H HIS 31 H HIS 31 -2.317 4.561 -3.520
196 HA HIS 31 HA HIS 31 -0.360 5.506 -1.599
197 HB2 HIS 31 1HB HIS 31 -1.141 3.460 -0.889
198 HB3 HIS 31 2HB HIS 31 -1.326 2.841 -2.527
199 HD1 HIS 31 HD1 HIS 31 1.489 3.696 -0.117
200 HD2 HIS 31 HD2 HIS 31 0.632 1.121 -3.263
201 HE1 HIS 31 HE1 HIS 31 3.480 2.170 -0.299
202 H GLN 32 H GLN 32 -0.352 3.922 -4.781
203 HA GLN 32 HA GLN 32 2.386 3.723 -5.156
204 HB2 GLN 32 1HB GLN 32 0.053 3.977 -7.004
205 HB3 GLN 32 2HB GLN 32 1.676 4.098 -7.671
206 HG2 GLN 32 1HG GLN 32 2.098 1.889 -6.388
207 HG3 GLN 32 2HG GLN 32 0.339 1.772 -6.362
208 HE21 GLN 32 1HE2 GLN 32 0.131 0.062 -7.718
209 HE22 GLN 32 2HE2 GLN 32 0.565 0.099 -9.390
210 H VAL 33 H VAL 33 0.499 6.519 -4.891
211 HA VAL 33 HA VAL 33 1.704 8.342 -6.592
212 HB VAL 33 HB VAL 33 -0.275 8.738 -5.051
213 HG11 VAL 33 1HG1 VAL 33 1.838 9.549 -3.067
214 HG12 VAL 33 2HG1 VAL 33 0.089 9.510 -2.838
215 HG13 VAL 33 3HG1 VAL 33 0.992 8.003 -2.999
216 HG21 VAL 33 3HG2 VAL 33 1.080 10.462 -6.421
217 HG22 VAL 33 1HG2 VAL 33 -0.024 11.045 -5.175
218 HG23 VAL 33 2HG2 VAL 33 1.709 10.975 -4.855
219 H ILE 34 H ILE 34 3.014 6.752 -3.846
220 HA ILE 34 HA ILE 34 5.134 8.694 -3.445
221 HB ILE 34 HB ILE 34 5.917 7.268 -1.671
222 HG12 ILE 34 1HG1 ILE 34 3.753 5.263 -2.187
223 HG13 ILE 34 2HG1 ILE 34 5.263 5.151 -3.085
224 HG21 ILE 34 1HG2 ILE 34 3.046 7.953 -1.844
225 HG22 ILE 34 2HG2 ILE 34 3.536 6.905 -0.514
226 HG23 ILE 34 3HG2 ILE 34 4.276 8.494 -0.702
227 HD11 ILE 34 3HD1 ILE 34 6.475 5.082 -0.924
228 HD12 ILE 34 1HD1 ILE 34 4.916 5.034 -0.101
229 HD13 ILE 34 2HD1 ILE 34 5.386 3.719 -1.179
230 H HIS 35 H HIS 35 4.567 5.846 -5.274
231 HA HIS 35 HA HIS 35 7.388 5.250 -5.633
232 HB2 HIS 35 1HB HIS 35 4.876 4.008 -6.762
233 HB3 HIS 35 2HB HIS 35 6.498 3.480 -7.200
234 HD1 HIS 35 HD1 HIS 35 7.923 3.240 -4.606
235 HD2 HIS 35 HD2 HIS 35 3.931 2.169 -5.032
236 HE1 HIS 35 HE1 HIS 35 7.455 1.630 -2.732
237 H THR 36 H THR 36 4.797 6.884 -7.286
238 HA THR 36 HA THR 36 6.528 7.303 -9.628
239 HB THR 36 HB THR 36 4.412 6.389 -10.285
240 HG1 THR 36 HG1 THR 36 5.305 8.675 -11.150
241 HG21 THR 36 3HG2 THR 36 3.333 8.393 -8.366
242 HG22 THR 36 1HG2 THR 36 2.854 6.717 -8.636
243 HG23 THR 36 2HG2 THR 36 2.353 7.971 -9.770
244 H GLY 37 H GLY 37 7.231 8.747 -7.409
245 HA2 GLY 37 1HA GLY 37 6.875 11.444 -8.382
246 HA3 GLY 37 2HA GLY 37 6.143 11.152 -6.812
247 H GLU 38 H GLU 38 7.597 10.254 -5.120
248 HA GLU 38 HA GLU 38 9.695 11.869 -4.527
249 HB2 GLU 38 1HB GLU 38 8.717 10.265 -2.944
250 HB3 GLU 38 2HB GLU 38 9.477 8.939 -3.813
251 HG2 GLU 38 1HG GLU 38 10.892 9.264 -2.021
252 HG3 GLU 38 2HG GLU 38 11.684 10.164 -3.313
253 H LYS 39 H LYS 39 11.800 12.076 -5.042
254 HA LYS 39 HA LYS 39 12.787 10.554 -7.300
255 HB2 LYS 39 1HB LYS 39 13.809 12.943 -5.780
256 HB3 LYS 39 2HB LYS 39 14.798 12.127 -6.984
257 HG2 LYS 39 1HG LYS 39 12.057 13.204 -7.580
258 HG3 LYS 39 2HG LYS 39 13.533 14.153 -7.775
259 HD2 LYS 39 1HD LYS 39 14.245 12.930 -9.571
260 HD3 LYS 39 2HD LYS 39 13.433 11.459 -9.028
261 HE2 LYS 39 1HE LYS 39 11.279 12.395 -9.671
262 HE3 LYS 39 2HE LYS 39 12.062 13.896 -10.164
263 HZ1 LYS 39 3HZ LYS 39 11.544 12.339 -12.013
264 HZ2 LYS 39 1HZ LYS 39 12.672 11.255 -11.369
265 HZ3 LYS 39 2HZ LYS 39 13.176 12.773 -11.918
266 HA PRO 40 HA PRO 40 15.255 7.691 -5.056
267 HB2 PRO 40 1HB PRO 40 17.231 7.247 -6.863
268 HB3 PRO 40 2HB PRO 40 15.591 6.620 -7.061
269 HG2 PRO 40 1HG PRO 40 16.854 9.038 -8.291
270 HG3 PRO 40 2HG PRO 40 15.806 7.820 -9.041
271 HD2 PRO 40 1HD PRO 40 14.888 10.239 -8.245
272 HD3 PRO 40 2HD PRO 40 13.883 8.776 -8.205
273 H SER 41 H SER 41 16.062 8.882 -3.326
274 HA SER 41 HA SER 41 17.919 10.905 -3.333
275 HB2 SER 41 1HB SER 41 16.678 10.061 -1.330
276 HB3 SER 41 2HB SER 41 17.793 8.696 -1.267
277 HG SER 41 HG SER 41 18.130 11.017 -0.154
278 H GLY 42 H GLY 42 19.891 11.020 -4.163
279 HA2 GLY 42 1HA GLY 42 21.758 8.816 -3.732
280 HA3 GLY 42 2HA GLY 42 21.427 9.258 -5.400
281 HA PRO 43 HA PRO 43 24.604 12.271 -5.225
282 HB2 PRO 43 1HB PRO 43 23.669 14.118 -6.980
283 HB3 PRO 43 2HB PRO 43 24.301 12.547 -7.486
284 HG2 PRO 43 1HG PRO 43 21.460 13.421 -7.130
285 HG3 PRO 43 2HG PRO 43 22.178 12.453 -8.431
286 HD2 PRO 43 1HD PRO 43 20.786 11.345 -6.391
287 HD3 PRO 43 2HD PRO 43 22.142 10.517 -7.182
288 H SER 44 H SER 44 25.052 14.566 -4.759
289 HA SER 44 HA SER 44 23.329 15.509 -2.638
290 HB2 SER 44 1HB SER 44 25.119 17.264 -2.371
291 HB3 SER 44 2HB SER 44 25.692 15.603 -2.216
292 HG SER 44 HG SER 44 26.953 15.946 -3.849
293 H SER 45 H SER 45 24.458 16.683 -5.787
294 HA SER 45 HA SER 45 23.532 19.198 -5.946
295 HB2 SER 45 1HB SER 45 23.559 16.967 -7.925
296 HB3 SER 45 2HB SER 45 22.695 18.442 -8.359
297 HG SER 45 HG SER 45 24.921 18.464 -8.982
298 H GLY 46 H GLY 46 21.706 20.152 -5.358
299 HA2 GLY 46 1HA GLY 46 19.363 20.527 -5.771
300 HA3 GLY 46 2HA GLY 46 19.160 18.789 -5.941
Start of MODEL 6
1 H1 GLY 1 H GLY 1 14.486 -8.111 10.865
2 HA2 GLY 1 1HA GLY 1 13.658 -9.021 13.423
3 HA3 GLY 1 2HA GLY 1 13.222 -7.332 13.211
4 H SER 2 H SER 2 11.470 -9.631 13.514
5 HA SER 2 HA SER 2 9.847 -9.189 11.127
6 HB2 SER 2 1HB SER 2 10.687 -11.910 12.141
7 HB3 SER 2 2HB SER 2 9.316 -11.667 11.058
8 HG SER 2 HG SER 2 10.766 -11.765 9.545
9 H SER 3 H SER 3 7.645 -10.407 11.480
10 HA SER 3 HA SER 3 6.761 -10.772 14.160
11 HB2 SER 3 1HB SER 3 7.007 -8.169 13.720
12 HB3 SER 3 2HB SER 3 5.449 -8.388 12.925
13 HG SER 3 HG SER 3 5.768 -9.533 15.443
14 H GLY 4 H GLY 4 4.230 -10.769 14.183
15 HA2 GLY 4 1HA GLY 4 3.346 -12.022 11.656
16 HA3 GLY 4 2HA GLY 4 2.851 -12.589 13.244
17 H SER 5 H SER 5 0.750 -12.282 11.915
18 HA SER 5 HA SER 5 -0.465 -9.832 12.879
19 HB2 SER 5 1HB SER 5 0.160 -8.992 10.758
20 HB3 SER 5 2HB SER 5 -0.248 -10.505 9.948
21 HG SER 5 HG SER 5 -2.418 -10.070 10.292
22 H SER 6 H SER 6 -2.600 -10.068 13.356
23 HA SER 6 HA SER 6 -3.737 -12.739 12.893
24 HB2 SER 6 1HB SER 6 -3.584 -12.293 15.231
25 HB3 SER 6 2HB SER 6 -4.252 -10.673 15.035
26 HG SER 6 HG SER 6 -6.227 -11.672 14.401
27 H GLY 7 H GLY 7 -5.781 -13.000 12.047
28 HA2 GLY 7 1HA GLY 7 -7.649 -12.487 10.816
29 HA3 GLY 7 2HA GLY 7 -7.646 -10.930 11.631
30 H THR 8 H THR 8 -6.009 -12.696 9.015
31 HA THR 8 HA THR 8 -6.091 -10.234 7.419
32 HB THR 8 HB THR 8 -3.816 -10.409 8.353
33 HG1 THR 8 HG1 THR 8 -2.749 -10.382 6.261
34 HG21 THR 8 3HG2 THR 8 -4.053 -13.060 8.229
35 HG22 THR 8 1HG2 THR 8 -2.484 -12.256 8.202
36 HG23 THR 8 2HG2 THR 8 -3.222 -12.801 6.695
37 H GLY 9 H GLY 9 -6.057 -10.565 5.137
38 HA2 GLY 9 1HA GLY 9 -6.460 -13.347 4.264
39 HA3 GLY 9 2HA GLY 9 -7.669 -12.133 3.876
40 H VAL 10 H VAL 10 -7.382 -12.428 1.650
41 HA VAL 10 HA VAL 10 -4.820 -11.413 0.599
42 HB VAL 10 HB VAL 10 -5.254 -13.782 0.013
43 HG11 VAL 10 1HG1 VAL 10 -7.637 -12.654 -1.454
44 HG12 VAL 10 2HG1 VAL 10 -7.042 -14.310 -1.585
45 HG13 VAL 10 3HG1 VAL 10 -7.683 -13.721 -0.051
46 HG21 VAL 10 3HG2 VAL 10 -5.043 -13.438 -2.506
47 HG22 VAL 10 1HG2 VAL 10 -5.187 -11.713 -2.165
48 HG23 VAL 10 2HG2 VAL 10 -3.849 -12.638 -1.484
49 H LYS 11 H LYS 11 -4.870 -9.962 -1.129
50 HA LYS 11 HA LYS 11 -7.499 -8.901 -1.892
51 HB2 LYS 11 1HB LYS 11 -5.227 -7.426 -0.630
52 HB3 LYS 11 2HB LYS 11 -6.214 -6.594 -1.823
53 HG2 LYS 11 1HG LYS 11 -7.343 -6.024 0.061
54 HG3 LYS 11 2HG LYS 11 -8.180 -7.529 -0.326
55 HD2 LYS 11 1HD LYS 11 -6.659 -8.727 1.212
56 HD3 LYS 11 2HD LYS 11 -5.918 -7.183 1.643
57 HE2 LYS 11 1HE LYS 11 -7.458 -7.496 3.344
58 HE3 LYS 11 2HE LYS 11 -8.336 -6.461 2.219
59 HZ1 LYS 11 3HZ LYS 11 -8.663 -9.367 2.664
60 HZ2 LYS 11 1HZ LYS 11 -9.263 -8.603 1.279
61 HZ3 LYS 11 2HZ LYS 11 -9.825 -8.146 2.807
62 HA PRO 12 HA PRO 12 -5.847 -9.071 -5.968
63 HB2 PRO 12 1HB PRO 12 -7.503 -7.295 -7.181
64 HB3 PRO 12 2HB PRO 12 -8.021 -8.913 -6.695
65 HG2 PRO 12 1HG PRO 12 -8.433 -6.295 -5.304
66 HG3 PRO 12 2HG PRO 12 -9.579 -7.627 -5.545
67 HD2 PRO 12 1HD PRO 12 -8.264 -7.242 -3.210
68 HD3 PRO 12 2HD PRO 12 -8.713 -8.855 -3.798
69 H TYR 13 H TYR 13 -6.624 -5.772 -4.848
70 HA TYR 13 HA TYR 13 -4.634 -4.575 -6.528
71 HB2 TYR 13 1HB TYR 13 -5.971 -3.261 -4.168
72 HB3 TYR 13 2HB TYR 13 -5.328 -2.498 -5.618
73 HD1 TYR 13 HD1 TYR 13 -6.490 -3.119 -7.856
74 HD2 TYR 13 HD2 TYR 13 -8.240 -3.746 -4.029
75 HE1 TYR 13 HE1 TYR 13 -8.716 -3.211 -8.896
76 HE2 TYR 13 HE2 TYR 13 -10.472 -3.841 -5.059
77 HH TYR 13 HH TYR 13 -11.633 -3.278 -6.990
78 H MET 14 H MET 14 -2.598 -5.256 -6.062
79 HA MET 14 HA MET 14 -1.566 -4.535 -3.406
80 HB2 MET 14 1HB MET 14 -1.895 -7.011 -3.612
81 HB3 MET 14 2HB MET 14 -0.738 -7.005 -4.936
82 HG2 MET 14 1HG MET 14 0.827 -5.862 -3.202
83 HG3 MET 14 2HG MET 14 -0.286 -6.556 -2.025
84 HE1 MET 14 3HE MET 14 -0.698 -9.131 -1.706
85 HE2 MET 14 1HE MET 14 -1.171 -9.265 -3.400
86 HE3 MET 14 2HE MET 14 0.019 -10.379 -2.727
87 H CYS 15 H CYS 15 0.040 -3.124 -3.549
88 HA CYS 15 HA CYS 15 1.144 -2.302 -6.014
89 HB2 CYS 15 1HB CYS 15 1.067 -0.688 -4.281
90 HB3 CYS 15 2HB CYS 15 1.890 -1.754 -3.146
91 H ASN 16 H ASN 16 3.210 -2.568 -6.875
92 HA ASN 16 HA ASN 16 4.616 -4.968 -5.918
93 HB2 ASN 16 1HB ASN 16 4.661 -3.679 -8.657
94 HB3 ASN 16 2HB ASN 16 5.522 -5.146 -8.202
95 HD21 ASN 16 1HD2 ASN 16 4.355 -7.041 -7.820
96 HD22 ASN 16 2HD2 ASN 16 2.738 -7.241 -8.394
97 H GLU 17 H GLU 17 4.910 -1.579 -6.467
98 HA GLU 17 HA GLU 17 7.671 -1.295 -6.750
99 HB2 GLU 17 1HB GLU 17 5.607 0.506 -5.487
100 HB3 GLU 17 2HB GLU 17 7.287 0.980 -5.690
101 HG2 GLU 17 1HG GLU 17 7.105 1.188 -7.952
102 HG3 GLU 17 2HG GLU 17 5.819 -0.012 -8.070
103 H CYS 18 H CYS 18 5.705 -1.868 -3.913
104 HA CYS 18 HA CYS 18 8.169 -2.151 -2.334
105 HB2 CYS 18 1HB CYS 18 7.003 -1.220 -0.375
106 HB3 CYS 18 2HB CYS 18 7.110 -0.048 -1.684
107 H GLY 19 H GLY 19 4.699 -2.913 -2.506
108 HA2 GLY 19 1HA GLY 19 4.193 -5.348 -2.548
109 HA3 GLY 19 2HA GLY 19 5.320 -5.496 -1.208
110 H LYS 20 H LYS 20 2.779 -3.085 -1.771
111 HA LYS 20 HA LYS 20 1.666 -3.770 0.856
112 HB2 LYS 20 1HB LYS 20 2.389 -1.364 0.063
113 HB3 LYS 20 2HB LYS 20 0.807 -1.367 -0.706
114 HG2 LYS 20 1HG LYS 20 0.258 -0.436 1.291
115 HG3 LYS 20 2HG LYS 20 0.030 -2.139 1.696
116 HD2 LYS 20 1HD LYS 20 2.582 -1.969 2.345
117 HD3 LYS 20 2HD LYS 20 2.189 -0.256 2.515
118 HE2 LYS 20 1HE LYS 20 1.873 -1.220 4.650
119 HE3 LYS 20 2HE LYS 20 0.261 -0.974 3.980
120 HZ1 LYS 20 3HZ LYS 20 -0.124 -3.171 3.876
121 HZ2 LYS 20 1HZ LYS 20 1.081 -3.264 5.059
122 HZ3 LYS 20 2HZ LYS 20 1.464 -3.557 3.438
123 H ALA 21 H ALA 21 -0.512 -4.211 1.146
124 HA ALA 21 HA ALA 21 -1.978 -4.890 -1.317
125 HB1 ALA 21 3HB ALA 21 -2.930 -6.714 -0.256
126 HB2 ALA 21 1HB ALA 21 -1.295 -6.699 0.406
127 HB3 ALA 21 2HB ALA 21 -2.638 -6.060 1.356
128 H PHE 22 H PHE 22 -4.064 -4.210 -1.595
129 HA PHE 22 HA PHE 22 -5.330 -2.676 0.554
130 HB2 PHE 22 1HB PHE 22 -5.260 -1.602 -2.260
131 HB3 PHE 22 2HB PHE 22 -5.736 -0.769 -0.784
132 HD1 PHE 22 HD2 PHE 22 -2.807 -2.313 -2.467
133 HD2 PHE 22 HD1 PHE 22 -4.205 0.538 0.367
134 HE1 PHE 22 HE2 PHE 22 -0.524 -1.426 -2.237
135 HE2 PHE 22 HE1 PHE 22 -1.924 1.430 0.600
136 HZ PHE 22 HZ PHE 22 -0.079 0.447 -0.702
137 H SER 23 H SER 23 -7.623 -2.354 0.251
138 HA SER 23 HA SER 23 -8.818 -4.579 -1.219
139 HB2 SER 23 1HB SER 23 -9.789 -2.796 1.006
140 HB3 SER 23 2HB SER 23 -10.904 -3.816 0.097
141 HG SER 23 HG SER 23 -9.443 -4.527 2.137
142 H VAL 24 H VAL 24 -8.930 -1.067 -0.999
143 HA VAL 24 HA VAL 24 -10.905 -0.934 -3.147
144 HB VAL 24 HB VAL 24 -9.637 1.331 -1.602
145 HG11 VAL 24 1HG1 VAL 24 -11.733 1.167 -3.711
146 HG12 VAL 24 2HG1 VAL 24 -11.887 2.394 -2.451
147 HG13 VAL 24 3HG1 VAL 24 -10.455 2.359 -3.481
148 HG21 VAL 24 3HG2 VAL 24 -12.425 0.847 -1.045
149 HG22 VAL 24 1HG2 VAL 24 -11.450 -0.576 -0.679
150 HG23 VAL 24 2HG2 VAL 24 -11.064 0.974 0.069
151 H TYR 25 H TYR 25 -10.412 -0.482 -5.200
152 HA TYR 25 HA TYR 25 -7.845 -0.613 -6.214
153 HB2 TYR 25 1HB TYR 25 -9.796 -0.955 -7.619
154 HB3 TYR 25 2HB TYR 25 -10.280 0.725 -7.410
155 HD1 TYR 25 HD2 TYR 25 -7.623 -1.437 -8.841
156 HD2 TYR 25 HD1 TYR 25 -9.471 2.395 -8.850
157 HE1 TYR 25 HE2 TYR 25 -6.319 -0.820 -10.833
158 HE2 TYR 25 HE1 TYR 25 -8.173 3.023 -10.844
159 HH TYR 25 HH TYR 25 -5.704 0.880 -12.177
160 H SER 26 H SER 26 -9.715 2.216 -5.252
161 HA SER 26 HA SER 26 -7.999 4.192 -6.266
162 HB2 SER 26 1HB SER 26 -9.820 4.295 -3.849
163 HB3 SER 26 2HB SER 26 -9.088 5.698 -4.627
164 HG SER 26 HG SER 26 -10.276 5.263 -6.471
165 H SER 27 H SER 27 -8.009 2.444 -3.202
166 HA SER 27 HA SER 27 -6.028 3.953 -1.897
167 HB2 SER 27 1HB SER 27 -7.607 2.182 -0.909
168 HB3 SER 27 2HB SER 27 -6.432 0.995 -1.476
169 HG SER 27 HG SER 27 -6.207 1.850 0.760
170 H LEU 28 H LEU 28 -5.845 1.586 -4.398
171 HA LEU 28 HA LEU 28 -3.066 0.952 -3.981
172 HB2 LEU 28 1HB LEU 28 -4.481 -0.725 -4.946
173 HB3 LEU 28 2HB LEU 28 -4.975 0.370 -6.236
174 HG LEU 28 HG LEU 28 -2.711 0.293 -7.167
175 HD11 LEU 28 1HD1 LEU 28 -2.108 -0.863 -4.608
176 HD12 LEU 28 2HD1 LEU 28 -1.014 -0.269 -5.856
177 HD13 LEU 28 3HD1 LEU 28 -1.587 -1.936 -5.907
178 HD21 LEU 28 3HD2 LEU 28 -2.899 -1.809 -8.166
179 HD22 LEU 28 1HD2 LEU 28 -4.552 -1.411 -7.694
180 HD23 LEU 28 2HD2 LEU 28 -3.604 -2.537 -6.722
181 H THR 29 H THR 29 -4.938 2.921 -6.256
182 HA THR 29 HA THR 29 -2.618 3.816 -7.686
183 HB THR 29 HB THR 29 -5.053 3.674 -8.554
184 HG1 THR 29 HG1 THR 29 -3.831 6.143 -9.160
185 HG21 THR 29 3HG2 THR 29 -6.577 5.143 -7.837
186 HG22 THR 29 1HG2 THR 29 -5.463 6.496 -8.031
187 HG23 THR 29 2HG2 THR 29 -5.453 5.552 -6.542
188 H THR 30 H THR 30 -4.250 4.779 -4.827
189 HA THR 30 HA THR 30 -3.289 7.506 -4.868
190 HB THR 30 HB THR 30 -4.665 5.919 -2.694
191 HG1 THR 30 HG1 THR 30 -5.642 8.061 -4.299
192 HG21 THR 30 3HG2 THR 30 -4.895 7.972 -1.471
193 HG22 THR 30 1HG2 THR 30 -4.133 8.889 -2.770
194 HG23 THR 30 2HG2 THR 30 -3.184 7.738 -1.828
195 H HIS 31 H HIS 31 -2.347 4.436 -3.487
196 HA HIS 31 HA HIS 31 -0.374 5.575 -1.724
197 HB2 HIS 31 1HB HIS 31 -1.104 3.573 -0.856
198 HB3 HIS 31 2HB HIS 31 -1.274 2.823 -2.441
199 HD1 HIS 31 HD1 HIS 31 1.239 3.497 0.250
200 HD2 HIS 31 HD2 HIS 31 1.005 1.528 -3.401
201 HE1 HIS 31 HE1 HIS 31 3.336 2.117 0.094
202 H GLN 32 H GLN 32 -0.346 3.834 -4.814
203 HA GLN 32 HA GLN 32 2.340 3.506 -5.226
204 HB2 GLN 32 1HB GLN 32 0.095 4.134 -7.117
205 HB3 GLN 32 2HB GLN 32 1.742 3.970 -7.711
206 HG2 GLN 32 1HG GLN 32 1.864 1.710 -6.925
207 HG3 GLN 32 2HG GLN 32 0.297 1.858 -6.131
208 HE21 GLN 32 1HE2 GLN 32 1.585 0.294 -8.503
209 HE22 GLN 32 2HE2 GLN 32 0.347 0.357 -9.706
210 H VAL 33 H VAL 33 0.631 6.452 -4.968
211 HA VAL 33 HA VAL 33 2.095 8.205 -6.534
212 HB VAL 33 HB VAL 33 0.786 8.621 -3.852
213 HG11 VAL 33 1HG1 VAL 33 2.140 10.634 -5.635
214 HG12 VAL 33 2HG1 VAL 33 0.975 11.069 -4.383
215 HG13 VAL 33 3HG1 VAL 33 2.490 10.279 -3.944
216 HG21 VAL 33 3HG2 VAL 33 -0.713 10.036 -5.450
217 HG22 VAL 33 1HG2 VAL 33 0.006 9.027 -6.706
218 HG23 VAL 33 2HG2 VAL 33 -0.902 8.283 -5.390
219 H ILE 34 H ILE 34 2.848 6.882 -3.355
220 HA ILE 34 HA ILE 34 5.091 8.521 -2.825
221 HB ILE 34 HB ILE 34 5.666 6.959 -1.090
222 HG12 ILE 34 1HG1 ILE 34 3.514 5.044 -1.862
223 HG13 ILE 34 2HG1 ILE 34 5.034 4.975 -2.747
224 HG21 ILE 34 1HG2 ILE 34 2.749 7.521 -1.459
225 HG22 ILE 34 2HG2 ILE 34 3.329 6.664 -0.032
226 HG23 ILE 34 3HG2 ILE 34 3.906 8.294 -0.376
227 HD11 ILE 34 3HD1 ILE 34 6.246 4.584 -0.700
228 HD12 ILE 34 1HD1 ILE 34 4.766 4.760 0.241
229 HD13 ILE 34 2HD1 ILE 34 4.949 3.401 -0.869
230 H HIS 35 H HIS 35 4.657 6.291 -5.221
231 HA HIS 35 HA HIS 35 7.518 5.595 -5.308
232 HB2 HIS 35 1HB HIS 35 5.125 4.207 -6.525
233 HB3 HIS 35 2HB HIS 35 6.793 3.775 -6.887
234 HD1 HIS 35 HD1 HIS 35 8.190 3.387 -4.408
235 HD2 HIS 35 HD2 HIS 35 4.128 2.550 -4.656
236 HE1 HIS 35 HE1 HIS 35 7.711 1.811 -2.507
237 H THR 36 H THR 36 5.029 7.378 -6.804
238 HA THR 36 HA THR 36 6.467 7.586 -9.343
239 HB THR 36 HB THR 36 4.479 9.028 -10.001
240 HG1 THR 36 HG1 THR 36 3.237 9.550 -8.371
241 HG21 THR 36 3HG2 THR 36 3.741 7.151 -10.945
242 HG22 THR 36 1HG2 THR 36 3.111 6.580 -9.401
243 HG23 THR 36 2HG2 THR 36 4.779 6.231 -9.856
244 H GLY 37 H GLY 37 7.948 8.659 -7.344
245 HA2 GLY 37 1HA GLY 37 7.783 11.533 -7.957
246 HA3 GLY 37 2HA GLY 37 7.954 11.012 -6.288
247 H GLU 38 H GLU 38 9.850 12.625 -6.918
248 HA GLU 38 HA GLU 38 12.135 11.031 -7.862
249 HB2 GLU 38 1HB GLU 38 11.874 14.032 -7.607
250 HB3 GLU 38 2HB GLU 38 13.272 13.173 -8.239
251 HG2 GLU 38 1HG GLU 38 12.255 13.740 -10.187
252 HG3 GLU 38 2HG GLU 38 11.490 12.179 -9.899
253 H LYS 39 H LYS 39 13.006 10.034 -6.143
254 HA LYS 39 HA LYS 39 14.223 11.654 -4.090
255 HB2 LYS 39 1HB LYS 39 13.167 10.644 -2.199
256 HB3 LYS 39 2HB LYS 39 11.892 11.237 -3.256
257 HG2 LYS 39 1HG LYS 39 11.829 8.849 -4.189
258 HG3 LYS 39 2HG LYS 39 12.749 8.413 -2.747
259 HD2 LYS 39 1HD LYS 39 10.141 9.918 -2.654
260 HD3 LYS 39 2HD LYS 39 10.248 8.158 -2.563
261 HE2 LYS 39 1HE LYS 39 11.872 8.538 -0.627
262 HE3 LYS 39 2HE LYS 39 11.295 10.203 -0.627
263 HZ1 LYS 39 3HZ LYS 39 9.084 8.474 -0.682
264 HZ2 LYS 39 1HZ LYS 39 9.535 9.569 0.527
265 HZ3 LYS 39 2HZ LYS 39 10.112 7.979 0.566
266 HA PRO 40 HA PRO 40 17.248 8.475 -4.395
267 HB2 PRO 40 1HB PRO 40 18.526 8.833 -2.027
268 HB3 PRO 40 2HB PRO 40 18.692 9.950 -3.386
269 HG2 PRO 40 1HG PRO 40 16.968 10.175 -0.949
270 HG3 PRO 40 2HG PRO 40 17.952 11.419 -1.742
271 HD2 PRO 40 1HD PRO 40 15.274 11.235 -2.096
272 HD3 PRO 40 2HD PRO 40 16.367 11.813 -3.369
273 H SER 41 H SER 41 15.648 8.695 -1.215
274 HA SER 41 HA SER 41 14.722 6.034 -1.255
275 HB2 SER 41 1HB SER 41 17.191 5.625 -0.947
276 HB3 SER 41 2HB SER 41 17.071 6.456 0.603
277 HG SER 41 HG SER 41 15.189 4.760 0.769
278 H GLY 42 H GLY 42 13.245 5.673 0.353
279 HA2 GLY 42 1HA GLY 42 12.989 7.816 2.374
280 HA3 GLY 42 2HA GLY 42 11.606 7.091 1.568
281 HA PRO 43 HA PRO 43 13.368 3.682 4.516
282 HB2 PRO 43 1HB PRO 43 15.311 4.458 6.245
283 HB3 PRO 43 2HB PRO 43 15.659 3.806 4.639
284 HG2 PRO 43 1HG PRO 43 15.586 6.657 5.551
285 HG3 PRO 43 2HG PRO 43 16.758 5.850 4.493
286 HD2 PRO 43 1HD PRO 43 14.763 7.409 3.534
287 HD3 PRO 43 2HD PRO 43 15.388 6.004 2.646
288 H SER 44 H SER 44 13.697 6.910 6.001
289 HA SER 44 HA SER 44 12.829 6.476 8.525
290 HB2 SER 44 1HB SER 44 11.906 8.783 6.796
291 HB3 SER 44 2HB SER 44 11.968 8.760 8.558
292 HG SER 44 HG SER 44 13.798 9.790 7.693
293 H SER 45 H SER 45 11.132 5.507 9.392
294 HA SER 45 HA SER 45 9.015 4.379 8.114
295 HB2 SER 45 1HB SER 45 9.209 5.478 10.915
296 HB3 SER 45 2HB SER 45 7.780 4.614 10.349
297 HG SER 45 HG SER 45 10.211 3.383 9.859
298 H GLY 46 H GLY 46 7.624 5.280 6.745
299 HA2 GLY 46 1HA GLY 46 5.619 7.033 7.451
300 HA3 GLY 46 2HA GLY 46 6.917 8.046 6.836
Start of MODEL 7
1 H1 GLY 1 H GLY 1 15.011 -8.414 13.129
2 HA2 GLY 1 1HA GLY 1 12.796 -6.851 12.045
3 HA3 GLY 1 2HA GLY 1 13.850 -7.638 10.879
4 H SER 2 H SER 2 10.953 -8.000 11.735
5 HA SER 2 HA SER 2 11.111 -10.908 12.188
6 HB2 SER 2 1HB SER 2 10.077 -9.302 14.022
7 HB3 SER 2 2HB SER 2 8.663 -9.382 12.972
8 HG SER 2 HG SER 2 9.535 -11.191 14.729
9 H SER 3 H SER 3 9.458 -12.188 11.188
10 HA SER 3 HA SER 3 8.418 -10.942 8.733
11 HB2 SER 3 1HB SER 3 10.080 -12.929 8.661
12 HB3 SER 3 2HB SER 3 8.696 -13.910 9.142
13 HG SER 3 HG SER 3 9.321 -13.085 6.718
14 H GLY 4 H GLY 4 6.319 -11.563 7.975
15 HA2 GLY 4 1HA GLY 4 4.550 -13.089 9.639
16 HA3 GLY 4 2HA GLY 4 4.269 -11.360 9.780
17 H SER 5 H SER 5 5.064 -13.467 7.020
18 HA SER 5 HA SER 5 3.408 -12.074 5.219
19 HB2 SER 5 1HB SER 5 3.756 -14.029 3.723
20 HB3 SER 5 2HB SER 5 5.261 -13.438 4.427
21 HG SER 5 HG SER 5 4.645 -15.155 6.125
22 H SER 6 H SER 6 2.917 -15.127 6.970
23 HA SER 6 HA SER 6 0.526 -15.969 5.974
24 HB2 SER 6 1HB SER 6 1.737 -17.199 7.705
25 HB3 SER 6 2HB SER 6 1.351 -15.949 8.888
26 HG SER 6 HG SER 6 -0.080 -17.727 9.027
27 H GLY 7 H GLY 7 -1.192 -14.759 5.497
28 HA2 GLY 7 1HA GLY 7 -2.829 -13.631 7.483
29 HA3 GLY 7 2HA GLY 7 -1.889 -12.342 6.747
30 H THR 8 H THR 8 -4.188 -11.671 6.252
31 HA THR 8 HA THR 8 -5.519 -13.107 4.133
32 HB THR 8 HB THR 8 -7.080 -11.137 4.137
33 HG1 THR 8 HG1 THR 8 -5.447 -9.656 5.000
34 HG21 THR 8 3HG2 THR 8 -8.082 -11.667 6.302
35 HG22 THR 8 1HG2 THR 8 -6.580 -12.432 6.821
36 HG23 THR 8 2HG2 THR 8 -7.516 -13.132 5.500
37 H GLY 9 H GLY 9 -3.066 -12.627 3.175
38 HA2 GLY 9 1HA GLY 9 -3.016 -10.144 1.676
39 HA3 GLY 9 2HA GLY 9 -1.793 -11.406 1.651
40 H VAL 10 H VAL 10 -5.278 -11.529 0.961
41 HA VAL 10 HA VAL 10 -4.637 -12.797 -1.607
42 HB VAL 10 HB VAL 10 -6.133 -14.051 -0.111
43 HG11 VAL 10 1HG1 VAL 10 -8.506 -13.133 0.103
44 HG12 VAL 10 2HG1 VAL 10 -7.264 -12.410 1.128
45 HG13 VAL 10 3HG1 VAL 10 -7.811 -11.570 -0.323
46 HG21 VAL 10 3HG2 VAL 10 -7.801 -13.111 -2.416
47 HG22 VAL 10 1HG2 VAL 10 -6.306 -14.009 -2.685
48 HG23 VAL 10 2HG2 VAL 10 -7.621 -14.739 -1.764
49 H LYS 11 H LYS 11 -5.640 -9.854 -0.305
50 HA LYS 11 HA LYS 11 -7.524 -8.790 -1.943
51 HB2 LYS 11 1HB LYS 11 -5.018 -7.574 -0.811
52 HB3 LYS 11 2HB LYS 11 -6.136 -6.616 -1.774
53 HG2 LYS 11 1HG LYS 11 -7.888 -6.925 -0.202
54 HG3 LYS 11 2HG LYS 11 -6.965 -8.145 0.679
55 HD2 LYS 11 1HD LYS 11 -5.294 -6.414 1.250
56 HD3 LYS 11 2HD LYS 11 -6.300 -5.210 0.441
57 HE2 LYS 11 1HE LYS 11 -8.131 -5.731 2.005
58 HE3 LYS 11 2HE LYS 11 -7.080 -6.880 2.831
59 HZ1 LYS 11 3HZ LYS 11 -5.845 -4.327 2.585
60 HZ2 LYS 11 1HZ LYS 11 -6.138 -5.247 3.974
61 HZ3 LYS 11 2HZ LYS 11 -7.332 -4.206 3.382
62 HA PRO 12 HA PRO 12 -5.950 -9.067 -6.059
63 HB2 PRO 12 1HB PRO 12 -7.659 -7.313 -7.231
64 HB3 PRO 12 2HB PRO 12 -8.142 -8.939 -6.735
65 HG2 PRO 12 1HG PRO 12 -8.560 -6.329 -5.331
66 HG3 PRO 12 2HG PRO 12 -9.692 -7.676 -5.547
67 HD2 PRO 12 1HD PRO 12 -8.327 -7.275 -3.243
68 HD3 PRO 12 2HD PRO 12 -8.767 -8.894 -3.822
69 H TYR 13 H TYR 13 -6.554 -5.866 -4.646
70 HA TYR 13 HA TYR 13 -4.690 -4.596 -6.462
71 HB2 TYR 13 1HB TYR 13 -5.956 -3.322 -4.042
72 HB3 TYR 13 2HB TYR 13 -5.374 -2.540 -5.508
73 HD1 TYR 13 HD1 TYR 13 -6.604 -3.304 -7.722
74 HD2 TYR 13 HD2 TYR 13 -8.228 -3.666 -3.806
75 HE1 TYR 13 HE1 TYR 13 -8.868 -3.400 -8.677
76 HE2 TYR 13 HE2 TYR 13 -10.497 -3.765 -4.750
77 HH TYR 13 HH TYR 13 -11.638 -4.211 -6.758
78 H MET 14 H MET 14 -2.647 -5.309 -6.055
79 HA MET 14 HA MET 14 -1.549 -4.638 -3.410
80 HB2 MET 14 1HB MET 14 -0.899 -7.093 -5.050
81 HB3 MET 14 2HB MET 14 -0.062 -6.612 -3.580
82 HG2 MET 14 1HG MET 14 -2.368 -6.714 -2.468
83 HG3 MET 14 2HG MET 14 -2.864 -7.610 -3.902
84 HE1 MET 14 3HE MET 14 -2.309 -9.824 -0.602
85 HE2 MET 14 1HE MET 14 -3.304 -8.515 -1.242
86 HE3 MET 14 2HE MET 14 -3.316 -10.095 -2.025
87 H CYS 15 H CYS 15 0.201 -3.376 -3.468
88 HA CYS 15 HA CYS 15 1.173 -2.362 -5.938
89 HB2 CYS 15 1HB CYS 15 1.189 -0.891 -4.063
90 HB3 CYS 15 2HB CYS 15 2.099 -2.039 -3.084
91 H ASN 16 H ASN 16 3.178 -2.622 -6.922
92 HA ASN 16 HA ASN 16 4.565 -5.112 -6.207
93 HB2 ASN 16 1HB ASN 16 5.354 -5.168 -8.517
94 HB3 ASN 16 2HB ASN 16 3.600 -5.023 -8.478
95 HD21 ASN 16 1HD2 ASN 16 6.600 -3.318 -9.038
96 HD22 ASN 16 2HD2 ASN 16 5.918 -2.029 -9.964
97 H GLU 17 H GLU 17 4.936 -1.696 -6.499
98 HA GLU 17 HA GLU 17 7.698 -1.469 -6.844
99 HB2 GLU 17 1HB GLU 17 5.754 0.301 -5.360
100 HB3 GLU 17 2HB GLU 17 7.429 0.740 -5.665
101 HG2 GLU 17 1HG GLU 17 5.339 0.179 -7.756
102 HG3 GLU 17 2HG GLU 17 5.937 1.767 -7.282
103 H CYS 18 H CYS 18 5.796 -1.665 -3.847
104 HA CYS 18 HA CYS 18 8.291 -2.290 -2.407
105 HB2 CYS 18 1HB CYS 18 7.178 -1.441 -0.376
106 HB3 CYS 18 2HB CYS 18 7.289 -0.206 -1.626
107 H GLY 19 H GLY 19 4.828 -3.031 -2.635
108 HA2 GLY 19 1HA GLY 19 4.233 -5.412 -2.740
109 HA3 GLY 19 2HA GLY 19 5.437 -5.685 -1.488
110 H LYS 20 H LYS 20 2.619 -3.549 -1.966
111 HA LYS 20 HA LYS 20 1.806 -4.183 0.793
112 HB2 LYS 20 1HB LYS 20 2.329 -1.744 -0.050
113 HB3 LYS 20 2HB LYS 20 0.704 -1.846 -0.715
114 HG2 LYS 20 1HG LYS 20 -0.290 -1.874 1.344
115 HG3 LYS 20 2HG LYS 20 1.121 -2.578 2.137
116 HD2 LYS 20 1HD LYS 20 1.309 0.166 0.974
117 HD3 LYS 20 2HD LYS 20 0.497 -0.064 2.524
118 HE2 LYS 20 1HE LYS 20 2.485 -1.086 3.450
119 HE3 LYS 20 2HE LYS 20 3.296 -0.990 1.888
120 HZ1 LYS 20 3HZ LYS 20 3.152 0.958 3.913
121 HZ2 LYS 20 1HZ LYS 20 2.414 1.570 2.519
122 HZ3 LYS 20 2HZ LYS 20 4.009 1.012 2.455
123 H ALA 21 H ALA 21 -0.712 -3.727 1.002
124 HA ALA 21 HA ALA 21 -2.149 -4.870 -1.278
125 HB1 ALA 21 3HB ALA 21 -1.622 -6.231 1.248
126 HB2 ALA 21 1HB ALA 21 -3.333 -6.177 0.821
127 HB3 ALA 21 2HB ALA 21 -2.166 -6.879 -0.300
128 H PHE 22 H PHE 22 -4.034 -3.881 -1.626
129 HA PHE 22 HA PHE 22 -5.253 -2.372 0.590
130 HB2 PHE 22 1HB PHE 22 -5.427 -1.416 -2.251
131 HB3 PHE 22 2HB PHE 22 -5.645 -0.505 -0.761
132 HD1 PHE 22 HD2 PHE 22 -3.107 -2.181 -2.870
133 HD2 PHE 22 HD1 PHE 22 -3.861 0.649 0.218
134 HE1 PHE 22 HE2 PHE 22 -0.769 -1.425 -2.997
135 HE2 PHE 22 HE1 PHE 22 -1.525 1.410 0.096
136 HZ PHE 22 HZ PHE 22 0.025 0.372 -1.512
137 H SER 23 H SER 23 -7.561 -1.998 0.371
138 HA SER 23 HA SER 23 -8.876 -4.320 -0.795
139 HB2 SER 23 1HB SER 23 -9.402 -3.706 1.529
140 HB3 SER 23 2HB SER 23 -9.978 -2.130 0.985
141 HG SER 23 HG SER 23 -11.359 -3.664 -0.455
142 H VAL 24 H VAL 24 -9.138 -0.778 -0.902
143 HA VAL 24 HA VAL 24 -11.062 -0.891 -3.063
144 HB VAL 24 HB VAL 24 -9.689 1.614 -2.137
145 HG11 VAL 24 1HG1 VAL 24 -11.954 0.923 -3.808
146 HG12 VAL 24 2HG1 VAL 24 -12.391 2.065 -2.536
147 HG13 VAL 24 3HG1 VAL 24 -11.086 2.450 -3.658
148 HG21 VAL 24 3HG2 VAL 24 -11.938 1.600 -0.644
149 HG22 VAL 24 1HG2 VAL 24 -11.524 -0.114 -0.615
150 HG23 VAL 24 2HG2 VAL 24 -10.360 1.084 -0.049
151 H TYR 25 H TYR 25 -10.707 -0.369 -5.182
152 HA TYR 25 HA TYR 25 -8.226 -0.913 -6.320
153 HB2 TYR 25 1HB TYR 25 -10.253 -1.111 -7.619
154 HB3 TYR 25 2HB TYR 25 -10.582 0.609 -7.448
155 HD1 TYR 25 HD2 TYR 25 -7.785 -1.575 -8.641
156 HD2 TYR 25 HD1 TYR 25 -10.138 1.910 -9.293
157 HE1 TYR 25 HE2 TYR 25 -6.552 -1.139 -10.724
158 HE2 TYR 25 HE1 TYR 25 -8.913 2.354 -11.378
159 HH TYR 25 HH TYR 25 -6.636 1.780 -12.334
160 H SER 26 H SER 26 -9.667 2.138 -5.342
161 HA SER 26 HA SER 26 -7.701 3.799 -6.562
162 HB2 SER 26 1HB SER 26 -9.870 4.216 -4.536
163 HB3 SER 26 2HB SER 26 -8.655 5.472 -4.773
164 HG SER 26 HG SER 26 -9.838 4.399 -7.053
165 H SER 27 H SER 27 -8.189 2.606 -3.254
166 HA SER 27 HA SER 27 -6.188 3.895 -1.911
167 HB2 SER 27 1HB SER 27 -7.274 1.103 -1.654
168 HB3 SER 27 2HB SER 27 -5.978 1.665 -0.597
169 HG SER 27 HG SER 27 -8.007 2.048 0.342
170 H LEU 28 H LEU 28 -5.860 1.553 -4.410
171 HA LEU 28 HA LEU 28 -3.126 0.869 -3.784
172 HB2 LEU 28 1HB LEU 28 -4.179 -0.884 -4.832
173 HB3 LEU 28 2HB LEU 28 -5.073 0.169 -5.927
174 HG LEU 28 HG LEU 28 -2.917 0.580 -7.143
175 HD11 LEU 28 1HD1 LEU 28 -1.979 -1.373 -5.099
176 HD12 LEU 28 2HD1 LEU 28 -1.177 0.058 -5.745
177 HD13 LEU 28 3HD1 LEU 28 -1.273 -1.412 -6.715
178 HD21 LEU 28 3HD2 LEU 28 -3.060 -2.250 -7.505
179 HD22 LEU 28 1HD2 LEU 28 -3.684 -0.964 -8.537
180 HD23 LEU 28 2HD2 LEU 28 -4.683 -1.614 -7.237
181 H THR 29 H THR 29 -4.822 2.886 -6.145
182 HA THR 29 HA THR 29 -2.453 3.698 -7.517
183 HB THR 29 HB THR 29 -3.863 5.351 -8.630
184 HG1 THR 29 HG1 THR 29 -5.342 6.133 -7.293
185 HG21 THR 29 3HG2 THR 29 -5.135 2.637 -8.289
186 HG22 THR 29 1HG2 THR 29 -3.986 3.133 -9.530
187 HG23 THR 29 2HG2 THR 29 -5.618 3.801 -9.522
188 H THR 30 H THR 30 -4.454 5.111 -4.967
189 HA THR 30 HA THR 30 -3.206 7.617 -4.831
190 HB THR 30 HB THR 30 -5.366 6.892 -3.681
191 HG1 THR 30 HG1 THR 30 -3.464 8.290 -2.081
192 HG21 THR 30 3HG2 THR 30 -3.408 5.965 -1.577
193 HG22 THR 30 1HG2 THR 30 -4.453 4.919 -2.536
194 HG23 THR 30 2HG2 THR 30 -5.159 6.063 -1.394
195 H HIS 31 H HIS 31 -2.306 4.503 -3.527
196 HA HIS 31 HA HIS 31 -0.314 5.511 -1.734
197 HB2 HIS 31 1HB HIS 31 -1.012 3.424 -1.055
198 HB3 HIS 31 2HB HIS 31 -1.159 2.818 -2.702
199 HD1 HIS 31 HD1 HIS 31 1.431 3.482 -0.043
200 HD2 HIS 31 HD2 HIS 31 1.047 1.479 -3.663
201 HE1 HIS 31 HE1 HIS 31 3.532 2.120 -0.285
202 H GLN 32 H GLN 32 -0.182 3.867 -4.891
203 HA GLN 32 HA GLN 32 2.508 3.746 -5.313
204 HB2 GLN 32 1HB GLN 32 0.179 4.156 -7.124
205 HB3 GLN 32 2HB GLN 32 1.789 4.374 -7.796
206 HG2 GLN 32 1HG GLN 32 2.383 2.108 -7.036
207 HG3 GLN 32 2HG GLN 32 0.732 1.897 -6.455
208 HE21 GLN 32 1HE2 GLN 32 -0.060 0.390 -7.776
209 HE22 GLN 32 2HE2 GLN 32 -0.113 0.506 -9.499
210 H VAL 33 H VAL 33 0.580 6.577 -5.061
211 HA VAL 33 HA VAL 33 1.930 8.464 -6.540
212 HB VAL 33 HB VAL 33 0.756 8.804 -3.777
213 HG11 VAL 33 1HG1 VAL 33 2.337 10.604 -4.386
214 HG12 VAL 33 2HG1 VAL 33 1.382 10.918 -5.836
215 HG13 VAL 33 3HG1 VAL 33 0.674 11.172 -4.240
216 HG21 VAL 33 3HG2 VAL 33 -1.176 9.735 -5.053
217 HG22 VAL 33 1HG2 VAL 33 -0.397 9.181 -6.536
218 HG23 VAL 33 2HG2 VAL 33 -0.902 8.012 -5.316
219 H ILE 34 H ILE 34 2.799 7.117 -3.396
220 HA ILE 34 HA ILE 34 4.960 8.872 -2.877
221 HB ILE 34 HB ILE 34 5.636 7.321 -1.160
222 HG12 ILE 34 1HG1 ILE 34 3.538 5.337 -1.918
223 HG13 ILE 34 2HG1 ILE 34 5.058 5.320 -2.806
224 HG21 ILE 34 1HG2 ILE 34 3.955 8.202 -0.007
225 HG22 ILE 34 2HG2 ILE 34 2.950 8.296 -1.453
226 HG23 ILE 34 3HG2 ILE 34 2.967 6.821 -0.486
227 HD11 ILE 34 3HD1 ILE 34 5.605 3.865 -1.173
228 HD12 ILE 34 1HD1 ILE 34 6.032 5.354 -0.331
229 HD13 ILE 34 2HD1 ILE 34 4.484 4.573 -0.011
230 H HIS 35 H HIS 35 4.617 6.062 -4.862
231 HA HIS 35 HA HIS 35 7.462 5.569 -5.060
232 HB2 HIS 35 1HB HIS 35 5.039 4.366 -6.386
233 HB3 HIS 35 2HB HIS 35 6.675 3.952 -6.891
234 HD1 HIS 35 HD1 HIS 35 8.171 3.406 -4.434
235 HD2 HIS 35 HD2 HIS 35 4.152 2.407 -4.768
236 HE1 HIS 35 HE1 HIS 35 7.780 1.612 -2.716
237 H THR 36 H THR 36 5.135 7.542 -6.596
238 HA THR 36 HA THR 36 7.067 8.164 -8.734
239 HB THR 36 HB THR 36 5.098 7.011 -9.667
240 HG1 THR 36 HG1 THR 36 5.190 8.325 -11.335
241 HG21 THR 36 3HG2 THR 36 3.650 8.342 -7.782
242 HG22 THR 36 1HG2 THR 36 2.961 7.547 -9.197
243 HG23 THR 36 2HG2 THR 36 3.287 9.280 -9.230
244 H GLY 37 H GLY 37 7.935 9.838 -7.419
245 HA2 GLY 37 1HA GLY 37 6.244 11.957 -6.449
246 HA3 GLY 37 2HA GLY 37 8.001 11.927 -6.422
247 H GLU 38 H GLU 38 9.026 12.148 -8.666
248 HA GLU 38 HA GLU 38 7.848 14.504 -9.897
249 HB2 GLU 38 1HB GLU 38 10.373 14.050 -9.253
250 HB3 GLU 38 2HB GLU 38 10.413 13.303 -10.844
251 HG2 GLU 38 1HG GLU 38 9.379 15.507 -11.670
252 HG3 GLU 38 2HG GLU 38 9.906 16.160 -10.120
253 H LYS 39 H LYS 39 7.537 14.719 -12.164
254 HA LYS 39 HA LYS 39 6.455 12.341 -13.375
255 HB2 LYS 39 1HB LYS 39 5.799 13.863 -15.211
256 HB3 LYS 39 2HB LYS 39 5.267 14.438 -13.636
257 HG2 LYS 39 1HG LYS 39 6.076 16.382 -14.471
258 HG3 LYS 39 2HG LYS 39 7.563 15.755 -13.755
259 HD2 LYS 39 1HD LYS 39 8.126 14.766 -15.978
260 HD3 LYS 39 2HD LYS 39 6.719 15.594 -16.647
261 HE2 LYS 39 1HE LYS 39 7.651 17.712 -16.277
262 HE3 LYS 39 2HE LYS 39 8.851 17.083 -15.149
263 HZ1 LYS 39 3HZ LYS 39 10.231 16.515 -16.805
264 HZ2 LYS 39 1HZ LYS 39 9.352 17.640 -17.713
265 HZ3 LYS 39 2HZ LYS 39 8.989 15.992 -17.827
266 HA PRO 40 HA PRO 40 9.980 11.155 -15.730
267 HB2 PRO 40 1HB PRO 40 8.733 9.798 -17.723
268 HB3 PRO 40 2HB PRO 40 8.890 9.163 -16.081
269 HG2 PRO 40 1HG PRO 40 6.554 10.519 -17.373
270 HG3 PRO 40 2HG PRO 40 6.579 9.088 -16.326
271 HD2 PRO 40 1HD PRO 40 5.913 11.550 -15.415
272 HD3 PRO 40 2HD PRO 40 6.733 10.345 -14.400
273 H SER 41 H SER 41 10.674 11.095 -18.133
274 HA SER 41 HA SER 41 10.661 13.725 -19.120
275 HB2 SER 41 1HB SER 41 11.858 12.822 -21.050
276 HB3 SER 41 2HB SER 41 12.473 12.098 -19.564
277 HG SER 41 HG SER 41 11.489 10.866 -21.688
278 H GLY 42 H GLY 42 9.303 14.792 -20.410
279 HA2 GLY 42 1HA GLY 42 7.563 13.321 -22.236
280 HA3 GLY 42 2HA GLY 42 6.773 14.274 -20.990
281 HA PRO 43 HA PRO 43 9.098 17.298 -24.008
282 HB2 PRO 43 1HB PRO 43 9.644 16.255 -26.454
283 HB3 PRO 43 2HB PRO 43 10.790 16.203 -25.110
284 HG2 PRO 43 1HG PRO 43 8.939 14.071 -26.105
285 HG3 PRO 43 2HG PRO 43 10.632 13.934 -25.597
286 HD2 PRO 43 1HD PRO 43 8.569 13.234 -23.990
287 HD3 PRO 43 2HD PRO 43 10.089 13.898 -23.358
288 H SER 44 H SER 44 8.196 18.570 -25.727
289 HA SER 44 HA SER 44 5.502 18.696 -25.914
290 HB2 SER 44 1HB SER 44 7.472 19.389 -28.107
291 HB3 SER 44 2HB SER 44 5.796 19.934 -28.051
292 HG SER 44 HG SER 44 7.563 20.409 -25.904
293 H SER 45 H SER 45 3.934 18.129 -27.522
294 HA SER 45 HA SER 45 3.841 15.441 -28.168
295 HB2 SER 45 1HB SER 45 1.810 16.716 -28.129
296 HB3 SER 45 2HB SER 45 2.391 17.788 -29.404
297 HG SER 45 HG SER 45 1.047 16.315 -30.361
298 H GLY 46 H GLY 46 4.780 14.225 -29.671
299 HA2 GLY 46 1HA GLY 46 5.723 15.522 -32.145
300 HA3 GLY 46 2HA GLY 46 6.803 14.489 -31.220
Start of MODEL 8
1 H1 GLY 1 H GLY 1 2.712 -24.971 11.131
2 HA2 GLY 1 1HA GLY 1 5.184 -24.225 12.002
3 HA3 GLY 1 2HA GLY 1 5.355 -24.245 10.253
4 H SER 2 H SER 2 4.212 -22.740 8.998
5 HA SER 2 HA SER 2 3.419 -20.354 10.500
6 HB2 SER 2 1HB SER 2 5.174 -20.107 8.770
7 HB3 SER 2 2HB SER 2 4.026 -20.655 7.548
8 HG SER 2 HG SER 2 3.235 -18.718 7.489
9 H SER 3 H SER 3 1.313 -20.410 10.997
10 HA SER 3 HA SER 3 -0.589 -20.981 8.818
11 HB2 SER 3 1HB SER 3 -0.646 -21.803 11.706
12 HB3 SER 3 2HB SER 3 -2.153 -21.613 10.810
13 HG SER 3 HG SER 3 -1.108 -23.061 9.214
14 H GLY 4 H GLY 4 -2.855 -20.055 9.463
15 HA2 GLY 4 1HA GLY 4 -2.590 -17.471 10.823
16 HA3 GLY 4 2HA GLY 4 -3.114 -17.471 9.146
17 H SER 5 H SER 5 -4.645 -16.414 11.242
18 HA SER 5 HA SER 5 -6.659 -18.352 11.971
19 HB2 SER 5 1HB SER 5 -6.405 -15.376 12.422
20 HB3 SER 5 2HB SER 5 -7.808 -16.307 12.945
21 HG SER 5 HG SER 5 -6.637 -17.262 14.458
22 H SER 6 H SER 6 -6.542 -18.412 9.295
23 HA SER 6 HA SER 6 -7.598 -17.891 7.303
24 HB2 SER 6 1HB SER 6 -9.843 -18.674 7.327
25 HB3 SER 6 2HB SER 6 -9.014 -19.568 8.601
26 HG SER 6 HG SER 6 -9.850 -17.809 10.017
27 H GLY 7 H GLY 7 -6.830 -15.505 8.452
28 HA2 GLY 7 1HA GLY 7 -9.167 -13.775 7.919
29 HA3 GLY 7 2HA GLY 7 -7.929 -13.376 9.102
30 H THR 8 H THR 8 -7.749 -14.547 5.745
31 HA THR 8 HA THR 8 -5.796 -12.445 5.182
32 HB THR 8 HB THR 8 -6.609 -14.786 3.448
33 HG1 THR 8 HG1 THR 8 -5.527 -15.751 5.047
34 HG21 THR 8 3HG2 THR 8 -4.452 -12.701 3.240
35 HG22 THR 8 1HG2 THR 8 -5.658 -13.160 2.038
36 HG23 THR 8 2HG2 THR 8 -4.328 -14.256 2.417
37 H GLY 9 H GLY 9 -7.282 -10.688 5.081
38 HA2 GLY 9 1HA GLY 9 -9.603 -10.454 3.659
39 HA3 GLY 9 2HA GLY 9 -8.447 -9.142 3.830
40 H VAL 10 H VAL 10 -10.239 -10.293 1.587
41 HA VAL 10 HA VAL 10 -8.478 -11.135 -0.478
42 HB VAL 10 HB VAL 10 -10.737 -11.742 -0.760
43 HG11 VAL 10 1HG1 VAL 10 -11.340 -8.846 -0.248
44 HG12 VAL 10 2HG1 VAL 10 -12.517 -9.925 -0.999
45 HG13 VAL 10 3HG1 VAL 10 -11.918 -10.264 0.625
46 HG21 VAL 10 3HG2 VAL 10 -9.465 -10.839 -2.791
47 HG22 VAL 10 1HG2 VAL 10 -11.213 -11.021 -2.936
48 HG23 VAL 10 2HG2 VAL 10 -10.512 -9.426 -2.658
49 H LYS 11 H LYS 11 -6.780 -9.649 -0.580
50 HA LYS 11 HA LYS 11 -7.492 -6.952 -1.523
51 HB2 LYS 11 1HB LYS 11 -4.947 -7.948 -0.231
52 HB3 LYS 11 2HB LYS 11 -5.187 -6.316 -0.840
53 HG2 LYS 11 1HG LYS 11 -6.541 -5.718 0.889
54 HG3 LYS 11 2HG LYS 11 -7.145 -7.359 1.129
55 HD2 LYS 11 1HD LYS 11 -4.843 -7.949 1.984
56 HD3 LYS 11 2HD LYS 11 -4.490 -6.219 1.978
57 HE2 LYS 11 1HE LYS 11 -6.919 -7.270 3.376
58 HE3 LYS 11 2HE LYS 11 -5.340 -7.343 4.157
59 HZ1 LYS 11 3HZ LYS 11 -5.223 -5.088 4.342
60 HZ2 LYS 11 1HZ LYS 11 -6.900 -5.281 4.454
61 HZ3 LYS 11 2HZ LYS 11 -6.200 -4.795 2.992
62 HA PRO 12 HA PRO 12 -5.878 -9.041 -5.284
63 HB2 PRO 12 1HB PRO 12 -7.482 -7.665 -6.988
64 HB3 PRO 12 2HB PRO 12 -8.006 -9.128 -6.145
65 HG2 PRO 12 1HG PRO 12 -8.537 -6.260 -5.471
66 HG3 PRO 12 2HG PRO 12 -9.649 -7.641 -5.438
67 HD2 PRO 12 1HD PRO 12 -8.481 -6.656 -3.202
68 HD3 PRO 12 2HD PRO 12 -8.873 -8.377 -3.396
69 H TYR 13 H TYR 13 -6.658 -5.595 -4.862
70 HA TYR 13 HA TYR 13 -4.646 -4.772 -6.754
71 HB2 TYR 13 1HB TYR 13 -6.332 -3.163 -4.826
72 HB3 TYR 13 2HB TYR 13 -5.286 -2.478 -6.064
73 HD1 TYR 13 HD1 TYR 13 -5.768 -3.256 -8.512
74 HD2 TYR 13 HD2 TYR 13 -8.562 -3.568 -5.319
75 HE1 TYR 13 HE1 TYR 13 -7.606 -3.382 -10.142
76 HE2 TYR 13 HE2 TYR 13 -10.408 -3.697 -6.940
77 HH TYR 13 HH TYR 13 -10.549 -2.751 -9.645
78 H MET 14 H MET 14 -2.661 -5.440 -6.004
79 HA MET 14 HA MET 14 -1.767 -4.223 -3.473
80 HB2 MET 14 1HB MET 14 -0.029 -6.091 -3.492
81 HB3 MET 14 2HB MET 14 -1.686 -6.551 -3.121
82 HG2 MET 14 1HG MET 14 -1.965 -7.246 -5.485
83 HG3 MET 14 2HG MET 14 -0.254 -6.909 -5.741
84 HE1 MET 14 3HE MET 14 -2.932 -9.184 -4.618
85 HE2 MET 14 1HE MET 14 -2.161 -10.514 -3.753
86 HE3 MET 14 2HE MET 14 -2.433 -8.974 -2.939
87 H CYS 15 H CYS 15 0.334 -3.346 -3.402
88 HA CYS 15 HA CYS 15 1.206 -2.232 -5.915
89 HB2 CYS 15 1HB CYS 15 1.173 -0.827 -3.918
90 HB3 CYS 15 2HB CYS 15 2.301 -1.913 -3.113
91 H ASN 16 H ASN 16 2.653 -3.127 -7.214
92 HA ASN 16 HA ASN 16 4.338 -5.289 -6.205
93 HB2 ASN 16 1HB ASN 16 2.909 -5.399 -8.362
94 HB3 ASN 16 2HB ASN 16 4.184 -4.418 -9.079
95 HD21 ASN 16 1HD2 ASN 16 3.158 -7.520 -8.345
96 HD22 ASN 16 2HD2 ASN 16 4.630 -8.363 -8.670
97 H GLU 17 H GLU 17 5.042 -2.726 -5.324
98 HA GLU 17 HA GLU 17 7.622 -2.371 -6.696
99 HB2 GLU 17 1HB GLU 17 5.931 -0.168 -5.500
100 HB3 GLU 17 2HB GLU 17 7.505 0.033 -6.255
101 HG2 GLU 17 1HG GLU 17 5.248 -1.176 -7.791
102 HG3 GLU 17 2HG GLU 17 5.361 0.572 -7.595
103 H CYS 18 H CYS 18 5.797 -2.007 -3.688
104 HA CYS 18 HA CYS 18 8.339 -2.182 -2.207
105 HB2 CYS 18 1HB CYS 18 7.235 -1.006 -0.370
106 HB3 CYS 18 2HB CYS 18 7.157 -0.054 -1.849
107 H GLY 19 H GLY 19 4.924 -3.156 -2.191
108 HA2 GLY 19 1HA GLY 19 4.651 -5.632 -1.846
109 HA3 GLY 19 2HA GLY 19 5.678 -5.411 -0.437
110 H LYS 20 H LYS 20 2.973 -3.447 -1.632
111 HA LYS 20 HA LYS 20 1.681 -3.818 0.987
112 HB2 LYS 20 1HB LYS 20 1.818 -1.525 -0.919
113 HB3 LYS 20 2HB LYS 20 0.380 -1.697 0.079
114 HG2 LYS 20 1HG LYS 20 2.026 -1.868 2.048
115 HG3 LYS 20 2HG LYS 20 3.207 -1.195 0.921
116 HD2 LYS 20 1HD LYS 20 2.396 0.732 1.861
117 HD3 LYS 20 2HD LYS 20 1.294 0.566 0.492
118 HE2 LYS 20 1HE LYS 20 -0.200 -0.743 2.127
119 HE3 LYS 20 2HE LYS 20 0.806 -0.037 3.391
120 HZ1 LYS 20 3HZ LYS 20 -0.126 1.884 1.468
121 HZ2 LYS 20 1HZ LYS 20 -0.176 1.934 3.159
122 HZ3 LYS 20 2HZ LYS 20 -1.384 1.119 2.301
123 H ALA 21 H ALA 21 -0.732 -3.705 0.948
124 HA ALA 21 HA ALA 21 -1.921 -4.706 -1.533
125 HB1 ALA 21 3HB ALA 21 -2.691 -6.683 -0.682
126 HB2 ALA 21 1HB ALA 21 -1.168 -6.544 0.198
127 HB3 ALA 21 2HB ALA 21 -2.684 -6.098 0.982
128 H PHE 22 H PHE 22 -3.966 -4.014 -1.884
129 HA PHE 22 HA PHE 22 -5.413 -2.746 0.333
130 HB2 PHE 22 1HB PHE 22 -5.382 -1.481 -2.393
131 HB3 PHE 22 2HB PHE 22 -5.843 -0.767 -0.851
132 HD1 PHE 22 HD2 PHE 22 -2.895 -2.173 -2.634
133 HD2 PHE 22 HD1 PHE 22 -4.341 0.573 0.278
134 HE1 PHE 22 HE2 PHE 22 -0.632 -1.237 -2.398
135 HE2 PHE 22 HE1 PHE 22 -2.081 1.515 0.518
136 HZ PHE 22 HZ PHE 22 -0.222 0.609 -0.820
137 H SER 23 H SER 23 -7.709 -2.536 -0.022
138 HA SER 23 HA SER 23 -8.743 -4.763 -1.582
139 HB2 SER 23 1HB SER 23 -10.238 -2.897 0.273
140 HB3 SER 23 2HB SER 23 -10.808 -4.443 -0.356
141 HG SER 23 HG SER 23 -8.727 -3.961 1.500
142 H VAL 24 H VAL 24 -9.166 -1.254 -1.332
143 HA VAL 24 HA VAL 24 -10.920 -1.227 -3.653
144 HB VAL 24 HB VAL 24 -9.896 1.286 -2.415
145 HG11 VAL 24 1HG1 VAL 24 -12.757 0.834 -2.950
146 HG12 VAL 24 2HG1 VAL 24 -11.734 2.221 -3.329
147 HG13 VAL 24 3HG1 VAL 24 -11.698 0.789 -4.360
148 HG21 VAL 24 3HG2 VAL 24 -11.364 -0.812 -0.989
149 HG22 VAL 24 1HG2 VAL 24 -10.447 0.559 -0.364
150 HG23 VAL 24 2HG2 VAL 24 -12.110 0.784 -0.907
151 H TYR 25 H TYR 25 -10.409 -0.427 -5.644
152 HA TYR 25 HA TYR 25 -7.761 -0.580 -6.532
153 HB2 TYR 25 1HB TYR 25 -9.490 -0.911 -8.128
154 HB3 TYR 25 2HB TYR 25 -10.231 0.642 -7.757
155 HD1 TYR 25 HD2 TYR 25 -6.925 -0.671 -8.923
156 HD2 TYR 25 HD1 TYR 25 -9.922 2.326 -9.297
157 HE1 TYR 25 HE2 TYR 25 -5.652 0.366 -10.754
158 HE2 TYR 25 HE1 TYR 25 -8.658 3.370 -11.130
159 HH TYR 25 HH TYR 25 -5.598 2.961 -11.720
160 H SER 26 H SER 26 -9.703 2.162 -5.495
161 HA SER 26 HA SER 26 -7.941 4.197 -6.348
162 HB2 SER 26 1HB SER 26 -10.371 4.459 -5.630
163 HB3 SER 26 2HB SER 26 -9.790 4.382 -3.967
164 HG SER 26 HG SER 26 -8.257 6.133 -4.933
165 H SER 27 H SER 27 -8.308 2.517 -3.245
166 HA SER 27 HA SER 27 -6.448 3.938 -1.754
167 HB2 SER 27 1HB SER 27 -7.522 1.151 -1.632
168 HB3 SER 27 2HB SER 27 -6.142 1.567 -0.615
169 HG SER 27 HG SER 27 -8.638 2.022 -0.079
170 H LEU 28 H LEU 28 -5.970 1.493 -4.194
171 HA LEU 28 HA LEU 28 -3.254 0.915 -3.585
172 HB2 LEU 28 1HB LEU 28 -4.460 -0.676 -4.854
173 HB3 LEU 28 2HB LEU 28 -4.940 0.534 -6.043
174 HG LEU 28 HG LEU 28 -2.551 0.682 -6.751
175 HD11 LEU 28 1HD1 LEU 28 -2.300 -1.380 -4.622
176 HD12 LEU 28 2HD1 LEU 28 -1.208 -0.067 -5.061
177 HD13 LEU 28 3HD1 LEU 28 -1.288 -1.518 -6.060
178 HD21 LEU 28 3HD2 LEU 28 -3.468 -2.157 -6.986
179 HD22 LEU 28 1HD2 LEU 28 -2.708 -1.122 -8.196
180 HD23 LEU 28 2HD2 LEU 28 -4.389 -0.851 -7.735
181 H THR 29 H THR 29 -4.822 3.091 -5.905
182 HA THR 29 HA THR 29 -2.431 4.049 -7.077
183 HB THR 29 HB THR 29 -3.810 5.900 -7.951
184 HG1 THR 29 HG1 THR 29 -6.009 4.744 -6.579
185 HG21 THR 29 3HG2 THR 29 -5.344 4.555 -9.268
186 HG22 THR 29 1HG2 THR 29 -5.219 3.233 -8.108
187 HG23 THR 29 2HG2 THR 29 -3.816 3.698 -9.070
188 H THR 30 H THR 30 -4.515 5.352 -4.510
189 HA THR 30 HA THR 30 -3.268 7.754 -4.027
190 HB THR 30 HB THR 30 -4.291 5.942 -1.838
191 HG1 THR 30 HG1 THR 30 -6.325 6.681 -2.340
192 HG21 THR 30 3HG2 THR 30 -3.139 7.968 -1.077
193 HG22 THR 30 1HG2 THR 30 -4.866 8.046 -0.729
194 HG23 THR 30 2HG2 THR 30 -4.199 8.951 -2.087
195 H HIS 31 H HIS 31 -2.206 4.536 -3.170
196 HA HIS 31 HA HIS 31 -0.071 5.502 -1.470
197 HB2 HIS 31 1HB HIS 31 -0.793 3.463 -0.672
198 HB3 HIS 31 2HB HIS 31 -1.108 2.824 -2.282
199 HD1 HIS 31 HD1 HIS 31 1.721 3.430 0.132
200 HD2 HIS 31 HD2 HIS 31 0.962 1.393 -3.408
201 HE1 HIS 31 HE1 HIS 31 3.741 1.985 -0.257
202 H GLN 32 H GLN 32 -0.333 3.824 -4.597
203 HA GLN 32 HA GLN 32 2.326 3.598 -5.249
204 HB2 GLN 32 1HB GLN 32 -0.114 4.076 -6.935
205 HB3 GLN 32 2HB GLN 32 1.478 3.955 -7.672
206 HG2 GLN 32 1HG GLN 32 1.611 1.739 -6.282
207 HG3 GLN 32 2HG GLN 32 -0.147 1.869 -6.311
208 HE21 GLN 32 1HE2 GLN 32 1.453 -0.167 -7.522
209 HE22 GLN 32 2HE2 GLN 32 1.160 -0.104 -9.223
210 H VAL 33 H VAL 33 0.503 6.459 -4.873
211 HA VAL 33 HA VAL 33 1.675 8.257 -6.610
212 HB VAL 33 HB VAL 33 -0.199 8.670 -4.916
213 HG11 VAL 33 1HG1 VAL 33 2.118 9.449 -3.152
214 HG12 VAL 33 2HG1 VAL 33 0.399 9.559 -2.771
215 HG13 VAL 33 3HG1 VAL 33 1.165 7.980 -2.947
216 HG21 VAL 33 3HG2 VAL 33 -0.030 10.888 -5.342
217 HG22 VAL 33 1HG2 VAL 33 1.640 10.979 -4.781
218 HG23 VAL 33 2HG2 VAL 33 1.283 10.352 -6.390
219 H ILE 34 H ILE 34 3.043 6.701 -3.838
220 HA ILE 34 HA ILE 34 5.221 8.550 -3.513
221 HB ILE 34 HB ILE 34 6.111 6.993 -1.902
222 HG12 ILE 34 1HG1 ILE 34 3.908 5.032 -2.374
223 HG13 ILE 34 2HG1 ILE 34 5.305 4.996 -3.445
224 HG21 ILE 34 1HG2 ILE 34 4.279 8.395 -1.157
225 HG22 ILE 34 2HG2 ILE 34 3.110 7.192 -1.701
226 HG23 ILE 34 3HG2 ILE 34 4.199 6.821 -0.365
227 HD11 ILE 34 3HD1 ILE 34 6.439 3.843 -1.945
228 HD12 ILE 34 1HD1 ILE 34 6.226 5.131 -0.760
229 HD13 ILE 34 2HD1 ILE 34 5.026 3.846 -0.890
230 H HIS 35 H HIS 35 4.588 5.726 -5.411
231 HA HIS 35 HA HIS 35 7.406 5.366 -6.072
232 HB2 HIS 35 1HB HIS 35 4.948 3.828 -6.933
233 HB3 HIS 35 2HB HIS 35 6.598 3.421 -7.392
234 HD1 HIS 35 HD1 HIS 35 8.153 2.491 -5.500
235 HD2 HIS 35 HD2 HIS 35 4.185 3.030 -4.392
236 HE1 HIS 35 HE1 HIS 35 7.879 1.227 -3.343
237 H THR 36 H THR 36 4.467 6.663 -7.403
238 HA THR 36 HA THR 36 5.944 7.395 -9.848
239 HB THR 36 HB THR 36 4.246 5.787 -10.459
240 HG1 THR 36 HG1 THR 36 2.839 7.378 -11.712
241 HG21 THR 36 3HG2 THR 36 2.688 7.209 -8.482
242 HG22 THR 36 1HG2 THR 36 2.416 5.618 -9.191
243 HG23 THR 36 2HG2 THR 36 1.807 7.060 -10.002
244 H GLY 37 H GLY 37 6.535 9.310 -8.558
245 HA2 GLY 37 1HA GLY 37 4.536 11.408 -8.951
246 HA3 GLY 37 2HA GLY 37 5.159 11.191 -7.322
247 H GLU 38 H GLU 38 7.158 11.965 -6.796
248 HA GLU 38 HA GLU 38 8.241 14.001 -8.451
249 HB2 GLU 38 1HB GLU 38 8.294 13.878 -5.905
250 HB3 GLU 38 2HB GLU 38 9.622 12.740 -6.086
251 HG2 GLU 38 1HG GLU 38 10.896 14.449 -7.307
252 HG3 GLU 38 2HG GLU 38 9.574 15.589 -7.058
253 H LYS 39 H LYS 39 9.199 13.465 -10.315
254 HA LYS 39 HA LYS 39 11.003 11.161 -10.399
255 HB2 LYS 39 1HB LYS 39 10.958 11.537 -12.867
256 HB3 LYS 39 2HB LYS 39 9.380 11.196 -12.169
257 HG2 LYS 39 1HG LYS 39 8.729 13.478 -12.322
258 HG3 LYS 39 2HG LYS 39 10.367 13.977 -12.750
259 HD2 LYS 39 1HD LYS 39 10.224 12.885 -14.869
260 HD3 LYS 39 2HD LYS 39 8.702 12.107 -14.428
261 HE2 LYS 39 1HE LYS 39 8.057 13.885 -15.797
262 HE3 LYS 39 2HE LYS 39 7.785 14.484 -14.161
263 HZ1 LYS 39 3HZ LYS 39 10.424 15.037 -15.151
264 HZ2 LYS 39 1HZ LYS 39 9.303 16.075 -14.425
265 HZ3 LYS 39 2HZ LYS 39 9.207 15.754 -16.083
266 HA PRO 40 HA PRO 40 14.620 13.666 -10.257
267 HB2 PRO 40 1HB PRO 40 16.355 11.998 -11.513
268 HB3 PRO 40 2HB PRO 40 15.773 11.717 -9.868
269 HG2 PRO 40 1HG PRO 40 14.843 10.498 -12.439
270 HG3 PRO 40 2HG PRO 40 15.129 9.721 -10.871
271 HD2 PRO 40 1HD PRO 40 12.651 10.389 -11.735
272 HD3 PRO 40 2HD PRO 40 13.101 10.409 -10.018
273 H SER 41 H SER 41 14.682 15.445 -11.493
274 HA SER 41 HA SER 41 14.399 15.310 -14.363
275 HB2 SER 41 1HB SER 41 14.780 17.583 -12.416
276 HB3 SER 41 2HB SER 41 14.777 17.834 -14.161
277 HG SER 41 HG SER 41 12.677 16.428 -12.921
278 H GLY 42 H GLY 42 16.640 13.887 -13.517
279 HA2 GLY 42 1HA GLY 42 18.658 15.081 -15.147
280 HA3 GLY 42 2HA GLY 42 19.077 15.172 -13.443
281 HA PRO 43 HA PRO 43 18.894 10.494 -14.778
282 HB2 PRO 43 1HB PRO 43 19.242 10.080 -17.439
283 HB3 PRO 43 2HB PRO 43 17.648 10.249 -16.693
284 HG2 PRO 43 1HG PRO 43 19.274 12.284 -18.169
285 HG3 PRO 43 2HG PRO 43 17.536 11.947 -18.277
286 HD2 PRO 43 1HD PRO 43 18.533 14.016 -16.842
287 HD3 PRO 43 2HD PRO 43 17.056 13.151 -16.371
288 H SER 44 H SER 44 20.738 9.318 -14.630
289 HA SER 44 HA SER 44 23.226 10.634 -15.490
290 HB2 SER 44 1HB SER 44 22.529 8.892 -13.161
291 HB3 SER 44 2HB SER 44 24.181 8.862 -13.776
292 HG SER 44 HG SER 44 22.944 11.332 -13.296
293 H SER 45 H SER 45 24.188 9.798 -17.206
294 HA SER 45 HA SER 45 23.418 7.591 -18.634
295 HB2 SER 45 1HB SER 45 26.219 8.721 -18.413
296 HB3 SER 45 2HB SER 45 25.650 7.654 -19.697
297 HG SER 45 HG SER 45 25.436 9.701 -20.471
298 H GLY 46 H GLY 46 24.203 5.459 -18.863
299 HA2 GLY 46 1HA GLY 46 25.956 3.861 -17.972
300 HA3 GLY 46 2HA GLY 46 25.418 4.400 -16.388
Start of MODEL 9
1 H1 GLY 1 H GLY 1 -8.906 -33.486 -9.051
2 HA2 GLY 1 1HA GLY 1 -9.745 -31.568 -8.055
3 HA3 GLY 1 2HA GLY 1 -10.514 -32.575 -6.837
4 H SER 2 H SER 2 -9.516 -30.362 -5.865
5 HA SER 2 HA SER 2 -7.272 -31.278 -4.267
6 HB2 SER 2 1HB SER 2 -5.789 -29.519 -4.764
7 HB3 SER 2 2HB SER 2 -6.393 -30.022 -6.343
8 HG SER 2 HG SER 2 -7.082 -27.742 -4.829
9 H SER 3 H SER 3 -6.895 -29.927 -2.381
10 HA SER 3 HA SER 3 -9.390 -28.861 -1.366
11 HB2 SER 3 1HB SER 3 -6.713 -29.468 -0.125
12 HB3 SER 3 2HB SER 3 -7.954 -28.578 0.758
13 HG SER 3 HG SER 3 -8.604 -31.009 -0.490
14 H GLY 4 H GLY 4 -6.035 -27.682 -1.663
15 HA2 GLY 4 1HA GLY 4 -5.237 -25.562 -2.077
16 HA3 GLY 4 2HA GLY 4 -6.877 -25.090 -2.499
17 H SER 5 H SER 5 -8.026 -23.880 -1.103
18 HA SER 5 HA SER 5 -7.005 -23.582 1.638
19 HB2 SER 5 1HB SER 5 -7.649 -21.385 -0.328
20 HB3 SER 5 2HB SER 5 -7.595 -21.104 1.412
21 HG SER 5 HG SER 5 -5.424 -22.416 0.264
22 H SER 6 H SER 6 -8.535 -23.222 3.215
23 HA SER 6 HA SER 6 -11.158 -24.152 2.684
24 HB2 SER 6 1HB SER 6 -9.741 -23.054 5.079
25 HB3 SER 6 2HB SER 6 -11.498 -23.195 5.120
26 HG SER 6 HG SER 6 -11.036 -25.173 5.700
27 H GLY 7 H GLY 7 -9.921 -20.937 3.603
28 HA2 GLY 7 1HA GLY 7 -12.037 -19.686 2.057
29 HA3 GLY 7 2HA GLY 7 -12.119 -19.414 3.791
30 H THR 8 H THR 8 -10.589 -18.558 0.842
31 HA THR 8 HA THR 8 -8.919 -16.609 2.292
32 HB THR 8 HB THR 8 -8.222 -17.835 -0.381
33 HG1 THR 8 HG1 THR 8 -6.507 -18.802 1.092
34 HG21 THR 8 3HG2 THR 8 -5.930 -16.882 0.816
35 HG22 THR 8 1HG2 THR 8 -7.136 -15.667 1.241
36 HG23 THR 8 2HG2 THR 8 -6.846 -16.067 -0.452
37 H GLY 9 H GLY 9 -9.074 -14.517 1.685
38 HA2 GLY 9 1HA GLY 9 -11.227 -13.747 -0.031
39 HA3 GLY 9 2HA GLY 9 -10.088 -12.666 0.758
40 H VAL 10 H VAL 10 -10.365 -11.545 -1.368
41 HA VAL 10 HA VAL 10 -8.244 -12.439 -3.180
42 HB VAL 10 HB VAL 10 -10.332 -13.201 -4.205
43 HG11 VAL 10 1HG1 VAL 10 -12.215 -12.025 -4.131
44 HG12 VAL 10 2HG1 VAL 10 -11.366 -10.806 -3.178
45 HG13 VAL 10 3HG1 VAL 10 -11.446 -10.656 -4.934
46 HG21 VAL 10 3HG2 VAL 10 -8.476 -12.423 -5.624
47 HG22 VAL 10 1HG2 VAL 10 -10.049 -12.156 -6.377
48 HG23 VAL 10 2HG2 VAL 10 -9.183 -10.808 -5.641
49 H LYS 11 H LYS 11 -6.818 -10.835 -2.890
50 HA LYS 11 HA LYS 11 -7.799 -8.062 -3.080
51 HB2 LYS 11 1HB LYS 11 -5.437 -9.222 -1.605
52 HB3 LYS 11 2HB LYS 11 -5.611 -7.498 -1.907
53 HG2 LYS 11 1HG LYS 11 -7.312 -7.263 -0.411
54 HG3 LYS 11 2HG LYS 11 -7.882 -8.919 -0.630
55 HD2 LYS 11 1HD LYS 11 -6.171 -9.793 0.742
56 HD3 LYS 11 2HD LYS 11 -5.261 -8.281 0.702
57 HE2 LYS 11 1HE LYS 11 -8.015 -8.465 1.892
58 HE3 LYS 11 2HE LYS 11 -6.563 -8.811 2.831
59 HZ1 LYS 11 3HZ LYS 11 -5.761 -6.563 2.216
60 HZ2 LYS 11 1HZ LYS 11 -7.159 -6.544 3.168
61 HZ3 LYS 11 2HZ LYS 11 -7.264 -6.250 1.506
62 HA PRO 12 HA PRO 12 -5.398 -8.701 -6.934
63 HB2 PRO 12 1HB PRO 12 -6.889 -6.964 -8.393
64 HB3 PRO 12 2HB PRO 12 -7.353 -8.650 -8.140
65 HG2 PRO 12 1HG PRO 12 -8.312 -6.190 -6.730
66 HG3 PRO 12 2HG PRO 12 -9.245 -7.581 -7.313
67 HD2 PRO 12 1HD PRO 12 -8.540 -7.285 -4.716
68 HD3 PRO 12 2HD PRO 12 -8.692 -8.876 -5.488
69 H TYR 13 H TYR 13 -6.396 -5.806 -5.222
70 HA TYR 13 HA TYR 13 -4.524 -4.094 -6.588
71 HB2 TYR 13 1HB TYR 13 -5.859 -3.410 -3.986
72 HB3 TYR 13 2HB TYR 13 -5.396 -2.340 -5.305
73 HD1 TYR 13 HD1 TYR 13 -6.627 -2.942 -7.618
74 HD2 TYR 13 HD2 TYR 13 -8.107 -3.840 -3.731
75 HE1 TYR 13 HE1 TYR 13 -8.911 -3.058 -8.521
76 HE2 TYR 13 HE2 TYR 13 -10.395 -3.960 -4.624
77 HH TYR 13 HH TYR 13 -11.356 -4.498 -7.159
78 H MET 14 H MET 14 -2.504 -5.033 -6.251
79 HA MET 14 HA MET 14 -1.463 -4.710 -3.519
80 HB2 MET 14 1HB MET 14 -1.025 -7.010 -5.415
81 HB3 MET 14 2HB MET 14 0.077 -6.673 -4.087
82 HG2 MET 14 1HG MET 14 -2.069 -6.739 -2.631
83 HG3 MET 14 2HG MET 14 -2.753 -7.607 -4.004
84 HE1 MET 14 3HE MET 14 0.886 -8.421 -1.631
85 HE2 MET 14 1HE MET 14 -0.384 -7.234 -1.329
86 HE3 MET 14 2HE MET 14 -0.482 -8.836 -0.597
87 H CYS 15 H CYS 15 0.456 -3.678 -3.346
88 HA CYS 15 HA CYS 15 1.589 -2.585 -5.804
89 HB2 CYS 15 1HB CYS 15 1.091 -0.970 -4.078
90 HB3 CYS 15 2HB CYS 15 2.021 -1.884 -2.895
91 H ASN 16 H ASN 16 3.401 -3.334 -6.676
92 HA ASN 16 HA ASN 16 4.951 -5.330 -5.224
93 HB2 ASN 16 1HB ASN 16 4.293 -5.887 -7.498
94 HB3 ASN 16 2HB ASN 16 5.058 -4.423 -8.109
95 HD21 ASN 16 1HD2 ASN 16 5.916 -7.190 -6.053
96 HD22 ASN 16 2HD2 ASN 16 7.448 -7.482 -6.798
97 H GLU 17 H GLU 17 5.153 -2.038 -6.242
98 HA GLU 17 HA GLU 17 7.887 -1.620 -6.407
99 HB2 GLU 17 1HB GLU 17 5.553 0.077 -5.682
100 HB3 GLU 17 2HB GLU 17 7.154 0.700 -5.309
101 HG2 GLU 17 1HG GLU 17 6.150 1.372 -7.530
102 HG3 GLU 17 2HG GLU 17 7.792 0.730 -7.560
103 H CYS 18 H CYS 18 5.835 -1.950 -3.578
104 HA CYS 18 HA CYS 18 8.256 -2.029 -1.912
105 HB2 CYS 18 1HB CYS 18 7.111 -0.839 -0.124
106 HB3 CYS 18 2HB CYS 18 7.118 0.142 -1.586
107 H GLY 19 H GLY 19 4.808 -2.849 -2.145
108 HA2 GLY 19 1HA GLY 19 4.257 -5.237 -1.895
109 HA3 GLY 19 2HA GLY 19 5.394 -5.270 -0.555
110 H LYS 20 H LYS 20 2.389 -3.698 -1.616
111 HA LYS 20 HA LYS 20 1.352 -4.008 1.104
112 HB2 LYS 20 1HB LYS 20 1.761 -1.449 -0.357
113 HB3 LYS 20 2HB LYS 20 0.276 -1.619 0.569
114 HG2 LYS 20 1HG LYS 20 1.505 -1.990 2.590
115 HG3 LYS 20 2HG LYS 20 3.031 -2.044 1.704
116 HD2 LYS 20 1HD LYS 20 2.864 0.273 1.138
117 HD3 LYS 20 2HD LYS 20 1.217 0.363 1.766
118 HE2 LYS 20 1HE LYS 20 2.148 -0.230 4.019
119 HE3 LYS 20 2HE LYS 20 3.760 -0.050 3.329
120 HZ1 LYS 20 3HZ LYS 20 1.934 2.173 2.914
121 HZ2 LYS 20 1HZ LYS 20 3.587 2.181 3.277
122 HZ3 LYS 20 2HZ LYS 20 2.452 1.931 4.506
123 H ALA 21 H ALA 21 -0.670 -4.766 1.130
124 HA ALA 21 HA ALA 21 -2.094 -4.975 -1.419
125 HB1 ALA 21 3HB ALA 21 -3.563 -6.411 0.395
126 HB2 ALA 21 1HB ALA 21 -2.314 -7.066 -0.664
127 HB3 ALA 21 2HB ALA 21 -1.916 -6.607 0.993
128 H PHE 22 H PHE 22 -4.237 -4.325 -1.677
129 HA PHE 22 HA PHE 22 -5.425 -2.736 0.480
130 HB2 PHE 22 1HB PHE 22 -5.399 -1.727 -2.359
131 HB3 PHE 22 2HB PHE 22 -5.832 -0.851 -0.895
132 HD1 PHE 22 HD2 PHE 22 -2.999 -2.364 -2.729
133 HD2 PHE 22 HD1 PHE 22 -4.221 0.332 0.330
134 HE1 PHE 22 HE2 PHE 22 -0.696 -1.513 -2.564
135 HE2 PHE 22 HE1 PHE 22 -1.920 1.188 0.499
136 HZ PHE 22 HZ PHE 22 -0.154 0.265 -0.948
137 H SER 23 H SER 23 -7.683 -2.578 0.421
138 HA SER 23 HA SER 23 -8.969 -4.747 -1.009
139 HB2 SER 23 1HB SER 23 -10.899 -4.280 0.390
140 HB3 SER 23 2HB SER 23 -9.451 -4.309 1.396
141 HG SER 23 HG SER 23 -10.350 -2.472 2.026
142 H VAL 24 H VAL 24 -8.731 -1.292 -1.176
143 HA VAL 24 HA VAL 24 -10.757 -1.257 -3.317
144 HB VAL 24 HB VAL 24 -9.803 1.133 -1.742
145 HG11 VAL 24 1HG1 VAL 24 -12.341 1.610 -2.711
146 HG12 VAL 24 2HG1 VAL 24 -10.834 2.212 -3.403
147 HG13 VAL 24 3HG1 VAL 24 -11.559 0.729 -4.024
148 HG21 VAL 24 3HG2 VAL 24 -11.381 -0.960 -0.782
149 HG22 VAL 24 1HG2 VAL 24 -11.186 0.642 -0.070
150 HG23 VAL 24 2HG2 VAL 24 -12.516 0.329 -1.185
151 H TYR 25 H TYR 25 -10.211 -0.516 -5.302
152 HA TYR 25 HA TYR 25 -7.537 -0.507 -6.113
153 HB2 TYR 25 1HB TYR 25 -9.375 -0.953 -7.660
154 HB3 TYR 25 2HB TYR 25 -9.945 0.704 -7.489
155 HD1 TYR 25 HD2 TYR 25 -7.173 -1.382 -8.777
156 HD2 TYR 25 HD1 TYR 25 -9.005 2.458 -8.774
157 HE1 TYR 25 HE2 TYR 25 -5.736 -0.702 -10.654
158 HE2 TYR 25 HE1 TYR 25 -7.574 3.149 -10.652
159 HH TYR 25 HH TYR 25 -5.931 2.571 -12.025
160 H SER 26 H SER 26 -9.653 2.103 -5.108
161 HA SER 26 HA SER 26 -8.120 4.276 -5.998
162 HB2 SER 26 1HB SER 26 -10.523 4.137 -4.897
163 HB3 SER 26 2HB SER 26 -9.621 4.468 -3.419
164 HG SER 26 HG SER 26 -10.432 6.220 -5.150
165 H SER 27 H SER 27 -8.030 2.450 -2.967
166 HA SER 27 HA SER 27 -6.131 4.048 -1.645
167 HB2 SER 27 1HB SER 27 -7.651 2.039 -0.816
168 HB3 SER 27 2HB SER 27 -6.197 1.101 -1.156
169 HG SER 27 HG SER 27 -5.160 2.092 0.432
170 H LEU 28 H LEU 28 -5.824 1.728 -4.172
171 HA LEU 28 HA LEU 28 -3.019 1.218 -3.746
172 HB2 LEU 28 1HB LEU 28 -4.256 -0.538 -4.736
173 HB3 LEU 28 2HB LEU 28 -4.947 0.537 -5.949
174 HG LEU 28 HG LEU 28 -2.658 0.759 -6.937
175 HD11 LEU 28 1HD1 LEU 28 -0.849 -0.233 -6.073
176 HD12 LEU 28 2HD1 LEU 28 -1.727 -1.710 -5.678
177 HD13 LEU 28 3HD1 LEU 28 -1.796 -0.326 -4.588
178 HD21 LEU 28 3HD2 LEU 28 -2.688 -1.826 -7.609
179 HD22 LEU 28 1HD2 LEU 28 -3.861 -0.662 -8.227
180 HD23 LEU 28 2HD2 LEU 28 -4.288 -1.709 -6.873
181 H THR 29 H THR 29 -4.979 3.159 -5.964
182 HA THR 29 HA THR 29 -2.736 4.146 -7.439
183 HB THR 29 HB THR 29 -5.162 4.009 -8.251
184 HG1 THR 29 HG1 THR 29 -4.230 5.165 -9.749
185 HG21 THR 29 3HG2 THR 29 -6.725 5.262 -7.278
186 HG22 THR 29 1HG2 THR 29 -5.782 6.722 -7.570
187 HG23 THR 29 2HG2 THR 29 -5.530 5.790 -6.094
188 H THR 30 H THR 30 -4.285 5.020 -4.493
189 HA THR 30 HA THR 30 -3.360 7.749 -4.472
190 HB THR 30 HB THR 30 -4.461 6.091 -2.194
191 HG1 THR 30 HG1 THR 30 -5.714 7.847 -4.055
192 HG21 THR 30 3HG2 THR 30 -4.689 8.067 -0.970
193 HG22 THR 30 1HG2 THR 30 -4.486 9.086 -2.395
194 HG23 THR 30 2HG2 THR 30 -3.100 8.232 -1.717
195 H HIS 31 H HIS 31 -2.307 4.661 -3.171
196 HA HIS 31 HA HIS 31 -0.179 5.853 -1.617
197 HB2 HIS 31 1HB HIS 31 -0.893 3.943 -0.550
198 HB3 HIS 31 2HB HIS 31 -1.217 3.092 -2.058
199 HD1 HIS 31 HD1 HIS 31 1.629 4.015 0.235
200 HD2 HIS 31 HD2 HIS 31 0.837 1.504 -2.979
201 HE1 HIS 31 HE1 HIS 31 3.641 2.518 0.039
202 H GLN 32 H GLN 32 -0.404 3.744 -4.476
203 HA GLN 32 HA GLN 32 2.240 3.412 -5.084
204 HB2 GLN 32 1HB GLN 32 -0.133 3.813 -6.895
205 HB3 GLN 32 2HB GLN 32 1.467 3.446 -7.524
206 HG2 GLN 32 1HG GLN 32 0.361 1.684 -5.408
207 HG3 GLN 32 2HG GLN 32 -0.309 1.561 -7.034
208 HE21 GLN 32 1HE2 GLN 32 0.562 -0.057 -8.092
209 HE22 GLN 32 2HE2 GLN 32 2.222 -0.534 -8.049
210 H VAL 33 H VAL 33 0.455 6.338 -5.119
211 HA VAL 33 HA VAL 33 1.783 7.868 -7.013
212 HB VAL 33 HB VAL 33 -0.220 8.579 -5.675
213 HG11 VAL 33 1HG1 VAL 33 -0.027 9.429 -3.505
214 HG12 VAL 33 2HG1 VAL 33 0.936 7.950 -3.474
215 HG13 VAL 33 3HG1 VAL 33 1.732 9.520 -3.599
216 HG21 VAL 33 3HG2 VAL 33 1.951 10.132 -6.671
217 HG22 VAL 33 1HG2 VAL 33 0.235 10.536 -6.617
218 HG23 VAL 33 2HG2 VAL 33 1.281 10.941 -5.255
219 H ILE 34 H ILE 34 2.973 6.550 -4.097
220 HA ILE 34 HA ILE 34 5.076 8.477 -3.698
221 HB ILE 34 HB ILE 34 5.880 7.023 -1.952
222 HG12 ILE 34 1HG1 ILE 34 3.759 4.987 -2.493
223 HG13 ILE 34 2HG1 ILE 34 5.240 4.932 -3.442
224 HG21 ILE 34 1HG2 ILE 34 3.559 6.620 -0.767
225 HG22 ILE 34 2HG2 ILE 34 4.180 8.247 -1.040
226 HG23 ILE 34 3HG2 ILE 34 2.963 7.575 -2.125
227 HD11 ILE 34 3HD1 ILE 34 4.933 3.619 -1.151
228 HD12 ILE 34 1HD1 ILE 34 6.491 4.241 -1.696
229 HD13 ILE 34 2HD1 ILE 34 5.545 5.145 -0.514
230 H HIS 35 H HIS 35 4.630 5.579 -5.522
231 HA HIS 35 HA HIS 35 7.503 5.273 -5.972
232 HB2 HIS 35 1HB HIS 35 5.201 3.569 -6.946
233 HB3 HIS 35 2HB HIS 35 6.913 3.191 -7.119
234 HD1 HIS 35 HD1 HIS 35 8.164 3.187 -4.576
235 HD2 HIS 35 HD2 HIS 35 4.120 2.275 -4.848
236 HE1 HIS 35 HE1 HIS 35 7.614 1.933 -2.467
237 H THR 36 H THR 36 4.558 6.231 -7.597
238 HA THR 36 HA THR 36 6.153 6.911 -9.982
239 HB THR 36 HB THR 36 4.603 5.184 -10.604
240 HG1 THR 36 HG1 THR 36 4.748 7.394 -11.809
241 HG21 THR 36 3HG2 THR 36 2.052 6.230 -10.320
242 HG22 THR 36 1HG2 THR 36 2.835 6.599 -8.784
243 HG23 THR 36 2HG2 THR 36 2.762 4.933 -9.358
244 H GLY 37 H GLY 37 6.586 8.964 -8.926
245 HA2 GLY 37 1HA GLY 37 4.259 10.785 -9.015
246 HA3 GLY 37 2HA GLY 37 5.606 10.984 -7.903
247 H GLU 38 H GLU 38 6.089 13.062 -8.608
248 HA GLU 38 HA GLU 38 7.831 13.200 -10.867
249 HB2 GLU 38 1HB GLU 38 5.684 13.368 -12.038
250 HB3 GLU 38 2HB GLU 38 5.217 14.712 -11.006
251 HG2 GLU 38 1HG GLU 38 7.205 15.956 -11.898
252 HG3 GLU 38 2HG GLU 38 7.399 14.653 -13.069
253 H LYS 39 H LYS 39 9.024 15.150 -10.952
254 HA LYS 39 HA LYS 39 8.499 17.181 -8.939
255 HB2 LYS 39 1HB LYS 39 10.629 16.999 -7.852
256 HB3 LYS 39 2HB LYS 39 9.865 15.416 -7.808
257 HG2 LYS 39 1HG LYS 39 11.954 14.796 -8.432
258 HG3 LYS 39 2HG LYS 39 11.261 15.083 -10.030
259 HD2 LYS 39 1HD LYS 39 12.136 17.501 -9.703
260 HD3 LYS 39 2HD LYS 39 13.158 16.785 -8.455
261 HE2 LYS 39 1HE LYS 39 13.029 15.764 -11.285
262 HE3 LYS 39 2HE LYS 39 14.197 16.968 -10.742
263 HZ1 LYS 39 3HZ LYS 39 15.096 15.400 -9.187
264 HZ2 LYS 39 1HZ LYS 39 15.072 14.684 -10.719
265 HZ3 LYS 39 2HZ LYS 39 13.910 14.256 -9.568
266 HA PRO 40 HA PRO 40 10.079 19.776 -12.123
267 HB2 PRO 40 1HB PRO 40 10.681 21.968 -10.638
268 HB3 PRO 40 2HB PRO 40 9.023 21.502 -11.035
269 HG2 PRO 40 1HG PRO 40 10.570 21.034 -8.515
270 HG3 PRO 40 2HG PRO 40 8.885 21.551 -8.714
271 HD2 PRO 40 1HD PRO 40 9.565 18.996 -8.132
272 HD3 PRO 40 2HD PRO 40 8.141 19.406 -9.110
273 H SER 41 H SER 41 11.985 19.856 -9.105
274 HA SER 41 HA SER 41 14.399 19.236 -10.581
275 HB2 SER 41 1HB SER 41 13.977 21.893 -9.216
276 HB3 SER 41 2HB SER 41 15.587 21.235 -9.507
277 HG SER 41 HG SER 41 13.648 21.583 -11.546
278 H GLY 42 H GLY 42 16.322 19.151 -9.012
279 HA2 GLY 42 1HA GLY 42 16.848 19.000 -6.574
280 HA3 GLY 42 2HA GLY 42 15.356 18.081 -6.432
281 HA PRO 43 HA PRO 43 19.136 15.327 -7.252
282 HB2 PRO 43 1HB PRO 43 19.334 14.225 -4.779
283 HB3 PRO 43 2HB PRO 43 20.197 15.694 -5.247
284 HG2 PRO 43 1HG PRO 43 17.652 15.405 -3.698
285 HG3 PRO 43 2HG PRO 43 19.028 16.482 -3.398
286 HD2 PRO 43 1HD PRO 43 16.747 17.327 -4.589
287 HD3 PRO 43 2HD PRO 43 18.339 18.008 -4.982
288 H SER 44 H SER 44 19.115 12.987 -7.248
289 HA SER 44 HA SER 44 16.386 11.941 -7.302
290 HB2 SER 44 1HB SER 44 18.134 11.717 -9.225
291 HB3 SER 44 2HB SER 44 18.797 10.414 -8.239
292 HG SER 44 HG SER 44 16.626 9.520 -8.253
293 H SER 45 H SER 45 16.164 11.761 -5.008
294 HA SER 45 HA SER 45 17.618 9.455 -3.886
295 HB2 SER 45 1HB SER 45 18.070 11.816 -2.894
296 HB3 SER 45 2HB SER 45 16.476 11.637 -2.161
297 HG SER 45 HG SER 45 18.571 9.744 -1.888
298 H GLY 46 H GLY 46 16.443 8.090 -2.453
299 HA2 GLY 46 1HA GLY 46 13.555 8.116 -3.014
300 HA3 GLY 46 2HA GLY 46 14.492 6.703 -2.554
Start of MODEL 10
1 H1 GLY 1 H GLY 1 -1.703 2.948 13.046
2 HA2 GLY 1 1HA GLY 1 -1.500 0.387 14.348
3 HA3 GLY 1 2HA GLY 1 -2.931 1.291 14.823
4 H SER 2 H SER 2 -1.593 -0.808 12.549
5 HA SER 2 HA SER 2 -4.031 -0.644 10.939
6 HB2 SER 2 1HB SER 2 -2.153 0.673 9.835
7 HB3 SER 2 2HB SER 2 -1.317 -0.866 9.631
8 HG SER 2 HG SER 2 -2.460 -1.002 7.874
9 H SER 3 H SER 3 -3.925 -2.549 9.245
10 HA SER 3 HA SER 3 -4.093 -4.802 8.968
11 HB2 SER 3 1HB SER 3 -1.514 -4.926 10.544
12 HB3 SER 3 2HB SER 3 -2.111 -6.112 9.384
13 HG SER 3 HG SER 3 -0.686 -4.896 8.260
14 H GLY 4 H GLY 4 -5.646 -3.883 11.011
15 HA2 GLY 4 1HA GLY 4 -5.441 -4.803 13.551
16 HA3 GLY 4 2HA GLY 4 -6.958 -4.824 12.664
17 H SER 5 H SER 5 -6.623 -6.765 10.822
18 HA SER 5 HA SER 5 -6.674 -9.141 12.473
19 HB2 SER 5 1HB SER 5 -7.254 -8.696 9.537
20 HB3 SER 5 2HB SER 5 -7.396 -10.259 10.341
21 HG SER 5 HG SER 5 -8.706 -8.098 11.511
22 H SER 6 H SER 6 -5.180 -10.714 12.550
23 HA SER 6 HA SER 6 -2.697 -10.280 11.067
24 HB2 SER 6 1HB SER 6 -3.421 -11.690 13.596
25 HB3 SER 6 2HB SER 6 -2.012 -12.260 12.703
26 HG SER 6 HG SER 6 -1.839 -10.447 14.374
27 H GLY 7 H GLY 7 -4.790 -11.221 9.509
28 HA2 GLY 7 1HA GLY 7 -3.616 -13.521 8.341
29 HA3 GLY 7 2HA GLY 7 -5.049 -13.978 9.250
30 H THR 8 H THR 8 -4.520 -10.995 7.429
31 HA THR 8 HA THR 8 -7.022 -10.948 6.234
32 HB THR 8 HB THR 8 -4.546 -9.795 4.951
33 HG1 THR 8 HG1 THR 8 -5.408 -7.903 6.337
34 HG21 THR 8 3HG2 THR 8 -7.392 -8.792 5.025
35 HG22 THR 8 1HG2 THR 8 -6.686 -9.697 3.687
36 HG23 THR 8 2HG2 THR 8 -6.050 -8.107 4.108
37 H GLY 9 H GLY 9 -7.866 -11.654 4.308
38 HA2 GLY 9 1HA GLY 9 -6.786 -14.024 3.194
39 HA3 GLY 9 2HA GLY 9 -8.151 -13.117 2.559
40 H VAL 10 H VAL 10 -7.667 -13.118 0.422
41 HA VAL 10 HA VAL 10 -5.081 -11.938 -0.361
42 HB VAL 10 HB VAL 10 -5.391 -14.271 -1.125
43 HG11 VAL 10 1HG1 VAL 10 -7.878 -14.097 -1.355
44 HG12 VAL 10 2HG1 VAL 10 -7.615 -13.198 -2.850
45 HG13 VAL 10 3HG1 VAL 10 -7.065 -14.869 -2.716
46 HG21 VAL 10 3HG2 VAL 10 -4.058 -12.574 -2.399
47 HG22 VAL 10 1HG2 VAL 10 -4.669 -13.913 -3.371
48 HG23 VAL 10 2HG2 VAL 10 -5.464 -12.340 -3.438
49 H LYS 11 H LYS 11 -5.066 -10.156 -1.613
50 HA LYS 11 HA LYS 11 -7.646 -9.199 -2.665
51 HB2 LYS 11 1HB LYS 11 -5.464 -7.600 -1.319
52 HB3 LYS 11 2HB LYS 11 -6.808 -6.878 -2.194
53 HG2 LYS 11 1HG LYS 11 -8.387 -7.816 -0.634
54 HG3 LYS 11 2HG LYS 11 -7.095 -8.685 0.198
55 HD2 LYS 11 1HD LYS 11 -6.903 -5.721 -0.087
56 HD3 LYS 11 2HD LYS 11 -7.991 -6.398 1.126
57 HE2 LYS 11 1HE LYS 11 -6.023 -7.769 1.931
58 HE3 LYS 11 2HE LYS 11 -5.013 -6.768 0.889
59 HZ1 LYS 11 3HZ LYS 11 -6.268 -6.123 3.415
60 HZ2 LYS 11 1HZ LYS 11 -6.388 -4.913 2.238
61 HZ3 LYS 11 2HZ LYS 11 -4.868 -5.489 2.707
62 HA PRO 12 HA PRO 12 -5.604 -8.923 -6.556
63 HB2 PRO 12 1HB PRO 12 -7.234 -7.120 -7.767
64 HB3 PRO 12 2HB PRO 12 -7.704 -8.799 -7.480
65 HG2 PRO 12 1HG PRO 12 -8.393 -6.344 -5.911
66 HG3 PRO 12 2HG PRO 12 -9.435 -7.700 -6.382
67 HD2 PRO 12 1HD PRO 12 -8.370 -7.473 -3.902
68 HD3 PRO 12 2HD PRO 12 -8.671 -9.045 -4.672
69 H TYR 13 H TYR 13 -6.476 -5.906 -4.909
70 HA TYR 13 HA TYR 13 -4.581 -4.342 -6.406
71 HB2 TYR 13 1HB TYR 13 -5.819 -3.441 -3.825
72 HB3 TYR 13 2HB TYR 13 -5.395 -2.489 -5.244
73 HD1 TYR 13 HD1 TYR 13 -6.738 -3.180 -7.440
74 HD2 TYR 13 HD2 TYR 13 -8.052 -3.882 -3.454
75 HE1 TYR 13 HE1 TYR 13 -9.060 -3.327 -8.237
76 HE2 TYR 13 HE2 TYR 13 -10.377 -4.033 -4.241
77 HH TYR 13 HH TYR 13 -11.585 -2.917 -6.631
78 H MET 14 H MET 14 -2.586 -5.344 -6.043
79 HA MET 14 HA MET 14 -1.480 -4.880 -3.355
80 HB2 MET 14 1HB MET 14 -1.815 -7.278 -3.655
81 HB3 MET 14 2HB MET 14 -0.921 -7.234 -5.168
82 HG2 MET 14 1HG MET 14 1.111 -6.680 -4.013
83 HG3 MET 14 2HG MET 14 0.245 -6.539 -2.485
84 HE1 MET 14 3HE MET 14 1.148 -8.469 -0.835
85 HE2 MET 14 1HE MET 14 -0.590 -8.314 -1.090
86 HE3 MET 14 2HE MET 14 0.155 -9.912 -1.042
87 H CYS 15 H CYS 15 -0.169 -3.185 -3.598
88 HA CYS 15 HA CYS 15 1.017 -2.263 -5.911
89 HB2 CYS 15 1HB CYS 15 0.955 -0.849 -3.986
90 HB3 CYS 15 2HB CYS 15 1.890 -1.997 -3.034
91 H ASN 16 H ASN 16 3.052 -2.460 -6.850
92 HA ASN 16 HA ASN 16 4.460 -4.949 -6.172
93 HB2 ASN 16 1HB ASN 16 3.682 -4.989 -8.431
94 HB3 ASN 16 2HB ASN 16 4.294 -3.366 -8.738
95 HD21 ASN 16 1HD2 ASN 16 6.470 -3.058 -9.118
96 HD22 ASN 16 2HD2 ASN 16 7.547 -4.365 -9.459
97 H GLU 17 H GLU 17 4.821 -1.508 -6.481
98 HA GLU 17 HA GLU 17 7.568 -1.232 -6.699
99 HB2 GLU 17 1HB GLU 17 5.491 0.440 -5.303
100 HB3 GLU 17 2HB GLU 17 7.184 0.910 -5.328
101 HG2 GLU 17 1HG GLU 17 5.696 1.941 -7.085
102 HG3 GLU 17 2HG GLU 17 7.188 1.195 -7.654
103 H CYS 18 H CYS 18 5.656 -1.324 -3.689
104 HA CYS 18 HA CYS 18 8.121 -2.005 -2.236
105 HB2 CYS 18 1HB CYS 18 6.923 -1.273 -0.209
106 HB3 CYS 18 2HB CYS 18 7.003 0.004 -1.418
107 H GLY 19 H GLY 19 4.685 -2.871 -2.513
108 HA2 GLY 19 1HA GLY 19 4.226 -5.291 -2.732
109 HA3 GLY 19 2HA GLY 19 5.388 -5.533 -1.436
110 H LYS 20 H LYS 20 2.789 -3.136 -1.706
111 HA LYS 20 HA LYS 20 1.737 -4.119 0.853
112 HB2 LYS 20 1HB LYS 20 1.798 -1.465 -0.491
113 HB3 LYS 20 2HB LYS 20 0.412 -1.821 0.531
114 HG2 LYS 20 1HG LYS 20 2.215 -2.505 2.276
115 HG3 LYS 20 2HG LYS 20 3.285 -1.523 1.274
116 HD2 LYS 20 1HD LYS 20 2.028 0.427 1.652
117 HD3 LYS 20 2HD LYS 20 0.645 -0.484 2.262
118 HE2 LYS 20 1HE LYS 20 1.976 -1.156 4.218
119 HE3 LYS 20 2HE LYS 20 3.329 -0.204 3.611
120 HZ1 LYS 20 3HZ LYS 20 2.210 1.105 5.211
121 HZ2 LYS 20 1HZ LYS 20 0.693 0.792 4.531
122 HZ3 LYS 20 2HZ LYS 20 1.807 1.758 3.703
123 H ALA 21 H ALA 21 -0.642 -4.028 1.135
124 HA ALA 21 HA ALA 21 -2.045 -4.714 -1.366
125 HB1 ALA 21 3HB ALA 21 -1.530 -6.423 0.746
126 HB2 ALA 21 1HB ALA 21 -3.203 -5.926 1.000
127 HB3 ALA 21 2HB ALA 21 -2.724 -6.663 -0.529
128 H PHE 22 H PHE 22 -4.293 -4.217 -1.456
129 HA PHE 22 HA PHE 22 -5.354 -2.465 0.623
130 HB2 PHE 22 1HB PHE 22 -5.320 -1.615 -2.278
131 HB3 PHE 22 2HB PHE 22 -5.913 -0.686 -0.905
132 HD1 PHE 22 HD2 PHE 22 -2.798 -2.329 -2.126
133 HD2 PHE 22 HD1 PHE 22 -4.539 0.900 0.032
134 HE1 PHE 22 HE2 PHE 22 -0.574 -1.312 -1.860
135 HE2 PHE 22 HE1 PHE 22 -2.318 1.923 0.301
136 HZ PHE 22 HZ PHE 22 -0.331 0.816 -0.644
137 H SER 23 H SER 23 -7.614 -2.306 0.643
138 HA SER 23 HA SER 23 -8.952 -4.555 -0.589
139 HB2 SER 23 1HB SER 23 -10.793 -4.052 0.852
140 HB3 SER 23 2HB SER 23 -9.328 -3.812 1.804
141 HG SER 23 HG SER 23 -10.370 -1.983 2.191
142 H VAL 24 H VAL 24 -8.753 -1.106 -1.005
143 HA VAL 24 HA VAL 24 -10.862 -1.214 -3.056
144 HB VAL 24 HB VAL 24 -9.677 1.249 -1.771
145 HG11 VAL 24 1HG1 VAL 24 -12.081 0.834 -3.543
146 HG12 VAL 24 2HG1 VAL 24 -11.689 2.344 -2.719
147 HG13 VAL 24 3HG1 VAL 24 -10.600 1.702 -3.949
148 HG21 VAL 24 3HG2 VAL 24 -11.470 1.332 -0.279
149 HG22 VAL 24 1HG2 VAL 24 -12.403 0.145 -1.189
150 HG23 VAL 24 2HG2 VAL 24 -10.992 -0.366 -0.262
151 H TYR 25 H TYR 25 -10.495 -0.328 -5.107
152 HA TYR 25 HA TYR 25 -7.922 -0.753 -6.176
153 HB2 TYR 25 1HB TYR 25 -10.284 -0.763 -7.315
154 HB3 TYR 25 2HB TYR 25 -9.948 0.943 -7.589
155 HD1 TYR 25 HD1 TYR 25 -7.142 1.028 -8.249
156 HD2 TYR 25 HD2 TYR 25 -10.058 -1.876 -9.329
157 HE1 TYR 25 HE1 TYR 25 -5.821 0.452 -10.241
158 HE2 TYR 25 HE2 TYR 25 -8.744 -2.461 -11.324
159 HH TYR 25 HH TYR 25 -6.159 -0.561 -12.445
160 H SER 26 H SER 26 -9.751 2.260 -5.658
161 HA SER 26 HA SER 26 -7.859 4.065 -6.557
162 HB2 SER 26 1HB SER 26 -10.084 4.208 -4.570
163 HB3 SER 26 2HB SER 26 -8.947 5.555 -4.650
164 HG SER 26 HG SER 26 -10.996 5.100 -6.229
165 H SER 27 H SER 27 -8.234 2.702 -3.302
166 HA SER 27 HA SER 27 -6.330 4.106 -1.919
167 HB2 SER 27 1HB SER 27 -7.897 2.103 -1.214
168 HB3 SER 27 2HB SER 27 -6.451 1.141 -1.521
169 HG SER 27 HG SER 27 -6.515 1.816 0.640
170 H LEU 28 H LEU 28 -5.832 1.348 -4.075
171 HA LEU 28 HA LEU 28 -3.063 1.055 -3.590
172 HB2 LEU 28 1HB LEU 28 -4.169 -0.769 -4.573
173 HB3 LEU 28 2HB LEU 28 -4.869 0.234 -5.841
174 HG LEU 28 HG LEU 28 -2.662 0.463 -6.877
175 HD11 LEU 28 1HD1 LEU 28 -0.983 -1.349 -5.921
176 HD12 LEU 28 2HD1 LEU 28 -1.825 -0.971 -4.418
177 HD13 LEU 28 3HD1 LEU 28 -1.012 0.309 -5.320
178 HD21 LEU 28 3HD2 LEU 28 -2.536 -1.720 -7.797
179 HD22 LEU 28 1HD2 LEU 28 -4.233 -1.430 -7.412
180 HD23 LEU 28 2HD2 LEU 28 -3.249 -2.443 -6.355
181 H THR 29 H THR 29 -4.872 2.792 -6.101
182 HA THR 29 HA THR 29 -2.653 3.709 -7.558
183 HB THR 29 HB THR 29 -4.126 5.279 -8.610
184 HG1 THR 29 HG1 THR 29 -5.488 6.285 -7.348
185 HG21 THR 29 3HG2 THR 29 -6.284 3.428 -8.305
186 HG22 THR 29 1HG2 THR 29 -4.761 2.540 -8.318
187 HG23 THR 29 2HG2 THR 29 -5.168 3.612 -9.658
188 H THR 30 H THR 30 -4.588 5.363 -5.063
189 HA THR 30 HA THR 30 -3.135 7.739 -4.980
190 HB THR 30 HB THR 30 -4.408 6.489 -2.549
191 HG1 THR 30 HG1 THR 30 -5.664 7.892 -4.692
192 HG21 THR 30 3HG2 THR 30 -3.063 8.727 -2.569
193 HG22 THR 30 1HG2 THR 30 -4.608 8.642 -1.724
194 HG23 THR 30 2HG2 THR 30 -4.518 9.375 -3.326
195 H HIS 31 H HIS 31 -2.408 4.607 -3.675
196 HA HIS 31 HA HIS 31 -0.393 5.535 -1.844
197 HB2 HIS 31 1HB HIS 31 -1.242 3.522 -1.112
198 HB3 HIS 31 2HB HIS 31 -1.410 2.877 -2.742
199 HD1 HIS 31 HD1 HIS 31 1.121 3.350 -0.008
200 HD2 HIS 31 HD2 HIS 31 0.779 1.464 -3.694
201 HE1 HIS 31 HE1 HIS 31 3.145 1.869 -0.196
202 H GLN 32 H GLN 32 -0.371 3.846 -4.975
203 HA GLN 32 HA GLN 32 2.294 3.477 -5.385
204 HB2 GLN 32 1HB GLN 32 0.068 4.203 -7.251
205 HB3 GLN 32 2HB GLN 32 1.714 4.101 -7.864
206 HG2 GLN 32 1HG GLN 32 1.878 1.815 -7.343
207 HG3 GLN 32 2HG GLN 32 0.435 1.862 -6.331
208 HE21 GLN 32 1HE2 GLN 32 0.027 -0.042 -7.798
209 HE22 GLN 32 2HE2 GLN 32 -0.833 0.277 -9.262
210 H VAL 33 H VAL 33 0.650 6.480 -5.123
211 HA VAL 33 HA VAL 33 2.235 8.215 -6.583
212 HB VAL 33 HB VAL 33 0.779 8.592 -3.978
213 HG11 VAL 33 1HG1 VAL 33 2.620 10.458 -5.384
214 HG12 VAL 33 2HG1 VAL 33 1.152 11.113 -4.656
215 HG13 VAL 33 3HG1 VAL 33 2.324 10.250 -3.659
216 HG21 VAL 33 3HG2 VAL 33 -0.900 8.644 -5.467
217 HG22 VAL 33 1HG2 VAL 33 -0.314 10.268 -5.827
218 HG23 VAL 33 2HG2 VAL 33 0.186 8.907 -6.831
219 H ILE 34 H ILE 34 2.820 6.791 -3.415
220 HA ILE 34 HA ILE 34 5.032 8.347 -2.669
221 HB ILE 34 HB ILE 34 5.571 6.621 -1.082
222 HG12 ILE 34 1HG1 ILE 34 3.487 4.767 -2.143
223 HG13 ILE 34 2HG1 ILE 34 5.048 4.809 -2.954
224 HG21 ILE 34 1HG2 ILE 34 3.842 7.507 0.010
225 HG22 ILE 34 2HG2 ILE 34 2.866 7.600 -1.456
226 HG23 ILE 34 3HG2 ILE 34 2.914 6.105 -0.522
227 HD11 ILE 34 3HD1 ILE 34 5.904 4.571 -0.451
228 HD12 ILE 34 1HD1 ILE 34 4.325 3.807 -0.272
229 HD13 ILE 34 2HD1 ILE 34 5.480 3.181 -1.450
230 H HIS 35 H HIS 35 4.718 6.242 -5.240
231 HA HIS 35 HA HIS 35 7.620 5.740 -5.332
232 HB2 HIS 35 1HB HIS 35 5.410 4.239 -6.753
233 HB3 HIS 35 2HB HIS 35 7.129 3.864 -6.833
234 HD1 HIS 35 HD1 HIS 35 8.130 3.519 -4.177
235 HD2 HIS 35 HD2 HIS 35 4.167 2.598 -5.021
236 HE1 HIS 35 HE1 HIS 35 7.399 1.954 -2.349
237 H THR 36 H THR 36 4.939 7.255 -6.865
238 HA THR 36 HA THR 36 6.107 7.544 -9.457
239 HB THR 36 HB THR 36 4.314 9.158 -9.891
240 HG1 THR 36 HG1 THR 36 2.787 9.485 -8.097
241 HG21 THR 36 3HG2 THR 36 3.997 6.539 -9.647
242 HG22 THR 36 1HG2 THR 36 2.632 7.605 -9.975
243 HG23 THR 36 2HG2 THR 36 2.930 7.033 -8.333
244 H GLY 37 H GLY 37 8.219 8.341 -8.946
245 HA2 GLY 37 1HA GLY 37 8.841 10.871 -9.457
246 HA3 GLY 37 2HA GLY 37 8.401 10.999 -7.761
247 H GLU 38 H GLU 38 9.517 9.252 -6.353
248 HA GLU 38 HA GLU 38 12.291 9.717 -6.479
249 HB2 GLU 38 1HB GLU 38 10.567 7.875 -4.851
250 HB3 GLU 38 2HB GLU 38 12.319 7.801 -4.729
251 HG2 GLU 38 1HG GLU 38 10.878 10.397 -4.389
252 HG3 GLU 38 2HG GLU 38 11.002 9.249 -3.057
253 H LYS 39 H LYS 39 13.991 8.480 -7.151
254 HA LYS 39 HA LYS 39 13.738 6.830 -9.341
255 HB2 LYS 39 1HB LYS 39 15.839 7.940 -8.316
256 HB3 LYS 39 2HB LYS 39 15.979 6.464 -7.370
257 HG2 LYS 39 1HG LYS 39 17.371 6.162 -9.235
258 HG3 LYS 39 2HG LYS 39 15.922 5.211 -9.568
259 HD2 LYS 39 1HD LYS 39 15.087 6.867 -11.066
260 HD3 LYS 39 2HD LYS 39 16.331 8.020 -10.579
261 HE2 LYS 39 1HE LYS 39 17.071 7.188 -12.639
262 HE3 LYS 39 2HE LYS 39 18.012 6.303 -11.440
263 HZ1 LYS 39 3HZ LYS 39 17.150 4.857 -13.191
264 HZ2 LYS 39 1HZ LYS 39 15.565 5.283 -12.778
265 HZ3 LYS 39 2HZ LYS 39 16.527 4.432 -11.676
266 HA PRO 40 HA PRO 40 12.158 3.045 -7.689
267 HB2 PRO 40 1HB PRO 40 12.645 1.485 -9.857
268 HB3 PRO 40 2HB PRO 40 11.327 2.661 -9.797
269 HG2 PRO 40 1HG PRO 40 14.033 2.911 -11.052
270 HG3 PRO 40 2HG PRO 40 12.455 3.413 -11.686
271 HD2 PRO 40 1HD PRO 40 14.191 5.155 -10.554
272 HD3 PRO 40 2HD PRO 40 12.431 5.352 -10.441
273 H SER 41 H SER 41 15.337 3.806 -8.084
274 HA SER 41 HA SER 41 16.928 1.679 -8.279
275 HB2 SER 41 1HB SER 41 17.079 3.617 -5.958
276 HB3 SER 41 2HB SER 41 18.406 2.636 -6.579
277 HG SER 41 HG SER 41 17.244 4.935 -7.624
278 H GLY 42 H GLY 42 16.822 -0.348 -7.592
279 HA2 GLY 42 1HA GLY 42 17.074 -1.766 -5.578
280 HA3 GLY 42 2HA GLY 42 15.750 -0.843 -4.881
281 HA PRO 43 HA PRO 43 13.984 -3.774 -8.343
282 HB2 PRO 43 1HB PRO 43 15.540 -5.935 -8.873
283 HB3 PRO 43 2HB PRO 43 15.655 -4.423 -9.781
284 HG2 PRO 43 1HG PRO 43 17.373 -5.422 -7.543
285 HG3 PRO 43 2HG PRO 43 17.854 -4.625 -9.052
286 HD2 PRO 43 1HD PRO 43 17.706 -3.307 -6.691
287 HD3 PRO 43 2HD PRO 43 17.360 -2.523 -8.246
288 H SER 44 H SER 44 16.083 -5.290 -5.902
289 HA SER 44 HA SER 44 14.231 -7.404 -5.352
290 HB2 SER 44 1HB SER 44 16.769 -7.457 -5.015
291 HB3 SER 44 2HB SER 44 16.483 -6.525 -3.545
292 HG SER 44 HG SER 44 14.844 -8.378 -3.208
293 H SER 45 H SER 45 12.592 -7.451 -3.949
294 HA SER 45 HA SER 45 11.852 -5.032 -2.573
295 HB2 SER 45 1HB SER 45 10.200 -6.538 -3.714
296 HB3 SER 45 2HB SER 45 10.502 -7.739 -2.458
297 HG SER 45 HG SER 45 8.658 -6.247 -2.152
298 H GLY 46 H GLY 46 14.253 -5.915 -1.561
299 HA2 GLY 46 1HA GLY 46 13.460 -6.683 1.173
300 HA3 GLY 46 2HA GLY 46 14.823 -7.469 0.391
Start of MODEL 11
1 H1 GLY 1 H GLY 1 9.740 -25.547 9.985
2 HA2 GLY 1 1HA GLY 1 9.373 -23.293 10.217
3 HA3 GLY 1 2HA GLY 1 10.485 -23.108 8.868
4 H SER 2 H SER 2 7.160 -24.339 9.272
5 HA SER 2 HA SER 2 6.370 -22.604 7.024
6 HB2 SER 2 1HB SER 2 5.161 -25.263 7.820
7 HB3 SER 2 2HB SER 2 4.663 -24.265 6.455
8 HG SER 2 HG SER 2 6.631 -24.647 5.482
9 H SER 3 H SER 3 5.592 -20.856 8.106
10 HA SER 3 HA SER 3 3.249 -21.330 9.820
11 HB2 SER 3 1HB SER 3 3.926 -19.661 11.380
12 HB3 SER 3 2HB SER 3 5.335 -20.691 11.128
13 HG SER 3 HG SER 3 6.076 -18.636 10.948
14 H GLY 4 H GLY 4 1.597 -19.796 9.689
15 HA2 GLY 4 1HA GLY 4 0.223 -18.344 8.558
16 HA3 GLY 4 2HA GLY 4 1.654 -17.331 8.439
17 H SER 5 H SER 5 2.587 -17.033 6.496
18 HA SER 5 HA SER 5 2.614 -16.911 4.207
19 HB2 SER 5 1HB SER 5 3.304 -18.973 3.142
20 HB3 SER 5 2HB SER 5 4.053 -18.884 4.736
21 HG SER 5 HG SER 5 3.194 -20.933 4.448
22 H SER 6 H SER 6 0.020 -16.657 5.140
23 HA SER 6 HA SER 6 -1.498 -18.029 3.021
24 HB2 SER 6 1HB SER 6 -1.900 -18.737 5.519
25 HB3 SER 6 2HB SER 6 -2.827 -17.239 5.590
26 HG SER 6 HG SER 6 -3.289 -18.983 3.455
27 H GLY 7 H GLY 7 -1.477 -15.239 5.233
28 HA2 GLY 7 1HA GLY 7 -1.757 -12.995 4.626
29 HA3 GLY 7 2HA GLY 7 -2.270 -13.515 3.027
30 H THR 8 H THR 8 -3.270 -12.349 6.028
31 HA THR 8 HA THR 8 -5.984 -13.343 5.868
32 HB THR 8 HB THR 8 -4.913 -12.974 8.065
33 HG1 THR 8 HG1 THR 8 -7.241 -11.499 7.388
34 HG21 THR 8 3HG2 THR 8 -3.566 -11.113 7.960
35 HG22 THR 8 1HG2 THR 8 -4.987 -10.433 8.751
36 HG23 THR 8 2HG2 THR 8 -4.736 -10.185 7.023
37 H GLY 9 H GLY 9 -5.218 -11.920 3.563
38 HA2 GLY 9 1HA GLY 9 -7.218 -9.787 3.647
39 HA3 GLY 9 2HA GLY 9 -5.596 -9.350 3.131
40 H VAL 10 H VAL 10 -5.017 -11.755 1.711
41 HA VAL 10 HA VAL 10 -5.056 -12.319 -0.519
42 HB VAL 10 HB VAL 10 -6.626 -13.912 0.447
43 HG11 VAL 10 1HG1 VAL 10 -8.226 -12.409 1.441
44 HG12 VAL 10 2HG1 VAL 10 -8.712 -11.817 -0.149
45 HG13 VAL 10 3HG1 VAL 10 -9.062 -13.482 0.318
46 HG21 VAL 10 3HG2 VAL 10 -7.386 -14.709 -1.551
47 HG22 VAL 10 1HG2 VAL 10 -8.000 -13.139 -2.069
48 HG23 VAL 10 2HG2 VAL 10 -6.271 -13.480 -2.146
49 H LYS 11 H LYS 11 -5.665 -9.456 0.091
50 HA LYS 11 HA LYS 11 -7.672 -8.489 -1.623
51 HB2 LYS 11 1HB LYS 11 -5.253 -7.303 -0.328
52 HB3 LYS 11 2HB LYS 11 -6.085 -6.381 -1.573
53 HG2 LYS 11 1HG LYS 11 -8.045 -6.224 -0.313
54 HG3 LYS 11 2HG LYS 11 -7.559 -7.531 0.769
55 HD2 LYS 11 1HD LYS 11 -5.845 -5.103 0.631
56 HD3 LYS 11 2HD LYS 11 -7.382 -4.993 1.492
57 HE2 LYS 11 1HE LYS 11 -6.739 -6.887 2.891
58 HE3 LYS 11 2HE LYS 11 -5.214 -7.025 2.017
59 HZ1 LYS 11 3HZ LYS 11 -5.413 -4.397 2.884
60 HZ2 LYS 11 1HZ LYS 11 -4.355 -5.590 3.446
61 HZ3 LYS 11 2HZ LYS 11 -5.850 -5.362 4.203
62 HA PRO 12 HA PRO 12 -5.847 -9.210 -5.585
63 HB2 PRO 12 1HB PRO 12 -7.498 -7.611 -7.030
64 HB3 PRO 12 2HB PRO 12 -7.996 -9.185 -6.399
65 HG2 PRO 12 1HG PRO 12 -8.520 -6.451 -5.298
66 HG3 PRO 12 2HG PRO 12 -9.625 -7.830 -5.441
67 HD2 PRO 12 1HD PRO 12 -8.406 -7.175 -3.114
68 HD3 PRO 12 2HD PRO 12 -8.795 -8.852 -3.548
69 H TYR 13 H TYR 13 -6.657 -5.859 -4.689
70 HA TYR 13 HA TYR 13 -4.739 -4.729 -6.490
71 HB2 TYR 13 1HB TYR 13 -5.878 -3.231 -4.156
72 HB3 TYR 13 2HB TYR 13 -5.495 -2.647 -5.771
73 HD1 TYR 13 HD1 TYR 13 -6.937 -3.749 -7.702
74 HD2 TYR 13 HD2 TYR 13 -8.096 -3.572 -3.611
75 HE1 TYR 13 HE1 TYR 13 -9.290 -4.024 -8.363
76 HE2 TYR 13 HE2 TYR 13 -10.452 -3.848 -4.261
77 HH TYR 13 HH TYR 13 -11.410 -4.848 -7.323
78 H MET 14 H MET 14 -2.689 -5.413 -6.058
79 HA MET 14 HA MET 14 -1.581 -4.612 -3.450
80 HB2 MET 14 1HB MET 14 -1.281 -7.178 -4.943
81 HB3 MET 14 2HB MET 14 0.094 -6.583 -4.022
82 HG2 MET 14 1HG MET 14 -1.012 -6.783 -1.996
83 HG3 MET 14 2HG MET 14 -2.602 -6.800 -2.754
84 HE1 MET 14 3HE MET 14 -1.244 -9.686 -0.592
85 HE2 MET 14 1HE MET 14 0.190 -9.957 -1.583
86 HE3 MET 14 2HE MET 14 -0.180 -8.337 -0.991
87 H CYS 15 H CYS 15 0.230 -3.408 -3.508
88 HA CYS 15 HA CYS 15 1.107 -2.341 -6.003
89 HB2 CYS 15 1HB CYS 15 1.138 -0.887 -4.108
90 HB3 CYS 15 2HB CYS 15 2.109 -2.021 -3.174
91 H ASN 16 H ASN 16 3.278 -2.395 -6.837
92 HA ASN 16 HA ASN 16 4.620 -4.955 -6.279
93 HB2 ASN 16 1HB ASN 16 4.531 -3.301 -8.809
94 HB3 ASN 16 2HB ASN 16 5.553 -4.719 -8.596
95 HD21 ASN 16 1HD2 ASN 16 4.132 -5.134 -10.600
96 HD22 ASN 16 2HD2 ASN 16 2.696 -6.051 -10.308
97 H GLU 17 H GLU 17 5.051 -1.506 -6.661
98 HA GLU 17 HA GLU 17 7.818 -1.330 -6.790
99 HB2 GLU 17 1HB GLU 17 5.725 0.481 -5.617
100 HB3 GLU 17 2HB GLU 17 7.431 0.895 -5.531
101 HG2 GLU 17 1HG GLU 17 6.232 1.933 -7.431
102 HG3 GLU 17 2HG GLU 17 7.614 0.948 -7.908
103 H CYS 18 H CYS 18 5.711 -1.703 -3.982
104 HA CYS 18 HA CYS 18 8.111 -2.159 -2.332
105 HB2 CYS 18 1HB CYS 18 6.839 -1.370 -0.400
106 HB3 CYS 18 2HB CYS 18 6.885 -0.135 -1.654
107 H GLY 19 H GLY 19 4.712 -3.071 -2.816
108 HA2 GLY 19 1HA GLY 19 4.171 -5.436 -2.986
109 HA3 GLY 19 2HA GLY 19 5.396 -5.742 -1.763
110 H LYS 20 H LYS 20 2.609 -3.530 -2.006
111 HA LYS 20 HA LYS 20 1.757 -4.492 0.645
112 HB2 LYS 20 1HB LYS 20 2.425 -2.012 0.242
113 HB3 LYS 20 2HB LYS 20 0.864 -1.890 -0.558
114 HG2 LYS 20 1HG LYS 20 -0.317 -2.231 1.398
115 HG3 LYS 20 2HG LYS 20 1.044 -3.018 2.201
116 HD2 LYS 20 1HD LYS 20 2.223 -0.875 2.300
117 HD3 LYS 20 2HD LYS 20 0.864 -0.089 1.493
118 HE2 LYS 20 1HE LYS 20 -0.592 -0.760 3.373
119 HE3 LYS 20 2HE LYS 20 0.812 -1.450 4.185
120 HZ1 LYS 20 3HZ LYS 20 1.714 0.987 3.729
121 HZ2 LYS 20 1HZ LYS 20 0.842 0.588 5.123
122 HZ3 LYS 20 2HZ LYS 20 0.063 1.341 3.824
123 H ALA 21 H ALA 21 -0.712 -4.040 0.954
124 HA ALA 21 HA ALA 21 -2.182 -4.799 -1.475
125 HB1 ALA 21 3HB ALA 21 -3.288 -6.586 -0.447
126 HB2 ALA 21 1HB ALA 21 -1.604 -6.775 0.041
127 HB3 ALA 21 2HB ALA 21 -2.778 -6.092 1.167
128 H PHE 22 H PHE 22 -4.297 -4.078 -1.596
129 HA PHE 22 HA PHE 22 -5.300 -2.460 0.636
130 HB2 PHE 22 1HB PHE 22 -5.374 -1.523 -2.236
131 HB3 PHE 22 2HB PHE 22 -5.880 -0.625 -0.809
132 HD1 PHE 22 HD2 PHE 22 -2.857 -2.325 -2.179
133 HD2 PHE 22 HD1 PHE 22 -4.436 0.932 0.060
134 HE1 PHE 22 HE2 PHE 22 -0.599 -1.366 -1.990
135 HE2 PHE 22 HE1 PHE 22 -2.180 1.897 0.252
136 HZ PHE 22 HZ PHE 22 -0.259 0.747 -0.772
137 H SER 23 H SER 23 -7.552 -2.275 0.761
138 HA SER 23 HA SER 23 -8.977 -4.449 -0.516
139 HB2 SER 23 1HB SER 23 -10.743 -3.999 1.041
140 HB3 SER 23 2HB SER 23 -9.226 -3.858 1.929
141 HG SER 23 HG SER 23 -9.402 -1.542 1.495
142 H VAL 24 H VAL 24 -8.413 -1.186 -1.140
143 HA VAL 24 HA VAL 24 -10.778 -1.051 -2.898
144 HB VAL 24 HB VAL 24 -9.336 1.237 -1.552
145 HG11 VAL 24 1HG1 VAL 24 -10.022 2.005 -3.687
146 HG12 VAL 24 2HG1 VAL 24 -11.583 1.194 -3.553
147 HG13 VAL 24 3HG1 VAL 24 -11.223 2.589 -2.536
148 HG21 VAL 24 3HG2 VAL 24 -11.099 -0.372 -0.364
149 HG22 VAL 24 1HG2 VAL 24 -11.029 1.360 -0.040
150 HG23 VAL 24 2HG2 VAL 24 -12.228 0.720 -1.164
151 H TYR 25 H TYR 25 -10.493 -0.411 -5.000
152 HA TYR 25 HA TYR 25 -8.004 -0.890 -6.209
153 HB2 TYR 25 1HB TYR 25 -10.468 -0.867 -7.171
154 HB3 TYR 25 2HB TYR 25 -10.050 0.789 -7.596
155 HD1 TYR 25 HD1 TYR 25 -7.477 0.859 -8.619
156 HD2 TYR 25 HD2 TYR 25 -10.254 -2.352 -8.911
157 HE1 TYR 25 HE1 TYR 25 -6.325 0.053 -10.637
158 HE2 TYR 25 HE2 TYR 25 -9.109 -3.167 -10.929
159 HH TYR 25 HH TYR 25 -7.316 -2.942 -12.246
160 H SER 26 H SER 26 -9.745 2.169 -5.670
161 HA SER 26 HA SER 26 -7.888 3.902 -6.781
162 HB2 SER 26 1HB SER 26 -9.691 4.369 -4.394
163 HB3 SER 26 2HB SER 26 -8.873 5.636 -5.309
164 HG SER 26 HG SER 26 -10.154 5.241 -7.027
165 H SER 27 H SER 27 -8.159 2.893 -3.374
166 HA SER 27 HA SER 27 -6.145 4.256 -2.198
167 HB2 SER 27 1HB SER 27 -7.660 2.385 -1.239
168 HB3 SER 27 2HB SER 27 -6.358 1.294 -1.711
169 HG SER 27 HG SER 27 -5.653 3.572 -0.274
170 H LEU 28 H LEU 28 -5.756 1.336 -4.170
171 HA LEU 28 HA LEU 28 -3.007 0.989 -3.846
172 HB2 LEU 28 1HB LEU 28 -4.227 -0.754 -4.852
173 HB3 LEU 28 2HB LEU 28 -4.888 0.315 -6.087
174 HG LEU 28 HG LEU 28 -2.731 0.430 -7.186
175 HD11 LEU 28 1HD1 LEU 28 -0.809 -0.764 -6.427
176 HD12 LEU 28 2HD1 LEU 28 -1.716 -1.493 -5.103
177 HD13 LEU 28 3HD1 LEU 28 -1.384 0.239 -5.095
178 HD21 LEU 28 3HD2 LEU 28 -3.553 -2.399 -6.538
179 HD22 LEU 28 1HD2 LEU 28 -2.536 -1.913 -7.894
180 HD23 LEU 28 2HD2 LEU 28 -4.217 -1.383 -7.819
181 H THR 29 H THR 29 -4.775 2.801 -6.345
182 HA THR 29 HA THR 29 -2.477 3.712 -7.716
183 HB THR 29 HB THR 29 -3.972 5.373 -8.760
184 HG1 THR 29 HG1 THR 29 -6.297 5.046 -8.054
185 HG21 THR 29 3HG2 THR 29 -3.919 2.854 -9.351
186 HG22 THR 29 1HG2 THR 29 -5.229 3.845 -9.992
187 HG23 THR 29 2HG2 THR 29 -5.512 2.804 -8.597
188 H THR 30 H THR 30 -4.452 5.137 -5.147
189 HA THR 30 HA THR 30 -3.146 7.640 -5.078
190 HB THR 30 HB THR 30 -4.491 6.299 -2.732
191 HG1 THR 30 HG1 THR 30 -6.302 7.713 -3.709
192 HG21 THR 30 3HG2 THR 30 -4.715 9.199 -3.295
193 HG22 THR 30 1HG2 THR 30 -3.149 8.616 -2.735
194 HG23 THR 30 2HG2 THR 30 -4.591 8.351 -1.754
195 H HIS 31 H HIS 31 -2.375 4.532 -3.723
196 HA HIS 31 HA HIS 31 -0.473 5.500 -1.812
197 HB2 HIS 31 1HB HIS 31 -1.235 3.421 -1.182
198 HB3 HIS 31 2HB HIS 31 -1.308 2.827 -2.838
199 HD1 HIS 31 HD1 HIS 31 1.237 3.562 -0.131
200 HD2 HIS 31 HD2 HIS 31 0.837 1.325 -3.609
201 HE1 HIS 31 HE1 HIS 31 3.303 2.133 -0.252
202 H GLN 32 H GLN 32 -0.176 3.829 -4.946
203 HA GLN 32 HA GLN 32 2.526 3.685 -5.224
204 HB2 GLN 32 1HB GLN 32 0.342 4.211 -7.203
205 HB3 GLN 32 2HB GLN 32 2.018 4.246 -7.734
206 HG2 GLN 32 1HG GLN 32 2.226 1.942 -6.666
207 HG3 GLN 32 2HG GLN 32 0.464 1.947 -6.604
208 HE21 GLN 32 1HE2 GLN 32 1.563 -0.014 -7.993
209 HE22 GLN 32 2HE2 GLN 32 1.401 0.238 -9.694
210 H VAL 33 H VAL 33 0.618 6.544 -5.100
211 HA VAL 33 HA VAL 33 2.083 8.408 -6.492
212 HB VAL 33 HB VAL 33 0.794 8.813 -3.789
213 HG11 VAL 33 1HG1 VAL 33 0.923 11.092 -4.101
214 HG12 VAL 33 2HG1 VAL 33 2.460 10.560 -4.786
215 HG13 VAL 33 3HG1 VAL 33 1.107 10.950 -5.849
216 HG21 VAL 33 3HG2 VAL 33 -0.523 9.655 -6.305
217 HG22 VAL 33 1HG2 VAL 33 -0.493 7.927 -5.951
218 HG23 VAL 33 2HG2 VAL 33 -1.225 9.050 -4.805
219 H ILE 34 H ILE 34 2.696 7.148 -3.241
220 HA ILE 34 HA ILE 34 4.816 8.841 -2.555
221 HB ILE 34 HB ILE 34 5.433 7.212 -0.887
222 HG12 ILE 34 1HG1 ILE 34 3.431 5.229 -1.873
223 HG13 ILE 34 2HG1 ILE 34 4.999 5.293 -2.670
224 HG21 ILE 34 1HG2 ILE 34 2.932 6.643 -0.123
225 HG22 ILE 34 2HG2 ILE 34 3.634 8.254 0.007
226 HG23 ILE 34 3HG2 ILE 34 2.587 7.856 -1.355
227 HD11 ILE 34 3HD1 ILE 34 4.262 4.244 -0.053
228 HD12 ILE 34 1HD1 ILE 34 5.628 3.850 -1.095
229 HD13 ILE 34 2HD1 ILE 34 5.703 5.260 -0.038
230 H HIS 35 H HIS 35 4.664 6.171 -4.732
231 HA HIS 35 HA HIS 35 7.540 5.781 -4.785
232 HB2 HIS 35 1HB HIS 35 5.287 4.535 -6.367
233 HB3 HIS 35 2HB HIS 35 6.985 4.135 -6.609
234 HD1 HIS 35 HD1 HIS 35 8.013 3.743 -3.830
235 HD2 HIS 35 HD2 HIS 35 4.248 2.445 -5.012
236 HE1 HIS 35 HE1 HIS 35 7.393 1.920 -2.213
237 H THR 36 H THR 36 5.264 7.797 -6.265
238 HA THR 36 HA THR 36 7.216 8.511 -8.352
239 HB THR 36 HB THR 36 5.524 7.554 -9.640
240 HG1 THR 36 HG1 THR 36 4.228 9.581 -10.305
241 HG21 THR 36 3HG2 THR 36 3.112 7.976 -9.264
242 HG22 THR 36 1HG2 THR 36 3.523 8.895 -7.817
243 HG23 THR 36 2HG2 THR 36 3.885 7.171 -7.899
244 H GLY 37 H GLY 37 7.918 10.025 -6.633
245 HA2 GLY 37 1HA GLY 37 6.142 12.381 -6.477
246 HA3 GLY 37 2HA GLY 37 7.304 11.943 -5.234
247 H GLU 38 H GLU 38 9.637 11.740 -6.166
248 HA GLU 38 HA GLU 38 10.103 14.007 -7.989
249 HB2 GLU 38 1HB GLU 38 12.199 14.436 -6.664
250 HB3 GLU 38 2HB GLU 38 10.698 14.781 -5.815
251 HG2 GLU 38 1HG GLU 38 10.892 12.526 -4.745
252 HG3 GLU 38 2HG GLU 38 12.501 12.404 -5.455
253 H LYS 39 H LYS 39 10.340 12.605 -9.756
254 HA LYS 39 HA LYS 39 12.551 10.684 -9.639
255 HB2 LYS 39 1HB LYS 39 10.124 10.267 -10.619
256 HB3 LYS 39 2HB LYS 39 10.827 10.999 -12.056
257 HG2 LYS 39 1HG LYS 39 12.434 9.290 -12.266
258 HG3 LYS 39 2HG LYS 39 12.107 8.680 -10.642
259 HD2 LYS 39 1HD LYS 39 9.872 7.988 -11.347
260 HD3 LYS 39 2HD LYS 39 10.180 8.620 -12.966
261 HE2 LYS 39 1HE LYS 39 11.676 6.936 -13.479
262 HE3 LYS 39 2HE LYS 39 12.041 6.603 -11.787
263 HZ1 LYS 39 3HZ LYS 39 9.822 5.646 -11.551
264 HZ2 LYS 39 1HZ LYS 39 10.720 4.837 -12.736
265 HZ3 LYS 39 2HZ LYS 39 9.512 5.930 -13.190
266 HA PRO 40 HA PRO 40 15.245 13.402 -11.823
267 HB2 PRO 40 1HB PRO 40 16.988 11.558 -12.790
268 HB3 PRO 40 2HB PRO 40 16.951 12.048 -11.092
269 HG2 PRO 40 1HG PRO 40 15.762 9.627 -12.391
270 HG3 PRO 40 2HG PRO 40 16.646 9.754 -10.859
271 HD2 PRO 40 1HD PRO 40 13.945 9.609 -10.975
272 HD3 PRO 40 2HD PRO 40 14.799 10.519 -9.712
273 H SER 41 H SER 41 13.304 11.033 -13.307
274 HA SER 41 HA SER 41 14.218 11.394 -15.998
275 HB2 SER 41 1HB SER 41 11.630 10.225 -14.946
276 HB3 SER 41 2HB SER 41 12.192 10.120 -16.615
277 HG SER 41 HG SER 41 13.926 8.884 -15.923
278 H GLY 42 H GLY 42 13.461 12.732 -17.567
279 HA2 GLY 42 1HA GLY 42 11.128 14.006 -17.926
280 HA3 GLY 42 2HA GLY 42 11.876 14.997 -16.682
281 HA PRO 43 HA PRO 43 14.272 17.198 -19.615
282 HB2 PRO 43 1HB PRO 43 16.795 17.193 -18.614
283 HB3 PRO 43 2HB PRO 43 15.478 18.124 -17.892
284 HG2 PRO 43 1HG PRO 43 16.592 15.469 -17.072
285 HG3 PRO 43 2HG PRO 43 16.123 16.847 -16.059
286 HD2 PRO 43 1HD PRO 43 14.536 14.679 -16.394
287 HD3 PRO 43 2HD PRO 43 13.883 16.311 -16.147
288 H SER 44 H SER 44 16.126 17.143 -21.139
289 HA SER 44 HA SER 44 16.511 14.418 -22.119
290 HB2 SER 44 1HB SER 44 15.735 16.528 -23.510
291 HB3 SER 44 2HB SER 44 17.471 16.820 -23.620
292 HG SER 44 HG SER 44 16.803 15.548 -25.354
293 H SER 45 H SER 45 18.438 17.336 -21.464
294 HA SER 45 HA SER 45 20.953 16.566 -22.040
295 HB2 SER 45 1HB SER 45 19.999 18.027 -19.572
296 HB3 SER 45 2HB SER 45 21.702 17.877 -20.007
297 HG SER 45 HG SER 45 20.224 19.768 -20.778
298 H GLY 46 H GLY 46 19.195 15.651 -19.091
299 HA2 GLY 46 1HA GLY 46 19.401 13.440 -18.177
300 HA3 GLY 46 2HA GLY 46 21.034 13.368 -18.822
Start of MODEL 12
1 H1 GLY 1 H GLY 1 6.218 -21.946 18.133
2 HA2 GLY 1 1HA GLY 1 4.433 -20.476 19.235
3 HA3 GLY 1 2HA GLY 1 5.603 -19.190 18.980
4 H SER 2 H SER 2 2.810 -20.093 17.867
5 HA SER 2 HA SER 2 3.472 -19.828 15.016
6 HB2 SER 2 1HB SER 2 1.128 -21.002 16.479
7 HB3 SER 2 2HB SER 2 0.952 -20.474 14.806
8 HG SER 2 HG SER 2 3.030 -21.835 14.604
9 H SER 3 H SER 3 1.793 -18.584 13.729
10 HA SER 3 HA SER 3 0.872 -16.225 15.232
11 HB2 SER 3 1HB SER 3 1.603 -14.763 13.462
12 HB3 SER 3 2HB SER 3 2.972 -15.771 13.929
13 HG SER 3 HG SER 3 2.202 -17.174 12.119
14 H GLY 4 H GLY 4 -0.773 -14.937 13.993
15 HA2 GLY 4 1HA GLY 4 -2.501 -16.762 12.436
16 HA3 GLY 4 2HA GLY 4 -3.129 -15.601 13.596
17 H SER 5 H SER 5 -3.055 -16.133 10.460
18 HA SER 5 HA SER 5 -2.088 -13.693 9.369
19 HB2 SER 5 1HB SER 5 -2.328 -15.744 8.020
20 HB3 SER 5 2HB SER 5 -4.080 -15.658 8.207
21 HG SER 5 HG SER 5 -2.361 -13.971 6.748
22 H SER 6 H SER 6 -5.379 -14.883 10.031
23 HA SER 6 HA SER 6 -7.393 -13.776 10.027
24 HB2 SER 6 1HB SER 6 -7.446 -11.931 11.691
25 HB3 SER 6 2HB SER 6 -6.582 -13.350 12.283
26 HG SER 6 HG SER 6 -5.670 -10.816 11.814
27 H GLY 7 H GLY 7 -6.019 -13.218 7.672
28 HA2 GLY 7 1HA GLY 7 -6.098 -10.346 7.240
29 HA3 GLY 7 2HA GLY 7 -5.642 -11.568 6.062
30 H THR 8 H THR 8 -8.609 -11.303 7.985
31 HA THR 8 HA THR 8 -10.439 -12.129 6.201
32 HB THR 8 HB THR 8 -12.067 -10.476 7.206
33 HG1 THR 8 HG1 THR 8 -10.870 -8.750 7.800
34 HG21 THR 8 3HG2 THR 8 -11.295 -11.386 9.668
35 HG22 THR 8 1HG2 THR 8 -10.490 -12.523 8.587
36 HG23 THR 8 2HG2 THR 8 -12.238 -12.309 8.498
37 H GLY 9 H GLY 9 -11.334 -11.495 4.323
38 HA2 GLY 9 1HA GLY 9 -12.099 -9.896 2.746
39 HA3 GLY 9 2HA GLY 9 -10.994 -8.720 3.443
40 H VAL 10 H VAL 10 -11.505 -9.904 0.649
41 HA VAL 10 HA VAL 10 -8.914 -11.047 0.008
42 HB VAL 10 HB VAL 10 -10.810 -10.255 -2.141
43 HG11 VAL 10 1HG1 VAL 10 -9.712 -12.977 -1.953
44 HG12 VAL 10 2HG1 VAL 10 -9.763 -11.862 -3.320
45 HG13 VAL 10 3HG1 VAL 10 -8.516 -11.688 -2.085
46 HG21 VAL 10 3HG2 VAL 10 -11.489 -12.060 0.089
47 HG22 VAL 10 1HG2 VAL 10 -12.538 -11.153 -1.001
48 HG23 VAL 10 2HG2 VAL 10 -11.823 -12.676 -1.529
49 H LYS 11 H LYS 11 -7.215 -9.934 -0.693
50 HA LYS 11 HA LYS 11 -7.620 -7.127 -1.484
51 HB2 LYS 11 1HB LYS 11 -5.157 -8.482 -0.370
52 HB3 LYS 11 2HB LYS 11 -5.253 -6.792 -0.846
53 HG2 LYS 11 1HG LYS 11 -6.463 -6.197 0.986
54 HG3 LYS 11 2HG LYS 11 -7.225 -7.782 1.136
55 HD2 LYS 11 1HD LYS 11 -4.290 -7.584 1.581
56 HD3 LYS 11 2HD LYS 11 -5.367 -6.964 2.835
57 HE2 LYS 11 1HE LYS 11 -5.195 -9.126 3.534
58 HE3 LYS 11 2HE LYS 11 -6.566 -9.291 2.438
59 HZ1 LYS 11 3HZ LYS 11 -4.034 -10.529 2.299
60 HZ2 LYS 11 1HZ LYS 11 -4.276 -9.599 0.906
61 HZ3 LYS 11 2HZ LYS 11 -5.397 -10.792 1.332
62 HA PRO 12 HA PRO 12 -6.384 -9.238 -5.387
63 HB2 PRO 12 1HB PRO 12 -7.936 -7.674 -6.972
64 HB3 PRO 12 2HB PRO 12 -8.546 -9.116 -6.153
65 HG2 PRO 12 1HG PRO 12 -8.802 -6.239 -5.366
66 HG3 PRO 12 2HG PRO 12 -10.024 -7.523 -5.325
67 HD2 PRO 12 1HD PRO 12 -8.683 -6.719 -3.115
68 HD3 PRO 12 2HD PRO 12 -9.228 -8.393 -3.345
69 H TYR 13 H TYR 13 -6.728 -5.791 -4.650
70 HA TYR 13 HA TYR 13 -4.755 -5.068 -6.653
71 HB2 TYR 13 1HB TYR 13 -6.016 -3.241 -4.609
72 HB3 TYR 13 2HB TYR 13 -5.280 -2.800 -6.146
73 HD1 TYR 13 HD1 TYR 13 -6.428 -3.889 -8.266
74 HD2 TYR 13 HD2 TYR 13 -8.320 -3.366 -4.491
75 HE1 TYR 13 HE1 TYR 13 -8.628 -4.006 -9.359
76 HE2 TYR 13 HE2 TYR 13 -10.525 -3.483 -5.574
77 HH TYR 13 HH TYR 13 -11.616 -3.506 -7.532
78 H MET 14 H MET 14 -2.655 -5.117 -6.251
79 HA MET 14 HA MET 14 -1.706 -4.451 -3.553
80 HB2 MET 14 1HB MET 14 -0.976 -6.857 -5.204
81 HB3 MET 14 2HB MET 14 0.106 -6.234 -3.966
82 HG2 MET 14 1HG MET 14 -1.572 -6.589 -2.268
83 HG3 MET 14 2HG MET 14 -2.732 -7.110 -3.488
84 HE1 MET 14 3HE MET 14 -1.696 -8.564 -0.757
85 HE2 MET 14 1HE MET 14 -0.551 -9.882 -1.010
86 HE3 MET 14 2HE MET 14 0.011 -8.211 -1.025
87 H CYS 15 H CYS 15 0.249 -3.369 -3.453
88 HA CYS 15 HA CYS 15 1.003 -1.956 -5.837
89 HB2 CYS 15 1HB CYS 15 1.021 -0.715 -3.795
90 HB3 CYS 15 2HB CYS 15 2.043 -1.910 -3.003
91 H ASN 16 H ASN 16 2.519 -2.509 -7.250
92 HA ASN 16 HA ASN 16 4.316 -4.723 -6.590
93 HB2 ASN 16 1HB ASN 16 2.883 -4.749 -8.681
94 HB3 ASN 16 2HB ASN 16 3.899 -3.448 -9.297
95 HD21 ASN 16 1HD2 ASN 16 5.511 -4.060 -10.530
96 HD22 ASN 16 2HD2 ASN 16 6.294 -5.599 -10.499
97 H GLU 17 H GLU 17 4.961 -2.342 -5.340
98 HA GLU 17 HA GLU 17 7.463 -1.639 -6.717
99 HB2 GLU 17 1HB GLU 17 5.689 0.284 -5.201
100 HB3 GLU 17 2HB GLU 17 7.242 0.672 -5.927
101 HG2 GLU 17 1HG GLU 17 5.083 -0.446 -7.643
102 HG3 GLU 17 2HG GLU 17 5.005 1.244 -7.148
103 H CYS 18 H CYS 18 5.704 -1.770 -3.649
104 HA CYS 18 HA CYS 18 8.288 -2.119 -2.275
105 HB2 CYS 18 1HB CYS 18 7.304 -1.097 -0.292
106 HB3 CYS 18 2HB CYS 18 7.184 0.001 -1.662
107 H GLY 19 H GLY 19 4.878 -3.045 -2.385
108 HA2 GLY 19 1HA GLY 19 4.519 -5.507 -2.247
109 HA3 GLY 19 2HA GLY 19 5.587 -5.471 -0.851
110 H LYS 20 H LYS 20 2.969 -3.240 -1.702
111 HA LYS 20 HA LYS 20 1.758 -3.794 0.911
112 HB2 LYS 20 1HB LYS 20 2.397 -1.417 -0.071
113 HB3 LYS 20 2HB LYS 20 0.826 -1.569 -0.847
114 HG2 LYS 20 1HG LYS 20 -0.317 -1.414 1.118
115 HG3 LYS 20 2HG LYS 20 0.998 -2.109 2.067
116 HD2 LYS 20 1HD LYS 20 2.275 0.044 1.537
117 HD3 LYS 20 2HD LYS 20 0.717 0.694 1.021
118 HE2 LYS 20 1HE LYS 20 0.878 -0.632 3.677
119 HE3 LYS 20 2HE LYS 20 1.594 0.969 3.503
120 HZ1 LYS 20 3HZ LYS 20 -0.491 1.614 3.993
121 HZ2 LYS 20 1HZ LYS 20 -1.199 0.172 3.462
122 HZ3 LYS 20 2HZ LYS 20 -0.760 1.362 2.343
123 H ALA 21 H ALA 21 -0.727 -3.475 0.885
124 HA ALA 21 HA ALA 21 -1.964 -4.590 -1.515
125 HB1 ALA 21 3HB ALA 21 -3.073 -6.367 -0.312
126 HB2 ALA 21 1HB ALA 21 -1.327 -6.517 -0.111
127 HB3 ALA 21 2HB ALA 21 -2.313 -5.861 1.197
128 H PHE 22 H PHE 22 -4.053 -3.957 -1.825
129 HA PHE 22 HA PHE 22 -5.417 -2.535 0.345
130 HB2 PHE 22 1HB PHE 22 -5.393 -1.391 -2.438
131 HB3 PHE 22 2HB PHE 22 -5.850 -0.606 -0.930
132 HD1 PHE 22 HD2 PHE 22 -3.032 -1.744 -2.991
133 HD2 PHE 22 HD1 PHE 22 -4.218 0.401 0.489
134 HE1 PHE 22 HE2 PHE 22 -0.762 -0.816 -2.793
135 HE2 PHE 22 HE1 PHE 22 -1.951 1.333 0.692
136 HZ PHE 22 HZ PHE 22 -0.218 0.724 -0.950
137 H SER 23 H SER 23 -7.675 -2.515 0.204
138 HA SER 23 HA SER 23 -8.778 -4.714 -1.306
139 HB2 SER 23 1HB SER 23 -10.795 -4.351 -0.029
140 HB3 SER 23 2HB SER 23 -9.420 -4.228 1.068
141 HG SER 23 HG SER 23 -11.195 -2.524 1.059
142 H VAL 24 H VAL 24 -8.941 -1.204 -1.333
143 HA VAL 24 HA VAL 24 -10.809 -1.275 -3.591
144 HB VAL 24 HB VAL 24 -9.818 1.260 -2.339
145 HG11 VAL 24 1HG1 VAL 24 -11.334 0.998 -4.444
146 HG12 VAL 24 2HG1 VAL 24 -12.604 0.697 -3.256
147 HG13 VAL 24 3HG1 VAL 24 -11.715 2.220 -3.231
148 HG21 VAL 24 3HG2 VAL 24 -12.069 0.911 -0.954
149 HG22 VAL 24 1HG2 VAL 24 -11.580 -0.777 -1.104
150 HG23 VAL 24 2HG2 VAL 24 -10.496 0.392 -0.350
151 H TYR 25 H TYR 25 -10.262 -0.647 -5.612
152 HA TYR 25 HA TYR 25 -7.643 -0.773 -6.496
153 HB2 TYR 25 1HB TYR 25 -9.935 -0.811 -7.788
154 HB3 TYR 25 2HB TYR 25 -9.618 0.909 -7.990
155 HD1 TYR 25 HD1 TYR 25 -6.962 1.293 -8.653
156 HD2 TYR 25 HD2 TYR 25 -9.363 -2.086 -9.611
157 HE1 TYR 25 HE1 TYR 25 -5.496 0.802 -10.565
158 HE2 TYR 25 HE2 TYR 25 -7.903 -2.587 -11.526
159 HH TYR 25 HH TYR 25 -6.270 -1.038 -13.049
160 H SER 26 H SER 26 -9.608 2.113 -5.836
161 HA SER 26 HA SER 26 -7.748 4.045 -6.586
162 HB2 SER 26 1HB SER 26 -10.039 4.028 -4.647
163 HB3 SER 26 2HB SER 26 -8.993 5.443 -4.760
164 HG SER 26 HG SER 26 -9.674 5.813 -6.774
165 H SER 27 H SER 27 -8.269 2.529 -3.416
166 HA SER 27 HA SER 27 -6.476 3.932 -1.882
167 HB2 SER 27 1HB SER 27 -7.226 1.009 -1.820
168 HB3 SER 27 2HB SER 27 -6.181 1.741 -0.603
169 HG SER 27 HG SER 27 -7.890 3.200 -0.141
170 H LEU 28 H LEU 28 -5.816 1.286 -4.121
171 HA LEU 28 HA LEU 28 -3.105 0.913 -3.478
172 HB2 LEU 28 1HB LEU 28 -4.129 -0.773 -4.740
173 HB3 LEU 28 2HB LEU 28 -4.740 0.371 -5.932
174 HG LEU 28 HG LEU 28 -2.350 0.732 -6.647
175 HD11 LEU 28 1HD1 LEU 28 -1.035 -0.011 -4.885
176 HD12 LEU 28 2HD1 LEU 28 -0.893 -1.312 -6.067
177 HD13 LEU 28 3HD1 LEU 28 -1.969 -1.493 -4.681
178 HD21 LEU 28 3HD2 LEU 28 -3.797 -0.605 -8.000
179 HD22 LEU 28 1HD2 LEU 28 -3.616 -1.988 -6.921
180 HD23 LEU 28 2HD2 LEU 28 -2.245 -1.435 -7.883
181 H THR 29 H THR 29 -4.679 2.979 -5.892
182 HA THR 29 HA THR 29 -2.283 4.000 -7.008
183 HB THR 29 HB THR 29 -3.679 5.727 -8.028
184 HG1 THR 29 HG1 THR 29 -5.552 6.265 -7.186
185 HG21 THR 29 3HG2 THR 29 -5.177 3.110 -8.050
186 HG22 THR 29 1HG2 THR 29 -3.664 3.375 -8.915
187 HG23 THR 29 2HG2 THR 29 -5.096 4.315 -9.335
188 H THR 30 H THR 30 -4.456 5.178 -4.471
189 HA THR 30 HA THR 30 -3.385 7.683 -4.024
190 HB THR 30 HB THR 30 -4.386 5.788 -1.890
191 HG1 THR 30 HG1 THR 30 -5.728 6.499 -3.899
192 HG21 THR 30 3HG2 THR 30 -4.840 7.729 -0.579
193 HG22 THR 30 1HG2 THR 30 -4.429 8.804 -1.915
194 HG23 THR 30 2HG2 THR 30 -3.169 7.856 -1.125
195 H HIS 31 H HIS 31 -2.123 4.552 -3.128
196 HA HIS 31 HA HIS 31 -0.028 5.735 -1.485
197 HB2 HIS 31 1HB HIS 31 -0.699 3.776 -0.468
198 HB3 HIS 31 2HB HIS 31 -1.008 2.962 -1.999
199 HD1 HIS 31 HD1 HIS 31 1.784 3.830 0.362
200 HD2 HIS 31 HD2 HIS 31 1.128 1.535 -3.038
201 HE1 HIS 31 HE1 HIS 31 3.848 2.419 0.096
202 H GLN 32 H GLN 32 -0.341 3.833 -4.465
203 HA GLN 32 HA GLN 32 2.285 3.486 -5.153
204 HB2 GLN 32 1HB GLN 32 -0.122 4.061 -6.869
205 HB3 GLN 32 2HB GLN 32 1.457 3.721 -7.566
206 HG2 GLN 32 1HG GLN 32 0.370 1.819 -5.563
207 HG3 GLN 32 2HG GLN 32 -0.334 1.829 -7.179
208 HE21 GLN 32 1HE2 GLN 32 0.463 0.179 -8.263
209 HE22 GLN 32 2HE2 GLN 32 2.126 -0.282 -8.336
210 H VAL 33 H VAL 33 0.574 6.439 -4.907
211 HA VAL 33 HA VAL 33 1.809 8.110 -6.715
212 HB VAL 33 HB VAL 33 -0.009 8.850 -5.253
213 HG11 VAL 33 1HG1 VAL 33 0.346 9.395 -2.936
214 HG12 VAL 33 2HG1 VAL 33 0.804 7.713 -3.203
215 HG13 VAL 33 3HG1 VAL 33 2.049 8.954 -3.052
216 HG21 VAL 33 3HG2 VAL 33 1.890 10.386 -6.263
217 HG22 VAL 33 1HG2 VAL 33 0.620 11.047 -5.234
218 HG23 VAL 33 2HG2 VAL 33 2.212 10.703 -4.558
219 H ILE 34 H ILE 34 2.951 7.193 -3.478
220 HA ILE 34 HA ILE 34 5.266 8.768 -3.447
221 HB ILE 34 HB ILE 34 6.077 7.346 -1.677
222 HG12 ILE 34 1HG1 ILE 34 3.810 5.428 -1.978
223 HG13 ILE 34 2HG1 ILE 34 5.204 5.239 -3.036
224 HG21 ILE 34 1HG2 ILE 34 3.496 8.529 -1.723
225 HG22 ILE 34 2HG2 ILE 34 3.419 7.076 -0.729
226 HG23 ILE 34 3HG2 ILE 34 4.595 8.336 -0.358
227 HD11 ILE 34 3HD1 ILE 34 5.547 3.828 -1.177
228 HD12 ILE 34 1HD1 ILE 34 6.628 5.206 -0.970
229 HD13 ILE 34 2HD1 ILE 34 5.134 5.110 -0.039
230 H HIS 35 H HIS 35 4.506 6.050 -5.324
231 HA HIS 35 HA HIS 35 7.315 5.356 -5.774
232 HB2 HIS 35 1HB HIS 35 4.722 4.028 -6.552
233 HB3 HIS 35 2HB HIS 35 6.274 3.519 -7.212
234 HD1 HIS 35 HD1 HIS 35 8.112 3.013 -5.134
235 HD2 HIS 35 HD2 HIS 35 4.050 2.603 -4.367
236 HE1 HIS 35 HE1 HIS 35 7.957 1.549 -3.095
237 H THR 36 H THR 36 4.574 6.860 -7.308
238 HA THR 36 HA THR 36 6.191 7.282 -9.736
239 HB THR 36 HB THR 36 4.297 6.105 -10.460
240 HG1 THR 36 HG1 THR 36 4.679 8.411 -11.349
241 HG21 THR 36 3HG2 THR 36 1.962 6.897 -9.799
242 HG22 THR 36 1HG2 THR 36 2.757 7.817 -8.523
243 HG23 THR 36 2HG2 THR 36 2.899 6.059 -8.563
244 H GLY 37 H GLY 37 7.188 9.197 -9.305
245 HA2 GLY 37 1HA GLY 37 5.702 11.587 -9.583
246 HA3 GLY 37 2HA GLY 37 6.134 11.360 -7.895
247 H GLU 38 H GLU 38 8.661 10.049 -8.478
248 HA GLU 38 HA GLU 38 10.329 12.311 -8.556
249 HB2 GLU 38 1HB GLU 38 10.881 9.363 -8.837
250 HB3 GLU 38 2HB GLU 38 12.166 10.561 -8.897
251 HG2 GLU 38 1HG GLU 38 10.250 10.420 -6.598
252 HG3 GLU 38 2HG GLU 38 11.701 9.421 -6.667
253 H LYS 39 H LYS 39 11.093 13.462 -10.197
254 HA LYS 39 HA LYS 39 10.324 13.180 -12.827
255 HB2 LYS 39 1HB LYS 39 11.610 15.099 -11.521
256 HB3 LYS 39 2HB LYS 39 13.012 14.350 -12.273
257 HG2 LYS 39 1HG LYS 39 10.644 15.061 -13.943
258 HG3 LYS 39 2HG LYS 39 11.789 16.313 -13.454
259 HD2 LYS 39 1HD LYS 39 12.823 13.780 -14.645
260 HD3 LYS 39 2HD LYS 39 12.114 15.001 -15.705
261 HE2 LYS 39 1HE LYS 39 14.313 15.559 -13.720
262 HE3 LYS 39 2HE LYS 39 14.595 15.172 -15.417
263 HZ1 LYS 39 3HZ LYS 39 13.363 17.124 -16.057
264 HZ2 LYS 39 1HZ LYS 39 14.594 17.568 -14.985
265 HZ3 LYS 39 2HZ LYS 39 12.994 17.477 -14.445
266 HA PRO 40 HA PRO 40 12.673 9.778 -14.370
267 HB2 PRO 40 1HB PRO 40 12.388 10.288 -17.021
268 HB3 PRO 40 2HB PRO 40 11.083 9.637 -16.023
269 HG2 PRO 40 1HG PRO 40 11.564 12.456 -16.909
270 HG3 PRO 40 2HG PRO 40 10.044 11.544 -16.854
271 HD2 PRO 40 1HD PRO 40 10.733 13.342 -14.950
272 HD3 PRO 40 2HD PRO 40 9.768 11.895 -14.593
273 H SER 41 H SER 41 14.781 9.444 -14.751
274 HA SER 41 HA SER 41 16.674 11.452 -14.752
275 HB2 SER 41 1HB SER 41 16.840 8.617 -15.786
276 HB3 SER 41 2HB SER 41 18.243 9.679 -15.668
277 HG SER 41 HG SER 41 17.405 9.920 -13.363
278 H GLY 42 H GLY 42 15.828 9.458 -17.595
279 HA2 GLY 42 1HA GLY 42 17.228 10.772 -19.534
280 HA3 GLY 42 2HA GLY 42 15.657 10.037 -19.819
281 HA PRO 43 HA PRO 43 15.611 14.778 -20.254
282 HB2 PRO 43 1HB PRO 43 15.519 14.924 -22.963
283 HB3 PRO 43 2HB PRO 43 17.033 14.942 -22.051
284 HG2 PRO 43 1HG PRO 43 15.707 12.667 -23.475
285 HG3 PRO 43 2HG PRO 43 17.421 13.120 -23.443
286 HD2 PRO 43 1HD PRO 43 16.415 11.121 -21.919
287 HD3 PRO 43 2HD PRO 43 17.774 12.133 -21.391
288 H SER 44 H SER 44 13.615 15.535 -19.983
289 HA SER 44 HA SER 44 11.457 14.548 -21.702
290 HB2 SER 44 1HB SER 44 11.487 14.539 -18.691
291 HB3 SER 44 2HB SER 44 9.972 14.613 -19.589
292 HG SER 44 HG SER 44 10.209 12.508 -19.537
293 H SER 45 H SER 45 9.405 15.923 -21.268
294 HA SER 45 HA SER 45 10.143 18.715 -20.726
295 HB2 SER 45 1HB SER 45 10.181 18.389 -23.165
296 HB3 SER 45 2HB SER 45 8.530 17.769 -23.109
297 HG SER 45 HG SER 45 8.014 19.789 -23.376
298 H GLY 46 H GLY 46 8.891 19.456 -19.154
299 HA2 GLY 46 1HA GLY 46 6.219 19.807 -19.111
300 HA3 GLY 46 2HA GLY 46 6.379 18.157 -18.527
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -3.631 -24.475 16.921
2 HA2 GLY 1 1HA GLY 1 -4.570 -25.723 14.459
3 HA3 GLY 1 2HA GLY 1 -5.152 -26.056 16.083
4 H SER 2 H SER 2 -6.352 -25.182 13.352
5 HA SER 2 HA SER 2 -8.539 -23.750 14.456
6 HB2 SER 2 1HB SER 2 -6.959 -21.870 14.335
7 HB3 SER 2 2HB SER 2 -6.707 -22.187 12.619
8 HG SER 2 HG SER 2 -9.186 -21.495 13.820
9 H SER 3 H SER 3 -10.111 -24.791 13.434
10 HA SER 3 HA SER 3 -9.809 -25.337 10.557
11 HB2 SER 3 1HB SER 3 -11.125 -26.820 12.786
12 HB3 SER 3 2HB SER 3 -11.842 -26.939 11.179
13 HG SER 3 HG SER 3 -9.929 -27.769 10.403
14 H GLY 4 H GLY 4 -11.278 -24.581 9.123
15 HA2 GLY 4 1HA GLY 4 -13.814 -24.010 9.067
16 HA3 GLY 4 2HA GLY 4 -13.316 -22.755 10.193
17 H SER 5 H SER 5 -14.331 -21.429 8.433
18 HA SER 5 HA SER 5 -12.217 -20.446 6.695
19 HB2 SER 5 1HB SER 5 -13.200 -21.948 5.150
20 HB3 SER 5 2HB SER 5 -14.835 -21.545 5.675
21 HG SER 5 HG SER 5 -13.068 -19.721 4.409
22 H SER 6 H SER 6 -12.466 -18.292 6.090
23 HA SER 6 HA SER 6 -14.478 -16.838 7.649
24 HB2 SER 6 1HB SER 6 -11.785 -16.123 6.539
25 HB3 SER 6 2HB SER 6 -12.945 -14.846 6.905
26 HG SER 6 HG SER 6 -11.347 -16.073 8.585
27 H GLY 7 H GLY 7 -15.664 -15.098 6.713
28 HA2 GLY 7 1HA GLY 7 -16.905 -15.648 4.301
29 HA3 GLY 7 2HA GLY 7 -16.899 -14.069 5.073
30 H THR 8 H THR 8 -15.770 -12.446 4.164
31 HA THR 8 HA THR 8 -14.598 -12.923 1.568
32 HB THR 8 HB THR 8 -14.447 -10.534 1.347
33 HG1 THR 8 HG1 THR 8 -14.790 -10.588 4.150
34 HG21 THR 8 3HG2 THR 8 -16.840 -11.896 1.878
35 HG22 THR 8 1HG2 THR 8 -16.643 -10.385 0.992
36 HG23 THR 8 2HG2 THR 8 -16.969 -10.355 2.725
37 H GLY 9 H GLY 9 -12.470 -12.279 0.949
38 HA2 GLY 9 1HA GLY 9 -10.492 -11.384 2.737
39 HA3 GLY 9 2HA GLY 9 -10.443 -13.140 2.687
40 H VAL 10 H VAL 10 -11.112 -10.806 0.096
41 HA VAL 10 HA VAL 10 -8.844 -11.962 -1.388
42 HB VAL 10 HB VAL 10 -11.379 -10.696 -2.430
43 HG11 VAL 10 1HG1 VAL 10 -10.327 -10.252 -4.332
44 HG12 VAL 10 2HG1 VAL 10 -8.811 -10.831 -3.637
45 HG13 VAL 10 3HG1 VAL 10 -9.880 -11.951 -4.484
46 HG21 VAL 10 3HG2 VAL 10 -12.068 -12.815 -2.023
47 HG22 VAL 10 1HG2 VAL 10 -11.272 -13.121 -3.567
48 HG23 VAL 10 2HG2 VAL 10 -10.432 -13.471 -2.056
49 H LYS 11 H LYS 11 -7.177 -10.683 -1.827
50 HA LYS 11 HA LYS 11 -7.594 -7.768 -1.828
51 HB2 LYS 11 1HB LYS 11 -5.195 -9.226 -0.703
52 HB3 LYS 11 2HB LYS 11 -5.410 -7.481 -0.760
53 HG2 LYS 11 1HG LYS 11 -7.596 -8.054 0.600
54 HG3 LYS 11 2HG LYS 11 -6.668 -9.494 1.023
55 HD2 LYS 11 1HD LYS 11 -5.986 -8.105 2.701
56 HD3 LYS 11 2HD LYS 11 -4.780 -7.692 1.480
57 HE2 LYS 11 1HE LYS 11 -7.371 -6.194 1.732
58 HE3 LYS 11 2HE LYS 11 -5.952 -5.767 2.686
59 HZ1 LYS 11 3HZ LYS 11 -4.873 -5.860 0.275
60 HZ2 LYS 11 1HZ LYS 11 -5.566 -4.453 0.911
61 HZ3 LYS 11 2HZ LYS 11 -6.447 -5.421 -0.161
62 HA PRO 12 HA PRO 12 -5.685 -9.089 -5.829
63 HB2 PRO 12 1HB PRO 12 -7.199 -7.429 -7.353
64 HB3 PRO 12 2HB PRO 12 -7.732 -9.044 -6.871
65 HG2 PRO 12 1HG PRO 12 -8.427 -6.387 -5.681
66 HG3 PRO 12 2HG PRO 12 -9.483 -7.770 -6.023
67 HD2 PRO 12 1HD PRO 12 -8.538 -7.237 -3.542
68 HD3 PRO 12 2HD PRO 12 -8.845 -8.890 -4.112
69 H TYR 13 H TYR 13 -6.738 -5.770 -5.037
70 HA TYR 13 HA TYR 13 -4.759 -4.454 -6.521
71 HB2 TYR 13 1HB TYR 13 -5.931 -3.327 -3.989
72 HB3 TYR 13 2HB TYR 13 -5.454 -2.474 -5.453
73 HD1 TYR 13 HD1 TYR 13 -6.801 -3.192 -7.621
74 HD2 TYR 13 HD2 TYR 13 -8.180 -3.706 -3.629
75 HE1 TYR 13 HE1 TYR 13 -9.118 -3.296 -8.441
76 HE2 TYR 13 HE2 TYR 13 -10.500 -3.812 -4.438
77 HH TYR 13 HH TYR 13 -11.627 -2.737 -6.938
78 H MET 14 H MET 14 -2.662 -4.938 -6.253
79 HA MET 14 HA MET 14 -1.502 -4.479 -3.602
80 HB2 MET 14 1HB MET 14 -1.796 -6.935 -3.950
81 HB3 MET 14 2HB MET 14 -0.744 -6.821 -5.354
82 HG2 MET 14 1HG MET 14 1.106 -6.147 -3.980
83 HG3 MET 14 2HG MET 14 0.068 -6.069 -2.558
84 HE1 MET 14 3HE MET 14 1.306 -8.348 -0.872
85 HE2 MET 14 1HE MET 14 2.585 -8.878 -1.965
86 HE3 MET 14 2HE MET 14 2.203 -7.162 -1.822
87 H CYS 15 H CYS 15 0.534 -3.575 -3.608
88 HA CYS 15 HA CYS 15 1.363 -2.409 -6.138
89 HB2 CYS 15 1HB CYS 15 1.306 -0.855 -4.345
90 HB3 CYS 15 2HB CYS 15 2.175 -1.947 -3.271
91 H ASN 16 H ASN 16 3.596 -2.440 -6.833
92 HA ASN 16 HA ASN 16 4.921 -4.976 -6.139
93 HB2 ASN 16 1HB ASN 16 5.413 -3.414 -8.666
94 HB3 ASN 16 2HB ASN 16 5.748 -5.113 -8.345
95 HD21 ASN 16 1HD2 ASN 16 3.624 -2.941 -9.721
96 HD22 ASN 16 2HD2 ASN 16 2.277 -3.999 -9.953
97 H GLU 17 H GLU 17 5.321 -1.530 -6.470
98 HA GLU 17 HA GLU 17 8.082 -1.287 -6.478
99 HB2 GLU 17 1HB GLU 17 5.911 0.440 -5.316
100 HB3 GLU 17 2HB GLU 17 7.604 0.892 -5.184
101 HG2 GLU 17 1HG GLU 17 6.858 2.031 -7.064
102 HG3 GLU 17 2HG GLU 17 7.691 0.623 -7.721
103 H CYS 18 H CYS 18 5.907 -1.413 -3.661
104 HA CYS 18 HA CYS 18 8.245 -2.089 -1.999
105 HB2 CYS 18 1HB CYS 18 6.992 -1.196 -0.087
106 HB3 CYS 18 2HB CYS 18 7.185 0.021 -1.344
107 H GLY 19 H GLY 19 4.783 -2.747 -2.468
108 HA2 GLY 19 1HA GLY 19 4.115 -5.098 -2.630
109 HA3 GLY 19 2HA GLY 19 5.261 -5.436 -1.342
110 H LYS 20 H LYS 20 2.587 -3.125 -1.830
111 HA LYS 20 HA LYS 20 1.548 -3.950 0.802
112 HB2 LYS 20 1HB LYS 20 2.460 -1.549 0.472
113 HB3 LYS 20 2HB LYS 20 0.986 -1.275 -0.447
114 HG2 LYS 20 1HG LYS 20 -0.362 -1.433 1.401
115 HG3 LYS 20 2HG LYS 20 0.786 -2.440 2.286
116 HD2 LYS 20 1HD LYS 20 2.290 -0.439 2.428
117 HD3 LYS 20 2HD LYS 20 0.973 0.521 1.749
118 HE2 LYS 20 1HE LYS 20 0.656 0.840 4.008
119 HE3 LYS 20 2HE LYS 20 -0.413 -0.527 3.695
120 HZ1 LYS 20 3HZ LYS 20 0.894 -1.934 4.858
121 HZ2 LYS 20 1HZ LYS 20 1.353 -0.514 5.654
122 HZ3 LYS 20 2HZ LYS 20 2.334 -1.154 4.434
123 H ALA 21 H ALA 21 -0.506 -4.645 0.921
124 HA ALA 21 HA ALA 21 -2.022 -4.810 -1.568
125 HB1 ALA 21 3HB ALA 21 -3.249 -6.557 -0.587
126 HB2 ALA 21 1HB ALA 21 -1.587 -6.805 -0.050
127 HB3 ALA 21 2HB ALA 21 -2.771 -6.089 1.045
128 H PHE 22 H PHE 22 -4.261 -4.257 -1.667
129 HA PHE 22 HA PHE 22 -5.307 -2.552 0.455
130 HB2 PHE 22 1HB PHE 22 -5.201 -1.589 -2.408
131 HB3 PHE 22 2HB PHE 22 -5.784 -0.698 -1.006
132 HD1 PHE 22 HD2 PHE 22 -2.824 -1.912 -2.782
133 HD2 PHE 22 HD1 PHE 22 -4.256 0.331 0.540
134 HE1 PHE 22 HE2 PHE 22 -0.573 -0.977 -2.447
135 HE2 PHE 22 HE1 PHE 22 -2.008 1.270 0.880
136 HZ PHE 22 HZ PHE 22 -0.162 0.616 -0.614
137 H SER 23 H SER 23 -7.534 -2.466 0.544
138 HA SER 23 HA SER 23 -8.905 -4.517 -0.990
139 HB2 SER 23 1HB SER 23 -9.113 -4.007 1.581
140 HB3 SER 23 2HB SER 23 -10.277 -2.796 1.044
141 HG SER 23 HG SER 23 -11.201 -4.664 -0.197
142 H VAL 24 H VAL 24 -8.446 -1.158 -1.105
143 HA VAL 24 HA VAL 24 -10.816 -0.821 -2.825
144 HB VAL 24 HB VAL 24 -9.266 1.382 -1.465
145 HG11 VAL 24 1HG1 VAL 24 -11.389 2.650 -1.954
146 HG12 VAL 24 2HG1 VAL 24 -10.418 2.217 -3.363
147 HG13 VAL 24 3HG1 VAL 24 -11.869 1.293 -2.972
148 HG21 VAL 24 3HG2 VAL 24 -11.667 -0.174 -0.564
149 HG22 VAL 24 1HG2 VAL 24 -10.199 0.219 0.332
150 HG23 VAL 24 2HG2 VAL 24 -11.384 1.478 -0.016
151 H TYR 25 H TYR 25 -10.424 -0.662 -4.924
152 HA TYR 25 HA TYR 25 -7.950 -0.745 -6.130
153 HB2 TYR 25 1HB TYR 25 -9.949 -1.255 -7.379
154 HB3 TYR 25 2HB TYR 25 -10.546 0.389 -7.185
155 HD1 TYR 25 HD2 TYR 25 -7.659 -1.488 -8.625
156 HD2 TYR 25 HD1 TYR 25 -10.183 1.928 -8.881
157 HE1 TYR 25 HE2 TYR 25 -6.575 -0.852 -10.739
158 HE2 TYR 25 HE1 TYR 25 -9.106 2.573 -10.996
159 HH TYR 25 HH TYR 25 -6.329 1.677 -11.994
160 H SER 26 H SER 26 -9.848 2.076 -5.197
161 HA SER 26 HA SER 26 -8.241 4.021 -6.459
162 HB2 SER 26 1HB SER 26 -10.447 4.633 -5.740
163 HB3 SER 26 2HB SER 26 -10.089 4.188 -4.072
164 HG SER 26 HG SER 26 -8.711 6.231 -5.472
165 H SER 27 H SER 27 -8.091 2.489 -3.294
166 HA SER 27 HA SER 27 -6.174 4.161 -2.115
167 HB2 SER 27 1HB SER 27 -6.971 1.296 -1.660
168 HB3 SER 27 2HB SER 27 -5.643 2.020 -0.752
169 HG SER 27 HG SER 27 -7.046 3.487 0.122
170 H LEU 28 H LEU 28 -5.822 1.259 -4.106
171 HA LEU 28 HA LEU 28 -3.056 0.936 -3.872
172 HB2 LEU 28 1HB LEU 28 -4.224 -0.838 -4.835
173 HB3 LEU 28 2HB LEU 28 -5.046 0.210 -5.989
174 HG LEU 28 HG LEU 28 -2.887 0.505 -7.180
175 HD11 LEU 28 1HD1 LEU 28 -1.030 -0.963 -6.682
176 HD12 LEU 28 2HD1 LEU 28 -1.916 -1.668 -5.330
177 HD13 LEU 28 3HD1 LEU 28 -1.415 0.022 -5.269
178 HD21 LEU 28 3HD2 LEU 28 -4.526 -1.149 -7.922
179 HD22 LEU 28 1HD2 LEU 28 -3.804 -2.350 -6.851
180 HD23 LEU 28 2HD2 LEU 28 -2.877 -1.708 -8.208
181 H THR 29 H THR 29 -4.966 2.870 -6.139
182 HA THR 29 HA THR 29 -2.716 3.771 -7.645
183 HB THR 29 HB THR 29 -4.277 5.413 -8.627
184 HG1 THR 29 HG1 THR 29 -5.922 4.479 -6.526
185 HG21 THR 29 3HG2 THR 29 -5.562 2.693 -8.399
186 HG22 THR 29 1HG2 THR 29 -4.172 3.043 -9.424
187 HG23 THR 29 2HG2 THR 29 -5.716 3.840 -9.729
188 H THR 30 H THR 30 -4.436 4.936 -4.829
189 HA THR 30 HA THR 30 -3.206 7.531 -4.835
190 HB THR 30 HB THR 30 -4.579 6.157 -2.520
191 HG1 THR 30 HG1 THR 30 -5.888 8.014 -4.169
192 HG21 THR 30 3HG2 THR 30 -3.370 8.104 -1.812
193 HG22 THR 30 1HG2 THR 30 -5.082 8.521 -1.871
194 HG23 THR 30 2HG2 THR 30 -4.000 9.048 -3.161
195 H HIS 31 H HIS 31 -2.294 4.405 -3.786
196 HA HIS 31 HA HIS 31 -0.387 5.360 -1.816
197 HB2 HIS 31 1HB HIS 31 -1.195 3.327 -1.101
198 HB3 HIS 31 2HB HIS 31 -1.348 2.690 -2.736
199 HD1 HIS 31 HD1 HIS 31 1.028 2.967 0.109
200 HD2 HIS 31 HD2 HIS 31 1.007 1.538 -3.792
201 HE1 HIS 31 HE1 HIS 31 3.111 1.576 -0.109
202 H GLN 32 H GLN 32 -0.305 3.719 -4.970
203 HA GLN 32 HA GLN 32 2.373 3.391 -5.349
204 HB2 GLN 32 1HB GLN 32 0.191 4.159 -7.265
205 HB3 GLN 32 2HB GLN 32 1.848 3.968 -7.821
206 HG2 GLN 32 1HG GLN 32 1.697 1.662 -6.633
207 HG3 GLN 32 2HG GLN 32 -0.042 1.918 -6.767
208 HE21 GLN 32 1HE2 GLN 32 1.503 -0.133 -8.024
209 HE22 GLN 32 2HE2 GLN 32 1.335 0.075 -9.731
210 H VAL 33 H VAL 33 0.678 6.363 -5.068
211 HA VAL 33 HA VAL 33 2.246 8.142 -6.492
212 HB VAL 33 HB VAL 33 0.982 8.611 -3.788
213 HG11 VAL 33 1HG1 VAL 33 2.753 10.243 -5.047
214 HG12 VAL 33 2HG1 VAL 33 1.219 10.832 -5.691
215 HG13 VAL 33 3HG1 VAL 33 1.488 10.793 -3.948
216 HG21 VAL 33 3HG2 VAL 33 -0.422 9.739 -6.031
217 HG22 VAL 33 1HG2 VAL 33 -0.219 8.000 -6.241
218 HG23 VAL 33 2HG2 VAL 33 -1.003 8.627 -4.791
219 H ILE 34 H ILE 34 2.844 6.655 -3.362
220 HA ILE 34 HA ILE 34 5.004 8.244 -2.544
221 HB ILE 34 HB ILE 34 5.588 6.473 -1.022
222 HG12 ILE 34 1HG1 ILE 34 3.560 4.606 -2.167
223 HG13 ILE 34 2HG1 ILE 34 5.126 4.720 -2.964
224 HG21 ILE 34 1HG2 ILE 34 2.753 7.195 -1.428
225 HG22 ILE 34 2HG2 ILE 34 3.077 5.871 -0.311
226 HG23 ILE 34 3HG2 ILE 34 3.804 7.454 -0.036
227 HD11 ILE 34 3HD1 ILE 34 4.561 3.899 -0.132
228 HD12 ILE 34 1HD1 ILE 34 5.230 2.917 -1.435
229 HD13 ILE 34 2HD1 ILE 34 6.179 4.235 -0.747
230 H HIS 35 H HIS 35 4.771 6.218 -5.190
231 HA HIS 35 HA HIS 35 7.688 5.815 -5.282
232 HB2 HIS 35 1HB HIS 35 5.552 4.302 -6.797
233 HB3 HIS 35 2HB HIS 35 7.281 3.972 -6.829
234 HD1 HIS 35 HD1 HIS 35 8.257 3.418 -4.265
235 HD2 HIS 35 HD2 HIS 35 4.235 2.730 -5.046
236 HE1 HIS 35 HE1 HIS 35 7.490 1.819 -2.482
237 H THR 36 H THR 36 4.946 7.244 -6.820
238 HA THR 36 HA THR 36 6.085 7.665 -9.386
239 HB THR 36 HB THR 36 4.296 9.345 -9.694
240 HG1 THR 36 HG1 THR 36 2.971 9.890 -8.011
241 HG21 THR 36 3HG2 THR 36 4.024 6.658 -9.546
242 HG22 THR 36 1HG2 THR 36 2.724 7.752 -10.017
243 HG23 THR 36 2HG2 THR 36 2.827 7.167 -8.356
244 H GLY 37 H GLY 37 8.189 8.472 -8.999
245 HA2 GLY 37 1HA GLY 37 8.452 11.256 -9.113
246 HA3 GLY 37 2HA GLY 37 8.756 10.762 -7.454
247 H GLU 38 H GLU 38 9.907 8.183 -8.281
248 HA GLU 38 HA GLU 38 11.890 7.261 -8.946
249 HB2 GLU 38 1HB GLU 38 11.473 8.738 -11.019
250 HB3 GLU 38 2HB GLU 38 12.634 9.843 -10.297
251 HG2 GLU 38 1HG GLU 38 13.734 8.436 -11.906
252 HG3 GLU 38 2HG GLU 38 14.311 8.052 -10.286
253 H LYS 39 H LYS 39 11.509 8.773 -6.499
254 HA LYS 39 HA LYS 39 14.188 9.885 -6.040
255 HB2 LYS 39 1HB LYS 39 11.771 10.034 -4.232
256 HB3 LYS 39 2HB LYS 39 13.276 10.927 -4.060
257 HG2 LYS 39 1HG LYS 39 11.499 11.224 -6.461
258 HG3 LYS 39 2HG LYS 39 11.294 12.191 -4.999
259 HD2 LYS 39 1HD LYS 39 12.671 13.581 -6.173
260 HD3 LYS 39 2HD LYS 39 13.889 12.601 -5.353
261 HE2 LYS 39 1HE LYS 39 13.570 11.090 -7.511
262 HE3 LYS 39 2HE LYS 39 13.065 12.629 -8.208
263 HZ1 LYS 39 3HZ LYS 39 15.173 13.589 -7.487
264 HZ2 LYS 39 1HZ LYS 39 15.422 12.276 -8.524
265 HZ3 LYS 39 2HZ LYS 39 15.657 12.095 -6.859
266 HA PRO 40 HA PRO 40 15.441 6.340 -3.754
267 HB2 PRO 40 1HB PRO 40 17.319 7.479 -2.160
268 HB3 PRO 40 2HB PRO 40 17.571 7.190 -3.885
269 HG2 PRO 40 1HG PRO 40 16.790 9.717 -2.482
270 HG3 PRO 40 2HG PRO 40 17.956 9.482 -3.798
271 HD2 PRO 40 1HD PRO 40 15.449 10.412 -4.222
272 HD3 PRO 40 2HD PRO 40 16.312 9.417 -5.412
273 H SER 41 H SER 41 13.685 5.750 -2.504
274 HA SER 41 HA SER 41 13.871 6.320 0.295
275 HB2 SER 41 1HB SER 41 12.619 8.313 -0.499
276 HB3 SER 41 2HB SER 41 11.376 7.245 -1.151
277 HG SER 41 HG SER 41 11.324 6.414 1.134
278 H GLY 42 H GLY 42 12.594 4.915 1.577
279 HA2 GLY 42 1HA GLY 42 10.649 3.150 0.569
280 HA3 GLY 42 2HA GLY 42 12.213 2.350 0.508
281 HA PRO 43 HA PRO 43 10.182 2.407 4.870
282 HB2 PRO 43 1HB PRO 43 8.746 0.104 4.795
283 HB3 PRO 43 2HB PRO 43 8.061 1.678 4.373
284 HG2 PRO 43 1HG PRO 43 9.084 -0.486 2.575
285 HG3 PRO 43 2HG PRO 43 7.623 0.507 2.412
286 HD2 PRO 43 1HD PRO 43 9.893 1.015 1.026
287 HD3 PRO 43 2HD PRO 43 8.787 2.300 1.551
288 H SER 44 H SER 44 11.167 -0.393 2.910
289 HA SER 44 HA SER 44 13.010 -1.155 5.073
290 HB2 SER 44 1HB SER 44 11.338 -3.069 3.425
291 HB3 SER 44 2HB SER 44 12.539 -3.529 4.632
292 HG SER 44 HG SER 44 10.531 -1.774 5.434
293 H SER 45 H SER 45 14.596 -2.901 4.173
294 HA SER 45 HA SER 45 15.372 -2.210 1.422
295 HB2 SER 45 1HB SER 45 17.725 -2.072 2.109
296 HB3 SER 45 2HB SER 45 16.751 -0.884 2.975
297 HG SER 45 HG SER 45 17.188 -1.860 4.788
298 H GLY 46 H GLY 46 14.635 -4.191 0.655
299 HA2 GLY 46 1HA GLY 46 15.990 -6.249 0.012
300 HA3 GLY 46 2HA GLY 46 15.990 -6.578 1.739
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -3.498 -31.595 10.347
2 HA2 GLY 1 1HA GLY 1 -1.500 -30.696 11.306
3 HA3 GLY 1 2HA GLY 1 -0.681 -30.974 9.777
4 H SER 2 H SER 2 0.075 -28.793 9.884
5 HA SER 2 HA SER 2 -1.225 -26.466 10.208
6 HB2 SER 2 1HB SER 2 0.899 -27.276 8.264
7 HB3 SER 2 2HB SER 2 0.201 -25.662 8.132
8 HG SER 2 HG SER 2 1.273 -26.734 10.529
9 H SER 3 H SER 3 -2.266 -24.931 8.790
10 HA SER 3 HA SER 3 -3.381 -25.839 6.296
11 HB2 SER 3 1HB SER 3 -4.824 -26.764 8.283
12 HB3 SER 3 2HB SER 3 -5.426 -25.109 8.364
13 HG SER 3 HG SER 3 -6.045 -27.061 6.612
14 H GLY 4 H GLY 4 -4.414 -24.167 5.112
15 HA2 GLY 4 1HA GLY 4 -3.716 -21.484 6.110
16 HA3 GLY 4 2HA GLY 4 -3.863 -21.928 4.416
17 H SER 5 H SER 5 -5.357 -20.388 6.952
18 HA SER 5 HA SER 5 -8.017 -20.692 5.720
19 HB2 SER 5 1HB SER 5 -7.306 -19.906 8.557
20 HB3 SER 5 2HB SER 5 -8.943 -19.975 7.904
21 HG SER 5 HG SER 5 -8.860 -21.975 8.547
22 H SER 6 H SER 6 -8.859 -18.978 4.738
23 HA SER 6 HA SER 6 -7.416 -16.528 4.567
24 HB2 SER 6 1HB SER 6 -9.188 -15.794 3.087
25 HB3 SER 6 2HB SER 6 -8.797 -17.472 2.712
26 HG SER 6 HG SER 6 -10.731 -18.050 3.315
27 H GLY 7 H GLY 7 -8.614 -14.384 4.862
28 HA2 GLY 7 1HA GLY 7 -9.649 -14.355 7.601
29 HA3 GLY 7 2HA GLY 7 -9.037 -12.969 6.711
30 H THR 8 H THR 8 -10.819 -11.682 7.139
31 HA THR 8 HA THR 8 -13.422 -12.612 6.163
32 HB THR 8 HB THR 8 -12.829 -10.075 7.693
33 HG1 THR 8 HG1 THR 8 -13.198 -11.202 9.524
34 HG21 THR 8 3HG2 THR 8 -14.950 -9.609 7.167
35 HG22 THR 8 1HG2 THR 8 -15.417 -10.953 8.207
36 HG23 THR 8 2HG2 THR 8 -15.201 -11.211 6.476
37 H GLY 9 H GLY 9 -11.578 -12.097 4.163
38 HA2 GLY 9 1HA GLY 9 -12.852 -10.675 2.283
39 HA3 GLY 9 2HA GLY 9 -12.022 -9.405 3.170
40 H VAL 10 H VAL 10 -11.529 -9.849 0.486
41 HA VAL 10 HA VAL 10 -8.812 -10.995 0.541
42 HB VAL 10 HB VAL 10 -10.017 -12.405 -0.899
43 HG11 VAL 10 1HG1 VAL 10 -11.397 -11.430 -2.800
44 HG12 VAL 10 2HG1 VAL 10 -12.072 -11.291 -1.176
45 HG13 VAL 10 3HG1 VAL 10 -11.305 -9.896 -1.936
46 HG21 VAL 10 3HG2 VAL 10 -7.906 -11.657 -1.859
47 HG22 VAL 10 1HG2 VAL 10 -9.100 -11.947 -3.125
48 HG23 VAL 10 2HG2 VAL 10 -8.724 -10.297 -2.629
49 H LYS 11 H LYS 11 -7.211 -9.950 -0.730
50 HA LYS 11 HA LYS 11 -7.871 -7.183 -1.497
51 HB2 LYS 11 1HB LYS 11 -5.466 -8.199 0.017
52 HB3 LYS 11 2HB LYS 11 -5.507 -6.620 -0.757
53 HG2 LYS 11 1HG LYS 11 -7.527 -6.093 0.625
54 HG3 LYS 11 2HG LYS 11 -7.239 -7.600 1.498
55 HD2 LYS 11 1HD LYS 11 -5.242 -6.827 2.418
56 HD3 LYS 11 2HD LYS 11 -5.064 -5.558 1.204
57 HE2 LYS 11 1HE LYS 11 -5.762 -4.305 2.983
58 HE3 LYS 11 2HE LYS 11 -7.322 -4.703 2.265
59 HZ1 LYS 11 3HZ LYS 11 -7.871 -5.535 4.232
60 HZ2 LYS 11 1HZ LYS 11 -6.291 -5.398 4.823
61 HZ3 LYS 11 2HZ LYS 11 -6.758 -6.781 3.970
62 HA PRO 12 HA PRO 12 -6.102 -9.230 -5.194
63 HB2 PRO 12 1HB PRO 12 -7.547 -7.753 -6.954
64 HB3 PRO 12 2HB PRO 12 -8.181 -9.206 -6.173
65 HG2 PRO 12 1HG PRO 12 -8.623 -6.330 -5.468
66 HG3 PRO 12 2HG PRO 12 -9.794 -7.662 -5.525
67 HD2 PRO 12 1HD PRO 12 -8.712 -6.771 -3.208
68 HD3 PRO 12 2HD PRO 12 -9.166 -8.469 -3.460
69 H TYR 13 H TYR 13 -6.826 -5.750 -4.891
70 HA TYR 13 HA TYR 13 -4.787 -4.909 -6.661
71 HB2 TYR 13 1HB TYR 13 -5.916 -3.236 -4.423
72 HB3 TYR 13 2HB TYR 13 -5.307 -2.698 -5.984
73 HD1 TYR 13 HD1 TYR 13 -6.620 -3.647 -8.068
74 HD2 TYR 13 HD2 TYR 13 -8.203 -3.402 -4.126
75 HE1 TYR 13 HE1 TYR 13 -8.901 -3.713 -8.986
76 HE2 TYR 13 HE2 TYR 13 -10.488 -3.469 -5.033
77 HH TYR 13 HH TYR 13 -11.338 -4.536 -7.802
78 H MET 14 H MET 14 -2.675 -5.068 -6.358
79 HA MET 14 HA MET 14 -1.591 -4.567 -3.673
80 HB2 MET 14 1HB MET 14 -0.789 -6.802 -5.542
81 HB3 MET 14 2HB MET 14 0.112 -6.346 -4.102
82 HG2 MET 14 1HG MET 14 -1.695 -6.977 -2.682
83 HG3 MET 14 2HG MET 14 -2.763 -7.218 -4.063
84 HE1 MET 14 3HE MET 14 0.941 -9.771 -3.190
85 HE2 MET 14 1HE MET 14 0.775 -8.025 -3.008
86 HE3 MET 14 2HE MET 14 0.063 -9.107 -1.812
87 H CYS 15 H CYS 15 0.668 -3.899 -3.669
88 HA CYS 15 HA CYS 15 1.282 -2.303 -6.047
89 HB2 CYS 15 1HB CYS 15 1.260 -0.956 -4.104
90 HB3 CYS 15 2HB CYS 15 2.162 -2.145 -3.170
91 H ASN 16 H ASN 16 2.881 -2.832 -7.381
92 HA ASN 16 HA ASN 16 4.689 -5.003 -6.597
93 HB2 ASN 16 1HB ASN 16 3.270 -5.092 -8.731
94 HB3 ASN 16 2HB ASN 16 4.371 -3.878 -9.376
95 HD21 ASN 16 1HD2 ASN 16 4.181 -7.129 -8.056
96 HD22 ASN 16 2HD2 ASN 16 5.595 -7.731 -8.845
97 H GLU 17 H GLU 17 5.227 -2.515 -5.471
98 HA GLU 17 HA GLU 17 7.785 -1.884 -6.769
99 HB2 GLU 17 1HB GLU 17 5.680 0.052 -5.836
100 HB3 GLU 17 2HB GLU 17 7.369 0.525 -5.956
101 HG2 GLU 17 1HG GLU 17 6.104 -0.757 -8.315
102 HG3 GLU 17 2HG GLU 17 5.671 0.908 -7.933
103 H CYS 18 H CYS 18 5.834 -1.994 -3.859
104 HA CYS 18 HA CYS 18 8.313 -2.081 -2.277
105 HB2 CYS 18 1HB CYS 18 7.395 -0.720 -0.567
106 HB3 CYS 18 2HB CYS 18 7.049 0.119 -2.076
107 H GLY 19 H GLY 19 4.893 -2.948 -2.502
108 HA2 GLY 19 1HA GLY 19 4.341 -5.304 -2.115
109 HA3 GLY 19 2HA GLY 19 5.476 -5.272 -0.774
110 H LYS 20 H LYS 20 2.526 -3.618 -1.893
111 HA LYS 20 HA LYS 20 1.482 -3.830 0.845
112 HB2 LYS 20 1HB LYS 20 2.408 -1.480 0.043
113 HB3 LYS 20 2HB LYS 20 0.841 -1.389 -0.751
114 HG2 LYS 20 1HG LYS 20 -0.287 -1.677 1.371
115 HG3 LYS 20 2HG LYS 20 1.264 -1.870 2.192
116 HD2 LYS 20 1HD LYS 20 1.885 0.396 1.653
117 HD3 LYS 20 2HD LYS 20 0.432 0.600 0.672
118 HE2 LYS 20 1HE LYS 20 -0.204 1.614 2.637
119 HE3 LYS 20 2HE LYS 20 -0.801 -0.026 2.886
120 HZ1 LYS 20 3HZ LYS 20 0.559 -0.310 4.604
121 HZ2 LYS 20 1HZ LYS 20 0.850 1.356 4.560
122 HZ3 LYS 20 2HZ LYS 20 1.900 0.293 3.767
123 H ALA 21 H ALA 21 -0.615 -4.421 0.990
124 HA ALA 21 HA ALA 21 -2.057 -4.823 -1.543
125 HB1 ALA 21 3HB ALA 21 -1.444 -6.712 0.243
126 HB2 ALA 21 1HB ALA 21 -2.985 -6.181 0.916
127 HB3 ALA 21 2HB ALA 21 -2.903 -6.768 -0.746
128 H PHE 22 H PHE 22 -4.176 -4.160 -1.772
129 HA PHE 22 HA PHE 22 -5.371 -2.651 0.442
130 HB2 PHE 22 1HB PHE 22 -5.474 -1.589 -2.370
131 HB3 PHE 22 2HB PHE 22 -5.813 -0.745 -0.863
132 HD1 PHE 22 HD2 PHE 22 -3.094 -2.241 -2.882
133 HD2 PHE 22 HD1 PHE 22 -4.135 0.439 0.257
134 HE1 PHE 22 HE2 PHE 22 -0.786 -1.391 -2.846
135 HE2 PHE 22 HE1 PHE 22 -1.828 1.294 0.297
136 HZ PHE 22 HZ PHE 22 -0.149 0.378 -1.255
137 H SER 23 H SER 23 -7.640 -2.514 0.403
138 HA SER 23 HA SER 23 -8.898 -4.675 -1.090
139 HB2 SER 23 1HB SER 23 -10.705 -4.513 0.454
140 HB3 SER 23 2HB SER 23 -9.234 -4.319 1.407
141 HG SER 23 HG SER 23 -9.615 -1.980 1.094
142 H VAL 24 H VAL 24 -8.425 -1.381 -1.429
143 HA VAL 24 HA VAL 24 -10.779 -1.145 -3.190
144 HB VAL 24 HB VAL 24 -9.401 1.198 -1.892
145 HG11 VAL 24 1HG1 VAL 24 -11.122 2.485 -2.699
146 HG12 VAL 24 2HG1 VAL 24 -10.984 1.283 -3.984
147 HG13 VAL 24 3HG1 VAL 24 -12.250 1.131 -2.764
148 HG21 VAL 24 3HG2 VAL 24 -11.918 0.750 -0.688
149 HG22 VAL 24 1HG2 VAL 24 -11.024 -0.768 -0.615
150 HG23 VAL 24 2HG2 VAL 24 -10.325 0.701 0.065
151 H TYR 25 H TYR 25 -10.469 -0.430 -5.243
152 HA TYR 25 HA TYR 25 -7.960 -0.707 -6.442
153 HB2 TYR 25 1HB TYR 25 -10.417 -0.665 -7.431
154 HB3 TYR 25 2HB TYR 25 -10.023 1.024 -7.731
155 HD1 TYR 25 HD1 TYR 25 -7.286 1.033 -8.565
156 HD2 TYR 25 HD2 TYR 25 -10.306 -1.841 -9.413
157 HE1 TYR 25 HE1 TYR 25 -6.092 0.394 -10.618
158 HE2 TYR 25 HE2 TYR 25 -9.119 -2.490 -11.467
159 HH TYR 25 HH TYR 25 -7.467 -1.924 -12.896
160 H SER 26 H SER 26 -9.761 2.226 -5.565
161 HA SER 26 HA SER 26 -7.908 4.087 -6.542
162 HB2 SER 26 1HB SER 26 -10.134 4.803 -5.954
163 HB3 SER 26 2HB SER 26 -9.905 4.300 -4.279
164 HG SER 26 HG SER 26 -9.235 6.263 -3.981
165 H SER 27 H SER 27 -8.170 2.492 -3.401
166 HA SER 27 HA SER 27 -6.267 3.928 -1.982
167 HB2 SER 27 1HB SER 27 -7.348 1.153 -1.813
168 HB3 SER 27 2HB SER 27 -5.900 1.531 -0.879
169 HG SER 27 HG SER 27 -7.524 2.073 0.453
170 H LEU 28 H LEU 28 -5.856 1.345 -4.326
171 HA LEU 28 HA LEU 28 -3.114 0.855 -3.847
172 HB2 LEU 28 1HB LEU 28 -4.175 -0.822 -5.034
173 HB3 LEU 28 2HB LEU 28 -4.995 0.315 -6.102
174 HG LEU 28 HG LEU 28 -2.759 0.772 -7.161
175 HD11 LEU 28 1HD1 LEU 28 -1.186 0.072 -5.586
176 HD12 LEU 28 2HD1 LEU 28 -1.126 -1.172 -6.834
177 HD13 LEU 28 3HD1 LEU 28 -1.993 -1.475 -5.329
178 HD21 LEU 28 3HD2 LEU 28 -2.821 -1.890 -7.935
179 HD22 LEU 28 1HD2 LEU 28 -3.729 -0.561 -8.657
180 HD23 LEU 28 2HD2 LEU 28 -4.468 -1.554 -7.401
181 H THR 29 H THR 29 -4.817 3.045 -6.035
182 HA THR 29 HA THR 29 -2.485 3.974 -7.373
183 HB THR 29 HB THR 29 -3.886 5.727 -8.291
184 HG1 THR 29 HG1 THR 29 -5.568 6.437 -7.223
185 HG21 THR 29 3HG2 THR 29 -5.886 3.568 -8.269
186 HG22 THR 29 1HG2 THR 29 -4.253 3.069 -8.708
187 HG23 THR 29 2HG2 THR 29 -5.064 4.338 -9.626
188 H THR 30 H THR 30 -4.536 5.442 -4.853
189 HA THR 30 HA THR 30 -3.138 7.785 -4.453
190 HB THR 30 HB THR 30 -4.408 6.158 -2.244
191 HG1 THR 30 HG1 THR 30 -5.698 8.151 -3.796
192 HG21 THR 30 3HG2 THR 30 -4.486 8.084 -0.991
193 HG22 THR 30 1HG2 THR 30 -4.452 9.136 -2.406
194 HG23 THR 30 2HG2 THR 30 -2.975 8.338 -1.864
195 H HIS 31 H HIS 31 -2.295 4.551 -3.501
196 HA HIS 31 HA HIS 31 -0.250 5.377 -1.641
197 HB2 HIS 31 1HB HIS 31 -1.167 3.310 -1.064
198 HB3 HIS 31 2HB HIS 31 -1.182 2.741 -2.731
199 HD1 HIS 31 HD1 HIS 31 1.218 3.351 0.124
200 HD2 HIS 31 HD2 HIS 31 1.034 1.316 -3.494
201 HE1 HIS 31 HE1 HIS 31 3.293 1.933 0.044
202 H GLN 32 H GLN 32 -0.387 4.114 -4.943
203 HA GLN 32 HA GLN 32 2.322 3.756 -5.414
204 HB2 GLN 32 1HB GLN 32 -0.008 4.423 -7.169
205 HB3 GLN 32 2HB GLN 32 1.614 4.443 -7.848
206 HG2 GLN 32 1HG GLN 32 1.752 2.072 -6.714
207 HG3 GLN 32 2HG GLN 32 -0.003 2.159 -6.858
208 HE21 GLN 32 1HE2 GLN 32 0.045 0.429 -8.330
209 HE22 GLN 32 2HE2 GLN 32 0.531 0.659 -9.972
210 H VAL 33 H VAL 33 0.658 6.632 -4.776
211 HA VAL 33 HA VAL 33 2.007 8.533 -6.295
212 HB VAL 33 HB VAL 33 0.926 8.756 -3.485
213 HG11 VAL 33 1HG1 VAL 33 1.021 11.162 -3.761
214 HG12 VAL 33 2HG1 VAL 33 2.635 10.472 -3.934
215 HG13 VAL 33 3HG1 VAL 33 1.732 10.974 -5.364
216 HG21 VAL 33 3HG2 VAL 33 -0.209 9.441 -6.191
217 HG22 VAL 33 1HG2 VAL 33 -0.811 8.247 -5.041
218 HG23 VAL 33 2HG2 VAL 33 -0.923 9.967 -4.666
219 H ILE 34 H ILE 34 3.049 6.725 -3.513
220 HA ILE 34 HA ILE 34 5.312 8.412 -2.946
221 HB ILE 34 HB ILE 34 5.909 6.850 -1.262
222 HG12 ILE 34 1HG1 ILE 34 3.914 4.901 -2.429
223 HG13 ILE 34 2HG1 ILE 34 5.646 4.829 -2.731
224 HG21 ILE 34 1HG2 ILE 34 4.053 8.116 -0.559
225 HG22 ILE 34 2HG2 ILE 34 2.934 7.167 -1.536
226 HG23 ILE 34 3HG2 ILE 34 3.682 6.452 -0.108
227 HD11 ILE 34 3HD1 ILE 34 5.459 3.334 -1.027
228 HD12 ILE 34 1HD1 ILE 34 5.765 4.808 -0.108
229 HD13 ILE 34 2HD1 ILE 34 4.119 4.194 -0.269
230 H HIS 35 H HIS 35 4.629 6.094 -5.275
231 HA HIS 35 HA HIS 35 7.483 5.472 -5.651
232 HB2 HIS 35 1HB HIS 35 5.051 3.980 -6.656
233 HB3 HIS 35 2HB HIS 35 6.722 3.536 -6.988
234 HD1 HIS 35 HD1 HIS 35 7.907 3.826 -4.166
235 HD2 HIS 35 HD2 HIS 35 4.286 1.964 -4.996
236 HE1 HIS 35 HE1 HIS 35 7.497 2.264 -2.239
237 H THR 36 H THR 36 4.731 7.030 -6.986
238 HA THR 36 HA THR 36 5.402 7.023 -9.716
239 HB THR 36 HB THR 36 4.025 9.159 -9.800
240 HG1 THR 36 HG1 THR 36 4.167 9.995 -7.780
241 HG21 THR 36 3HG2 THR 36 1.903 7.943 -9.091
242 HG22 THR 36 1HG2 THR 36 2.952 6.609 -8.612
243 HG23 THR 36 2HG2 THR 36 2.908 7.136 -10.295
244 H GLY 37 H GLY 37 6.231 9.276 -7.102
245 HA2 GLY 37 1HA GLY 37 8.265 10.442 -8.903
246 HA3 GLY 37 2HA GLY 37 7.352 11.412 -7.758
247 H GLU 38 H GLU 38 9.286 8.413 -7.689
248 HA GLU 38 HA GLU 38 10.691 9.511 -5.343
249 HB2 GLU 38 1HB GLU 38 9.057 7.601 -4.886
250 HB3 GLU 38 2HB GLU 38 10.175 6.574 -5.772
251 HG2 GLU 38 1HG GLU 38 11.950 7.176 -4.174
252 HG3 GLU 38 2HG GLU 38 10.774 8.121 -3.262
253 H LYS 39 H LYS 39 10.999 6.813 -7.659
254 HA LYS 39 HA LYS 39 13.799 6.690 -7.565
255 HB2 LYS 39 1HB LYS 39 11.976 5.065 -8.584
256 HB3 LYS 39 2HB LYS 39 12.349 5.938 -10.065
257 HG2 LYS 39 1HG LYS 39 14.555 4.783 -8.417
258 HG3 LYS 39 2HG LYS 39 13.619 3.752 -9.502
259 HD2 LYS 39 1HD LYS 39 14.720 6.319 -10.545
260 HD3 LYS 39 2HD LYS 39 15.813 4.950 -10.325
261 HE2 LYS 39 1HE LYS 39 15.113 4.651 -12.502
262 HE3 LYS 39 2HE LYS 39 13.981 3.630 -11.617
263 HZ1 LYS 39 3HZ LYS 39 13.144 6.379 -11.972
264 HZ2 LYS 39 1HZ LYS 39 12.259 4.947 -12.135
265 HZ3 LYS 39 2HZ LYS 39 13.249 5.477 -13.400
266 HA PRO 40 HA PRO 40 14.992 10.238 -9.902
267 HB2 PRO 40 1HB PRO 40 17.537 9.482 -10.472
268 HB3 PRO 40 2HB PRO 40 17.035 10.033 -8.870
269 HG2 PRO 40 1HG PRO 40 17.412 7.240 -9.879
270 HG3 PRO 40 2HG PRO 40 17.901 7.945 -8.327
271 HD2 PRO 40 1HD PRO 40 15.684 6.414 -8.600
272 HD3 PRO 40 2HD PRO 40 15.787 7.744 -7.428
273 H SER 41 H SER 41 14.065 10.451 -11.856
274 HA SER 41 HA SER 41 14.069 8.480 -13.876
275 HB2 SER 41 1HB SER 41 12.323 10.146 -13.833
276 HB3 SER 41 2HB SER 41 13.500 11.449 -14.002
277 HG SER 41 HG SER 41 12.256 10.425 -15.943
278 H GLY 42 H GLY 42 15.810 7.812 -14.942
279 HA2 GLY 42 1HA GLY 42 17.539 9.801 -16.200
280 HA3 GLY 42 2HA GLY 42 18.308 8.674 -15.091
281 HA PRO 43 HA PRO 43 18.895 5.948 -18.484
282 HB2 PRO 43 1HB PRO 43 19.205 3.617 -17.127
283 HB3 PRO 43 2HB PRO 43 20.443 4.878 -17.167
284 HG2 PRO 43 1HG PRO 43 18.418 4.278 -15.045
285 HG3 PRO 43 2HG PRO 43 20.135 4.684 -14.870
286 HD2 PRO 43 1HD PRO 43 18.163 6.500 -14.490
287 HD3 PRO 43 2HD PRO 43 19.757 6.943 -15.132
288 H SER 44 H SER 44 18.026 3.913 -19.427
289 HA SER 44 HA SER 44 15.297 3.295 -18.534
290 HB2 SER 44 1HB SER 44 14.437 3.423 -20.789
291 HB3 SER 44 2HB SER 44 15.235 4.950 -20.415
292 HG SER 44 HG SER 44 16.170 4.513 -22.273
293 H SER 45 H SER 45 14.454 1.371 -19.972
294 HA SER 45 HA SER 45 15.760 -0.914 -19.286
295 HB2 SER 45 1HB SER 45 13.977 -0.361 -21.657
296 HB3 SER 45 2HB SER 45 14.561 -1.981 -21.279
297 HG SER 45 HG SER 45 13.331 -2.038 -19.523
298 H GLY 46 H GLY 46 17.373 -2.187 -20.065
299 HA2 GLY 46 1HA GLY 46 19.139 -2.872 -21.376
300 HA3 GLY 46 2HA GLY 46 18.467 -1.914 -22.687
Start of MODEL 15
1 H1 GLY 1 H GLY 1 15.332 -18.992 6.077
2 HA2 GLY 1 1HA GLY 1 14.926 -19.659 3.825
3 HA3 GLY 1 2HA GLY 1 15.885 -21.104 4.113
4 H SER 2 H SER 2 12.861 -20.115 3.512
5 HA SER 2 HA SER 2 11.703 -22.593 4.344
6 HB2 SER 2 1HB SER 2 10.026 -21.730 5.864
7 HB3 SER 2 2HB SER 2 11.620 -21.276 6.466
8 HG SER 2 HG SER 2 11.128 -19.257 5.127
9 H SER 3 H SER 3 9.937 -23.099 3.140
10 HA SER 3 HA SER 3 8.996 -21.029 1.266
11 HB2 SER 3 1HB SER 3 9.248 -24.023 0.941
12 HB3 SER 3 2HB SER 3 8.351 -23.008 -0.188
13 HG SER 3 HG SER 3 10.304 -21.830 -0.520
14 H GLY 4 H GLY 4 7.342 -20.260 2.613
15 HA2 GLY 4 1HA GLY 4 5.043 -22.095 2.811
16 HA3 GLY 4 2HA GLY 4 5.510 -21.105 4.186
17 H SER 5 H SER 5 5.959 -18.675 3.244
18 HA SER 5 HA SER 5 4.673 -16.780 2.941
19 HB2 SER 5 1HB SER 5 4.207 -16.407 0.557
20 HB3 SER 5 2HB SER 5 5.792 -17.150 0.779
21 HG SER 5 HG SER 5 3.677 -18.903 0.444
22 H SER 6 H SER 6 3.125 -18.668 4.255
23 HA SER 6 HA SER 6 0.510 -18.503 2.918
24 HB2 SER 6 1HB SER 6 1.597 -20.357 5.032
25 HB3 SER 6 2HB SER 6 -0.135 -20.207 4.736
26 HG SER 6 HG SER 6 0.109 -21.429 3.057
27 H GLY 7 H GLY 7 -0.453 -16.646 3.490
28 HA2 GLY 7 1HA GLY 7 -0.606 -16.043 6.378
29 HA3 GLY 7 2HA GLY 7 -0.395 -14.781 5.174
30 H THR 8 H THR 8 -2.573 -15.710 7.208
31 HA THR 8 HA THR 8 -4.888 -16.308 5.708
32 HB THR 8 HB THR 8 -6.141 -15.524 7.731
33 HG1 THR 8 HG1 THR 8 -5.094 -14.551 9.341
34 HG21 THR 8 3HG2 THR 8 -5.569 -17.382 9.032
35 HG22 THR 8 1HG2 THR 8 -3.867 -17.293 8.579
36 HG23 THR 8 2HG2 THR 8 -5.065 -17.841 7.406
37 H GLY 9 H GLY 9 -4.990 -14.889 3.945
38 HA2 GLY 9 1HA GLY 9 -6.648 -12.771 3.986
39 HA3 GLY 9 2HA GLY 9 -5.112 -12.029 4.408
40 H VAL 10 H VAL 10 -6.726 -11.519 2.072
41 HA VAL 10 HA VAL 10 -4.666 -11.697 0.093
42 HB VAL 10 HB VAL 10 -5.601 -13.936 -0.179
43 HG11 VAL 10 1HG1 VAL 10 -8.191 -12.442 -0.423
44 HG12 VAL 10 2HG1 VAL 10 -7.985 -14.055 -1.108
45 HG13 VAL 10 3HG1 VAL 10 -7.792 -13.801 0.627
46 HG21 VAL 10 3HG2 VAL 10 -5.825 -13.894 -2.509
47 HG22 VAL 10 1HG2 VAL 10 -6.588 -12.303 -2.496
48 HG23 VAL 10 2HG2 VAL 10 -4.867 -12.460 -2.141
49 H LYS 11 H LYS 11 -4.917 -10.189 -1.507
50 HA LYS 11 HA LYS 11 -7.479 -8.780 -1.700
51 HB2 LYS 11 1HB LYS 11 -4.815 -7.572 -1.016
52 HB3 LYS 11 2HB LYS 11 -6.048 -6.621 -1.834
53 HG2 LYS 11 1HG LYS 11 -6.512 -6.092 0.329
54 HG3 LYS 11 2HG LYS 11 -7.557 -7.501 0.136
55 HD2 LYS 11 1HD LYS 11 -5.959 -8.915 1.223
56 HD3 LYS 11 2HD LYS 11 -4.753 -7.626 1.239
57 HE2 LYS 11 1HE LYS 11 -6.049 -6.350 2.799
58 HE3 LYS 11 2HE LYS 11 -7.406 -7.467 2.661
59 HZ1 LYS 11 3HZ LYS 11 -5.139 -7.613 4.357
60 HZ2 LYS 11 1HZ LYS 11 -5.239 -9.003 3.398
61 HZ3 LYS 11 2HZ LYS 11 -6.546 -8.552 4.373
62 HA PRO 12 HA PRO 12 -6.675 -9.064 -6.022
63 HB2 PRO 12 1HB PRO 12 -8.363 -7.123 -6.891
64 HB3 PRO 12 2HB PRO 12 -8.925 -8.694 -6.309
65 HG2 PRO 12 1HG PRO 12 -8.811 -6.072 -4.869
66 HG3 PRO 12 2HG PRO 12 -10.102 -7.288 -4.879
67 HD2 PRO 12 1HD PRO 12 -8.326 -7.064 -2.847
68 HD3 PRO 12 2HD PRO 12 -9.030 -8.620 -3.333
69 H TYR 13 H TYR 13 -6.667 -5.843 -4.533
70 HA TYR 13 HA TYR 13 -4.858 -4.871 -6.615
71 HB2 TYR 13 1HB TYR 13 -5.916 -3.206 -4.348
72 HB3 TYR 13 2HB TYR 13 -5.409 -2.690 -5.953
73 HD1 TYR 13 HD1 TYR 13 -6.857 -3.515 -7.941
74 HD2 TYR 13 HD2 TYR 13 -8.176 -3.520 -3.896
75 HE1 TYR 13 HE1 TYR 13 -9.192 -3.592 -8.709
76 HE2 TYR 13 HE2 TYR 13 -10.515 -3.598 -4.652
77 HH TYR 13 HH TYR 13 -11.886 -3.683 -6.391
78 H MET 14 H MET 14 -2.739 -4.853 -6.307
79 HA MET 14 HA MET 14 -1.682 -4.503 -3.597
80 HB2 MET 14 1HB MET 14 -1.787 -6.974 -4.373
81 HB3 MET 14 2HB MET 14 -0.453 -6.538 -5.434
82 HG2 MET 14 1HG MET 14 0.836 -5.808 -3.470
83 HG3 MET 14 2HG MET 14 -0.489 -6.329 -2.433
84 HE1 MET 14 3HE MET 14 1.425 -9.172 -1.297
85 HE2 MET 14 1HE MET 14 0.576 -7.650 -1.020
86 HE3 MET 14 2HE MET 14 -0.334 -9.110 -1.409
87 H CYS 15 H CYS 15 0.439 -3.643 -3.506
88 HA CYS 15 HA CYS 15 1.103 -2.031 -5.833
89 HB2 CYS 15 1HB CYS 15 1.028 -0.981 -3.603
90 HB3 CYS 15 2HB CYS 15 2.314 -2.054 -3.060
91 H ASN 16 H ASN 16 2.607 -2.582 -7.257
92 HA ASN 16 HA ASN 16 4.434 -4.773 -6.612
93 HB2 ASN 16 1HB ASN 16 4.546 -5.243 -8.868
94 HB3 ASN 16 2HB ASN 16 2.928 -4.554 -8.766
95 HD21 ASN 16 1HD2 ASN 16 5.351 -4.649 -10.748
96 HD22 ASN 16 2HD2 ASN 16 5.368 -3.040 -11.378
97 H GLU 17 H GLU 17 4.834 -2.082 -5.554
98 HA GLU 17 HA GLU 17 7.439 -1.497 -6.800
99 HB2 GLU 17 1HB GLU 17 5.276 0.346 -5.874
100 HB3 GLU 17 2HB GLU 17 6.949 0.870 -5.743
101 HG2 GLU 17 1HG GLU 17 6.000 -0.227 -8.337
102 HG3 GLU 17 2HG GLU 17 5.512 1.401 -7.871
103 H CYS 18 H CYS 18 5.557 -1.773 -3.861
104 HA CYS 18 HA CYS 18 8.071 -1.818 -2.327
105 HB2 CYS 18 1HB CYS 18 7.014 -0.713 -0.481
106 HB3 CYS 18 2HB CYS 18 6.710 0.255 -1.920
107 H GLY 19 H GLY 19 4.678 -2.865 -2.424
108 HA2 GLY 19 1HA GLY 19 4.320 -5.302 -2.244
109 HA3 GLY 19 2HA GLY 19 5.502 -5.287 -0.944
110 H LYS 20 H LYS 20 2.604 -3.354 -1.705
111 HA LYS 20 HA LYS 20 1.548 -4.076 0.947
112 HB2 LYS 20 1HB LYS 20 1.944 -1.391 -0.271
113 HB3 LYS 20 2HB LYS 20 0.482 -1.641 0.674
114 HG2 LYS 20 1HG LYS 20 1.724 -2.146 2.627
115 HG3 LYS 20 2HG LYS 20 3.233 -2.255 1.718
116 HD2 LYS 20 1HD LYS 20 3.388 -0.155 2.682
117 HD3 LYS 20 2HD LYS 20 2.730 0.213 1.085
118 HE2 LYS 20 1HE LYS 20 0.647 0.717 1.912
119 HE3 LYS 20 2HE LYS 20 0.842 -0.315 3.328
120 HZ1 LYS 20 3HZ LYS 20 1.442 2.462 3.010
121 HZ2 LYS 20 1HZ LYS 20 2.760 1.599 3.628
122 HZ3 LYS 20 2HZ LYS 20 1.270 1.553 4.427
123 H ALA 21 H ALA 21 -0.406 -4.961 0.870
124 HA ALA 21 HA ALA 21 -1.912 -4.863 -1.625
125 HB1 ALA 21 3HB ALA 21 -1.797 -6.677 0.700
126 HB2 ALA 21 1HB ALA 21 -3.372 -6.499 -0.076
127 HB3 ALA 21 2HB ALA 21 -1.980 -7.038 -1.017
128 H PHE 22 H PHE 22 -3.965 -4.051 -1.832
129 HA PHE 22 HA PHE 22 -5.111 -2.689 0.509
130 HB2 PHE 22 1HB PHE 22 -5.050 -1.549 -2.291
131 HB3 PHE 22 2HB PHE 22 -5.704 -0.772 -0.853
132 HD1 PHE 22 HD2 PHE 22 -2.591 -1.937 -2.462
133 HD2 PHE 22 HD1 PHE 22 -4.322 0.442 0.614
134 HE1 PHE 22 HE2 PHE 22 -0.397 -0.913 -2.024
135 HE2 PHE 22 HE1 PHE 22 -2.130 1.470 1.056
136 HZ PHE 22 HZ PHE 22 -0.164 0.792 -0.263
137 H SER 23 H SER 23 -7.329 -2.695 0.670
138 HA SER 23 HA SER 23 -8.692 -4.762 -0.769
139 HB2 SER 23 1HB SER 23 -10.590 -4.245 0.654
140 HB3 SER 23 2HB SER 23 -9.123 -4.254 1.633
141 HG SER 23 HG SER 23 -9.443 -2.230 2.076
142 H VAL 24 H VAL 24 -8.686 -1.245 -0.815
143 HA VAL 24 HA VAL 24 -10.789 -1.189 -2.838
144 HB VAL 24 HB VAL 24 -9.299 1.091 -1.528
145 HG11 VAL 24 1HG1 VAL 24 -11.602 2.153 -2.471
146 HG12 VAL 24 2HG1 VAL 24 -10.064 2.198 -3.334
147 HG13 VAL 24 3HG1 VAL 24 -11.256 0.956 -3.719
148 HG21 VAL 24 3HG2 VAL 24 -10.574 0.456 0.223
149 HG22 VAL 24 1HG2 VAL 24 -11.847 1.294 -0.664
150 HG23 VAL 24 2HG2 VAL 24 -11.693 -0.459 -0.787
151 H TYR 25 H TYR 25 -10.509 -0.333 -4.909
152 HA TYR 25 HA TYR 25 -7.995 -0.893 -6.120
153 HB2 TYR 25 1HB TYR 25 -9.952 -1.280 -7.425
154 HB3 TYR 25 2HB TYR 25 -10.536 0.359 -7.161
155 HD1 TYR 25 HD2 TYR 25 -7.456 -1.288 -8.511
156 HD2 TYR 25 HD1 TYR 25 -10.373 1.777 -8.964
157 HE1 TYR 25 HE2 TYR 25 -6.370 -0.571 -10.598
158 HE2 TYR 25 HE1 TYR 25 -9.295 2.501 -11.053
159 HH TYR 25 HH TYR 25 -6.362 1.900 -11.914
160 H SER 26 H SER 26 -9.794 2.119 -5.540
161 HA SER 26 HA SER 26 -7.897 3.857 -6.666
162 HB2 SER 26 1HB SER 26 -9.934 4.360 -4.484
163 HB3 SER 26 2HB SER 26 -9.035 5.622 -5.325
164 HG SER 26 HG SER 26 -10.845 5.479 -6.490
165 H SER 27 H SER 27 -8.077 2.305 -3.559
166 HA SER 27 HA SER 27 -6.295 3.972 -2.144
167 HB2 SER 27 1HB SER 27 -7.303 1.176 -1.794
168 HB3 SER 27 2HB SER 27 -5.940 1.719 -0.815
169 HG SER 27 HG SER 27 -8.248 3.311 -1.009
170 H LEU 28 H LEU 28 -5.800 1.614 -4.587
171 HA LEU 28 HA LEU 28 -3.044 1.082 -3.915
172 HB2 LEU 28 1HB LEU 28 -4.005 -0.730 -4.961
173 HB3 LEU 28 2HB LEU 28 -4.909 0.272 -6.094
174 HG LEU 28 HG LEU 28 -2.692 0.776 -7.211
175 HD11 LEU 28 1HD1 LEU 28 -1.045 -1.186 -6.792
176 HD12 LEU 28 2HD1 LEU 28 -1.844 -1.286 -5.223
177 HD13 LEU 28 3HD1 LEU 28 -1.037 0.205 -5.708
178 HD21 LEU 28 3HD2 LEU 28 -2.607 -1.666 -8.155
179 HD22 LEU 28 1HD2 LEU 28 -4.011 -0.639 -8.448
180 HD23 LEU 28 2HD2 LEU 28 -4.067 -1.870 -7.186
181 H THR 29 H THR 29 -4.827 3.156 -6.110
182 HA THR 29 HA THR 29 -2.534 4.005 -7.599
183 HB THR 29 HB THR 29 -4.001 5.696 -8.572
184 HG1 THR 29 HG1 THR 29 -5.853 4.815 -6.591
185 HG21 THR 29 3HG2 THR 29 -6.024 3.904 -8.966
186 HG22 THR 29 1HG2 THR 29 -4.710 2.854 -8.438
187 HG23 THR 29 2HG2 THR 29 -4.492 3.903 -9.839
188 H THR 30 H THR 30 -4.487 5.436 -5.000
189 HA THR 30 HA THR 30 -3.075 7.864 -4.824
190 HB THR 30 HB THR 30 -5.347 7.166 -3.746
191 HG1 THR 30 HG1 THR 30 -3.880 9.188 -3.480
192 HG21 THR 30 3HG2 THR 30 -5.352 6.231 -1.651
193 HG22 THR 30 1HG2 THR 30 -3.723 6.794 -1.276
194 HG23 THR 30 2HG2 THR 30 -3.954 5.411 -2.345
195 H HIS 31 H HIS 31 -2.281 4.688 -3.801
196 HA HIS 31 HA HIS 31 -0.347 5.559 -1.820
197 HB2 HIS 31 1HB HIS 31 -1.397 3.540 -1.222
198 HB3 HIS 31 2HB HIS 31 -1.235 2.873 -2.844
199 HD1 HIS 31 HD1 HIS 31 0.896 3.721 0.170
200 HD2 HIS 31 HD2 HIS 31 0.993 1.343 -3.235
201 HE1 HIS 31 HE1 HIS 31 2.948 2.288 0.410
202 H GLN 32 H GLN 32 -0.277 3.841 -4.939
203 HA GLN 32 HA GLN 32 2.403 3.493 -5.290
204 HB2 GLN 32 1HB GLN 32 0.162 4.056 -7.171
205 HB3 GLN 32 2HB GLN 32 1.802 4.115 -7.803
206 HG2 GLN 32 1HG GLN 32 2.162 1.821 -6.931
207 HG3 GLN 32 2HG GLN 32 0.462 1.777 -6.467
208 HE21 GLN 32 1HE2 GLN 32 -0.195 0.183 -7.816
209 HE22 GLN 32 2HE2 GLN 32 -0.185 0.311 -9.539
210 H VAL 33 H VAL 33 0.724 6.474 -5.106
211 HA VAL 33 HA VAL 33 2.281 8.202 -6.601
212 HB VAL 33 HB VAL 33 0.908 8.656 -3.954
213 HG11 VAL 33 1HG1 VAL 33 1.117 11.085 -4.503
214 HG12 VAL 33 2HG1 VAL 33 2.640 10.299 -4.084
215 HG13 VAL 33 3HG1 VAL 33 2.260 10.644 -5.772
216 HG21 VAL 33 3HG2 VAL 33 -0.942 8.846 -5.169
217 HG22 VAL 33 1HG2 VAL 33 -0.189 10.092 -6.164
218 HG23 VAL 33 2HG2 VAL 33 -0.026 8.392 -6.606
219 H ILE 34 H ILE 34 2.857 6.944 -3.347
220 HA ILE 34 HA ILE 34 5.119 8.517 -2.757
221 HB ILE 34 HB ILE 34 5.585 6.973 -0.979
222 HG12 ILE 34 1HG1 ILE 34 3.464 5.072 -1.895
223 HG13 ILE 34 2HG1 ILE 34 5.070 4.965 -2.609
224 HG21 ILE 34 1HG2 ILE 34 2.978 6.602 -0.295
225 HG22 ILE 34 2HG2 ILE 34 3.870 8.108 -0.087
226 HG23 ILE 34 3HG2 ILE 34 2.849 7.877 -1.506
227 HD11 ILE 34 3HD1 ILE 34 4.142 4.257 0.089
228 HD12 ILE 34 1HD1 ILE 34 5.413 3.545 -0.905
229 HD13 ILE 34 2HD1 ILE 34 5.723 5.032 -0.007
230 H HIS 35 H HIS 35 4.729 6.219 -5.118
231 HA HIS 35 HA HIS 35 7.600 5.556 -5.124
232 HB2 HIS 35 1HB HIS 35 5.301 4.033 -6.369
233 HB3 HIS 35 2HB HIS 35 7.000 3.584 -6.487
234 HD1 HIS 35 HD1 HIS 35 7.886 3.881 -3.590
235 HD2 HIS 35 HD2 HIS 35 4.293 2.130 -4.722
236 HE1 HIS 35 HE1 HIS 35 7.233 2.387 -1.675
237 H THR 36 H THR 36 5.801 7.810 -6.324
238 HA THR 36 HA THR 36 6.951 7.649 -9.034
239 HB THR 36 HB THR 36 5.082 8.953 -9.885
240 HG1 THR 36 HG1 THR 36 3.955 10.075 -8.501
241 HG21 THR 36 3HG2 THR 36 4.974 6.392 -9.563
242 HG22 THR 36 1HG2 THR 36 3.482 7.254 -9.934
243 HG23 THR 36 2HG2 THR 36 3.823 6.754 -8.277
244 H GLY 37 H GLY 37 8.361 8.718 -6.859
245 HA2 GLY 37 1HA GLY 37 8.771 11.419 -7.841
246 HA3 GLY 37 2HA GLY 37 8.252 11.306 -6.166
247 H GLU 38 H GLU 38 10.638 9.741 -8.310
248 HA GLU 38 HA GLU 38 12.428 8.909 -6.390
249 HB2 GLU 38 1HB GLU 38 12.428 8.603 -8.980
250 HB3 GLU 38 2HB GLU 38 13.424 10.051 -8.978
251 HG2 GLU 38 1HG GLU 38 14.167 7.774 -7.210
252 HG3 GLU 38 2HG GLU 38 14.512 7.681 -8.936
253 H LYS 39 H LYS 39 12.838 10.277 -4.714
254 HA LYS 39 HA LYS 39 13.657 13.012 -5.193
255 HB2 LYS 39 1HB LYS 39 13.709 13.229 -2.784
256 HB3 LYS 39 2HB LYS 39 12.227 12.411 -3.261
257 HG2 LYS 39 1HG LYS 39 13.628 10.249 -2.811
258 HG3 LYS 39 2HG LYS 39 14.607 11.341 -1.828
259 HD2 LYS 39 1HD LYS 39 11.619 11.180 -1.543
260 HD3 LYS 39 2HD LYS 39 12.705 10.105 -0.659
261 HE2 LYS 39 1HE LYS 39 13.622 11.846 0.577
262 HE3 LYS 39 2HE LYS 39 13.110 13.070 -0.584
263 HZ1 LYS 39 3HZ LYS 39 10.805 11.847 0.340
264 HZ2 LYS 39 1HZ LYS 39 11.347 13.412 0.688
265 HZ3 LYS 39 2HZ LYS 39 11.757 12.128 1.710
266 HA PRO 40 HA PRO 40 18.001 12.354 -5.271
267 HB2 PRO 40 1HB PRO 40 18.869 14.695 -4.205
268 HB3 PRO 40 2HB PRO 40 18.193 14.573 -5.834
269 HG2 PRO 40 1HG PRO 40 16.876 15.465 -3.297
270 HG3 PRO 40 2HG PRO 40 16.769 16.170 -4.921
271 HD2 PRO 40 1HD PRO 40 14.839 14.570 -3.896
272 HD3 PRO 40 2HD PRO 40 15.221 14.616 -5.630
273 H SER 41 H SER 41 16.233 12.333 -2.471
274 HA SER 41 HA SER 41 18.589 12.037 -0.740
275 HB2 SER 41 1HB SER 41 16.738 13.634 -0.077
276 HB3 SER 41 2HB SER 41 15.702 12.223 0.137
277 HG SER 41 HG SER 41 16.830 13.004 2.065
278 H GLY 42 H GLY 42 19.124 10.118 0.128
279 HA2 GLY 42 1HA GLY 42 17.200 7.897 -0.151
280 HA3 GLY 42 2HA GLY 42 18.875 7.709 -0.649
281 HA PRO 43 HA PRO 43 20.002 6.390 3.371
282 HB2 PRO 43 1HB PRO 43 22.466 7.487 3.678
283 HB3 PRO 43 2HB PRO 43 22.146 6.136 2.585
284 HG2 PRO 43 1HG PRO 43 22.405 9.053 1.965
285 HG3 PRO 43 2HG PRO 43 23.063 7.660 1.087
286 HD2 PRO 43 1HD PRO 43 20.827 8.961 0.288
287 HD3 PRO 43 2HD PRO 43 21.062 7.220 0.031
288 H SER 44 H SER 44 19.512 9.672 2.706
289 HA SER 44 HA SER 44 20.335 11.066 4.908
290 HB2 SER 44 1HB SER 44 19.161 12.091 2.998
291 HB3 SER 44 2HB SER 44 17.652 11.349 3.530
292 HG SER 44 HG SER 44 17.434 12.868 4.964
293 H SER 45 H SER 45 17.400 9.096 4.619
294 HA SER 45 HA SER 45 16.511 9.624 7.278
295 HB2 SER 45 1HB SER 45 15.705 7.728 5.104
296 HB3 SER 45 2HB SER 45 15.101 7.467 6.741
297 HG SER 45 HG SER 45 13.671 8.782 5.598
298 H GLY 46 H GLY 46 18.183 6.901 5.729
299 HA2 GLY 46 1HA GLY 46 19.175 6.113 8.378
300 HA3 GLY 46 2HA GLY 46 18.367 4.906 7.389
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -15.266 -14.180 20.463
2 HA2 GLY 1 1HA GLY 1 -17.676 -13.367 19.297
3 HA3 GLY 1 2HA GLY 1 -16.156 -12.493 19.187
4 H SER 2 H SER 2 -16.366 -11.863 17.068
5 HA SER 2 HA SER 2 -16.860 -13.870 15.023
6 HB2 SER 2 1HB SER 2 -16.731 -11.901 13.465
7 HB3 SER 2 2HB SER 2 -17.978 -11.761 14.705
8 HG SER 2 HG SER 2 -16.655 -9.851 14.401
9 H SER 3 H SER 3 -15.052 -15.156 14.956
10 HA SER 3 HA SER 3 -12.413 -13.988 14.771
11 HB2 SER 3 1HB SER 3 -12.749 -16.095 15.998
12 HB3 SER 3 2HB SER 3 -13.299 -16.873 14.514
13 HG SER 3 HG SER 3 -11.167 -17.363 14.681
14 H GLY 4 H GLY 4 -13.900 -13.007 12.717
15 HA2 GLY 4 1HA GLY 4 -12.771 -14.424 10.382
16 HA3 GLY 4 2HA GLY 4 -14.368 -13.692 10.347
17 H SER 5 H SER 5 -11.067 -13.225 9.787
18 HA SER 5 HA SER 5 -11.043 -10.364 10.045
19 HB2 SER 5 1HB SER 5 -8.809 -10.493 9.070
20 HB3 SER 5 2HB SER 5 -8.991 -11.730 10.315
21 HG SER 5 HG SER 5 -8.395 -12.034 7.722
22 H SER 6 H SER 6 -13.212 -10.963 8.538
23 HA SER 6 HA SER 6 -14.213 -10.778 6.472
24 HB2 SER 6 1HB SER 6 -13.800 -8.438 7.232
25 HB3 SER 6 2HB SER 6 -12.295 -8.441 6.313
26 HG SER 6 HG SER 6 -14.613 -9.179 4.960
27 H GLY 7 H GLY 7 -11.945 -12.564 6.445
28 HA2 GLY 7 1HA GLY 7 -10.478 -13.583 4.989
29 HA3 GLY 7 2HA GLY 7 -11.702 -13.180 3.795
30 H THR 8 H THR 8 -8.671 -12.217 5.242
31 HA THR 8 HA THR 8 -8.335 -10.158 3.170
32 HB THR 8 HB THR 8 -6.200 -9.723 4.713
33 HG1 THR 8 HG1 THR 8 -6.901 -10.056 6.929
34 HG21 THR 8 3HG2 THR 8 -7.372 -7.922 5.697
35 HG22 THR 8 1HG2 THR 8 -8.908 -8.785 5.637
36 HG23 THR 8 2HG2 THR 8 -8.164 -8.205 4.147
37 H GLY 9 H GLY 9 -7.369 -10.927 1.402
38 HA2 GLY 9 1HA GLY 9 -4.730 -11.823 1.366
39 HA3 GLY 9 2HA GLY 9 -5.755 -13.251 1.341
40 H VAL 10 H VAL 10 -7.793 -12.653 -0.262
41 HA VAL 10 HA VAL 10 -6.761 -12.914 -2.836
42 HB VAL 10 HB VAL 10 -9.059 -13.583 -2.137
43 HG11 VAL 10 1HG1 VAL 10 -9.521 -10.611 -2.262
44 HG12 VAL 10 2HG1 VAL 10 -10.824 -11.799 -2.324
45 HG13 VAL 10 3HG1 VAL 10 -9.791 -11.694 -0.897
46 HG21 VAL 10 3HG2 VAL 10 -9.352 -13.763 -4.332
47 HG22 VAL 10 1HG2 VAL 10 -9.909 -12.091 -4.379
48 HG23 VAL 10 2HG2 VAL 10 -8.201 -12.458 -4.616
49 H LYS 11 H LYS 11 -6.990 -10.145 -0.929
50 HA LYS 11 HA LYS 11 -7.671 -8.005 -2.344
51 HB2 LYS 11 1HB LYS 11 -5.161 -8.463 -0.757
52 HB3 LYS 11 2HB LYS 11 -5.477 -6.905 -1.508
53 HG2 LYS 11 1HG LYS 11 -7.498 -6.643 -0.235
54 HG3 LYS 11 2HG LYS 11 -7.335 -8.270 0.429
55 HD2 LYS 11 1HD LYS 11 -5.132 -6.286 0.807
56 HD3 LYS 11 2HD LYS 11 -6.570 -6.201 1.827
57 HE2 LYS 11 1HE LYS 11 -6.214 -8.598 2.406
58 HE3 LYS 11 2HE LYS 11 -4.699 -8.544 1.507
59 HZ1 LYS 11 3HZ LYS 11 -5.301 -6.725 3.769
60 HZ2 LYS 11 1HZ LYS 11 -3.806 -6.987 3.021
61 HZ3 LYS 11 2HZ LYS 11 -4.505 -8.205 3.963
62 HA PRO 12 HA PRO 12 -5.444 -8.910 -6.203
63 HB2 PRO 12 1HB PRO 12 -7.115 -7.435 -7.752
64 HB3 PRO 12 2HB PRO 12 -7.478 -9.092 -7.255
65 HG2 PRO 12 1HG PRO 12 -8.455 -6.510 -6.097
66 HG3 PRO 12 2HG PRO 12 -9.357 -8.000 -6.428
67 HD2 PRO 12 1HD PRO 12 -8.487 -7.344 -3.950
68 HD3 PRO 12 2HD PRO 12 -8.616 -9.026 -4.502
69 H TYR 13 H TYR 13 -6.488 -5.847 -4.834
70 HA TYR 13 HA TYR 13 -4.698 -4.306 -6.510
71 HB2 TYR 13 1HB TYR 13 -6.241 -3.336 -4.103
72 HB3 TYR 13 2HB TYR 13 -5.595 -2.372 -5.426
73 HD1 TYR 13 HD1 TYR 13 -6.513 -3.138 -7.829
74 HD2 TYR 13 HD2 TYR 13 -8.504 -3.763 -4.121
75 HE1 TYR 13 HE1 TYR 13 -8.658 -3.326 -9.019
76 HE2 TYR 13 HE2 TYR 13 -10.654 -3.954 -5.301
77 HH TYR 13 HH TYR 13 -11.519 -4.442 -7.483
78 H MET 14 H MET 14 -2.673 -5.189 -5.945
79 HA MET 14 HA MET 14 -1.705 -4.332 -3.299
80 HB2 MET 14 1HB MET 14 -0.889 -6.805 -4.834
81 HB3 MET 14 2HB MET 14 -0.148 -6.255 -3.337
82 HG2 MET 14 1HG MET 14 -2.147 -6.652 -2.110
83 HG3 MET 14 2HG MET 14 -3.061 -6.948 -3.587
84 HE1 MET 14 3HE MET 14 0.007 -9.622 -1.558
85 HE2 MET 14 1HE MET 14 0.669 -8.758 -2.946
86 HE3 MET 14 2HE MET 14 -0.036 -7.859 -1.602
87 H CYS 15 H CYS 15 0.151 -3.179 -3.252
88 HA CYS 15 HA CYS 15 1.144 -2.112 -5.712
89 HB2 CYS 15 1HB CYS 15 1.030 -0.705 -3.734
90 HB3 CYS 15 2HB CYS 15 2.111 -1.788 -2.864
91 H ASN 16 H ASN 16 2.835 -2.741 -6.895
92 HA ASN 16 HA ASN 16 4.337 -5.077 -6.030
93 HB2 ASN 16 1HB ASN 16 4.124 -3.612 -8.659
94 HB3 ASN 16 2HB ASN 16 5.281 -4.913 -8.396
95 HD21 ASN 16 1HD2 ASN 16 4.635 -6.886 -8.861
96 HD22 ASN 16 2HD2 ASN 16 2.995 -7.406 -9.019
97 H GLU 17 H GLU 17 4.770 -1.664 -6.490
98 HA GLU 17 HA GLU 17 7.509 -1.444 -6.791
99 HB2 GLU 17 1HB GLU 17 5.715 0.341 -5.136
100 HB3 GLU 17 2HB GLU 17 7.306 0.769 -5.750
101 HG2 GLU 17 1HG GLU 17 5.115 -0.055 -7.611
102 HG3 GLU 17 2HG GLU 17 5.222 1.597 -7.005
103 H CYS 18 H CYS 18 5.697 -1.448 -3.719
104 HA CYS 18 HA CYS 18 8.201 -2.107 -2.326
105 HB2 CYS 18 1HB CYS 18 7.001 -1.390 -0.270
106 HB3 CYS 18 2HB CYS 18 7.131 -0.110 -1.472
107 H GLY 19 H GLY 19 4.778 -3.024 -2.546
108 HA2 GLY 19 1HA GLY 19 4.348 -5.451 -2.712
109 HA3 GLY 19 2HA GLY 19 5.528 -5.655 -1.426
110 H LYS 20 H LYS 20 2.850 -3.343 -1.749
111 HA LYS 20 HA LYS 20 1.880 -4.234 0.873
112 HB2 LYS 20 1HB LYS 20 2.454 -1.771 0.305
113 HB3 LYS 20 2HB LYS 20 0.928 -1.775 -0.569
114 HG2 LYS 20 1HG LYS 20 -0.324 -1.890 1.331
115 HG3 LYS 20 2HG LYS 20 0.928 -2.743 2.238
116 HD2 LYS 20 1HD LYS 20 2.208 -0.718 2.472
117 HD3 LYS 20 2HD LYS 20 1.095 0.156 1.418
118 HE2 LYS 20 1HE LYS 20 0.287 -1.112 4.029
119 HE3 LYS 20 2HE LYS 20 0.785 0.572 3.872
120 HZ1 LYS 20 3HZ LYS 20 -1.137 0.160 1.934
121 HZ2 LYS 20 1HZ LYS 20 -1.307 1.038 3.370
122 HZ3 LYS 20 2HZ LYS 20 -1.734 -0.598 3.323
123 H ALA 21 H ALA 21 -0.633 -3.793 1.050
124 HA ALA 21 HA ALA 21 -2.005 -4.794 -1.339
125 HB1 ALA 21 3HB ALA 21 -1.547 -6.789 -0.094
126 HB2 ALA 21 1HB ALA 21 -2.155 -6.058 1.392
127 HB3 ALA 21 2HB ALA 21 -3.263 -6.417 0.068
128 H PHE 22 H PHE 22 -4.162 -4.205 -1.513
129 HA PHE 22 HA PHE 22 -5.336 -2.621 0.645
130 HB2 PHE 22 1HB PHE 22 -5.252 -1.596 -2.196
131 HB3 PHE 22 2HB PHE 22 -5.860 -0.756 -0.773
132 HD1 PHE 22 HD2 PHE 22 -2.749 -2.228 -2.182
133 HD2 PHE 22 HD1 PHE 22 -4.481 0.691 0.386
134 HE1 PHE 22 HE2 PHE 22 -0.530 -1.224 -1.834
135 HE2 PHE 22 HE1 PHE 22 -2.265 1.701 0.738
136 HZ PHE 22 HZ PHE 22 -0.286 0.743 -0.372
137 H SER 23 H SER 23 -7.568 -2.625 0.691
138 HA SER 23 HA SER 23 -8.831 -4.787 -0.716
139 HB2 SER 23 1HB SER 23 -9.464 -4.406 1.581
140 HB3 SER 23 2HB SER 23 -9.908 -2.735 1.231
141 HG SER 23 HG SER 23 -11.622 -3.481 -0.004
142 H VAL 24 H VAL 24 -8.792 -1.294 -0.935
143 HA VAL 24 HA VAL 24 -10.812 -1.364 -3.061
144 HB VAL 24 HB VAL 24 -9.587 1.122 -1.887
145 HG11 VAL 24 1HG1 VAL 24 -11.913 1.978 -2.545
146 HG12 VAL 24 2HG1 VAL 24 -10.760 1.648 -3.839
147 HG13 VAL 24 3HG1 VAL 24 -12.046 0.493 -3.486
148 HG21 VAL 24 3HG2 VAL 24 -11.305 -0.780 -0.576
149 HG22 VAL 24 1HG2 VAL 24 -10.562 0.686 0.063
150 HG23 VAL 24 2HG2 VAL 24 -12.120 0.773 -0.758
151 H TYR 25 H TYR 25 -10.429 -0.211 -5.047
152 HA TYR 25 HA TYR 25 -7.759 -0.652 -6.043
153 HB2 TYR 25 1HB TYR 25 -9.559 -1.257 -7.500
154 HB3 TYR 25 2HB TYR 25 -10.300 0.332 -7.345
155 HD1 TYR 25 HD2 TYR 25 -7.016 -1.130 -8.387
156 HD2 TYR 25 HD1 TYR 25 -10.044 1.766 -9.127
157 HE1 TYR 25 HE2 TYR 25 -5.796 -0.373 -10.385
158 HE2 TYR 25 HE1 TYR 25 -8.833 2.530 -11.127
159 HH TYR 25 HH TYR 25 -5.708 1.904 -11.735
160 H SER 26 H SER 26 -9.880 2.127 -5.485
161 HA SER 26 HA SER 26 -8.223 4.106 -6.570
162 HB2 SER 26 1HB SER 26 -10.329 4.189 -4.412
163 HB3 SER 26 2HB SER 26 -9.480 5.638 -4.950
164 HG SER 26 HG SER 26 -10.228 5.124 -7.090
165 H SER 27 H SER 27 -8.245 2.569 -3.415
166 HA SER 27 HA SER 27 -6.429 4.373 -2.175
167 HB2 SER 27 1HB SER 27 -7.508 1.659 -1.517
168 HB3 SER 27 2HB SER 27 -6.121 2.271 -0.617
169 HG SER 27 HG SER 27 -8.664 3.506 -0.880
170 H LEU 28 H LEU 28 -6.069 1.589 -4.216
171 HA LEU 28 HA LEU 28 -3.347 1.036 -3.576
172 HB2 LEU 28 1HB LEU 28 -4.349 -0.781 -4.535
173 HB3 LEU 28 2HB LEU 28 -5.272 0.195 -5.676
174 HG LEU 28 HG LEU 28 -3.175 0.553 -6.970
175 HD11 LEU 28 1HD1 LEU 28 -1.291 0.182 -5.818
176 HD12 LEU 28 2HD1 LEU 28 -1.540 -1.504 -6.268
177 HD13 LEU 28 3HD1 LEU 28 -2.077 -0.924 -4.692
178 HD21 LEU 28 3HD2 LEU 28 -3.380 -1.426 -8.146
179 HD22 LEU 28 1HD2 LEU 28 -4.915 -1.350 -7.280
180 HD23 LEU 28 2HD2 LEU 28 -3.619 -2.391 -6.689
181 H THR 29 H THR 29 -4.962 2.906 -6.108
182 HA THR 29 HA THR 29 -2.594 3.579 -7.523
183 HB THR 29 HB THR 29 -3.978 5.336 -8.602
184 HG1 THR 29 HG1 THR 29 -6.236 4.396 -7.221
185 HG21 THR 29 3HG2 THR 29 -3.997 2.924 -9.326
186 HG22 THR 29 1HG2 THR 29 -5.431 3.848 -9.771
187 HG23 THR 29 2HG2 THR 29 -5.488 2.733 -8.405
188 H THR 30 H THR 30 -4.632 5.475 -5.293
189 HA THR 30 HA THR 30 -3.114 7.788 -5.214
190 HB THR 30 HB THR 30 -5.400 7.233 -4.086
191 HG1 THR 30 HG1 THR 30 -5.186 9.181 -3.230
192 HG21 THR 30 3HG2 THR 30 -3.947 7.109 -1.531
193 HG22 THR 30 1HG2 THR 30 -3.875 5.639 -2.501
194 HG23 THR 30 2HG2 THR 30 -5.437 6.308 -2.029
195 H HIS 31 H HIS 31 -2.412 4.691 -3.898
196 HA HIS 31 HA HIS 31 -0.480 5.654 -1.974
197 HB2 HIS 31 1HB HIS 31 -1.429 3.673 -1.234
198 HB3 HIS 31 2HB HIS 31 -1.460 2.964 -2.846
199 HD1 HIS 31 HD1 HIS 31 0.786 3.494 0.101
200 HD2 HIS 31 HD2 HIS 31 0.858 1.603 -3.597
201 HE1 HIS 31 HE1 HIS 31 2.839 2.042 0.129
202 H GLN 32 H GLN 32 -0.397 3.926 -5.077
203 HA GLN 32 HA GLN 32 2.265 3.462 -5.396
204 HB2 GLN 32 1HB GLN 32 0.225 4.386 -7.412
205 HB3 GLN 32 2HB GLN 32 1.864 3.944 -7.872
206 HG2 GLN 32 1HG GLN 32 1.482 1.710 -6.854
207 HG3 GLN 32 2HG GLN 32 -0.198 2.172 -6.585
208 HE21 GLN 32 1HE2 GLN 32 1.013 0.050 -8.246
209 HE22 GLN 32 2HE2 GLN 32 0.389 0.301 -9.837
210 H VAL 33 H VAL 33 0.717 6.524 -5.208
211 HA VAL 33 HA VAL 33 2.413 8.195 -6.612
212 HB VAL 33 HB VAL 33 1.107 8.774 -3.949
213 HG11 VAL 33 1HG1 VAL 33 2.980 10.313 -4.831
214 HG12 VAL 33 2HG1 VAL 33 1.793 10.808 -6.039
215 HG13 VAL 33 3HG1 VAL 33 1.456 11.042 -4.324
216 HG21 VAL 33 3HG2 VAL 33 -0.179 9.935 -6.245
217 HG22 VAL 33 1HG2 VAL 33 -0.062 8.184 -6.422
218 HG23 VAL 33 2HG2 VAL 33 -0.848 8.876 -5.003
219 H ILE 34 H ILE 34 2.836 6.767 -3.420
220 HA ILE 34 HA ILE 34 5.054 8.241 -2.570
221 HB ILE 34 HB ILE 34 5.514 6.458 -1.019
222 HG12 ILE 34 1HG1 ILE 34 3.433 4.678 -2.205
223 HG13 ILE 34 2HG1 ILE 34 5.023 4.711 -2.959
224 HG21 ILE 34 1HG2 ILE 34 3.067 6.018 -0.230
225 HG22 ILE 34 2HG2 ILE 34 3.719 7.656 -0.215
226 HG23 ILE 34 3HG2 ILE 34 2.653 7.144 -1.523
227 HD11 ILE 34 3HD1 ILE 34 5.168 4.446 -0.075
228 HD12 ILE 34 1HD1 ILE 34 4.257 3.143 -0.838
229 HD13 ILE 34 2HD1 ILE 34 5.914 3.475 -1.344
230 H HIS 35 H HIS 35 4.793 6.150 -5.181
231 HA HIS 35 HA HIS 35 7.698 5.661 -5.208
232 HB2 HIS 35 1HB HIS 35 5.559 4.160 -6.730
233 HB3 HIS 35 2HB HIS 35 7.275 3.770 -6.677
234 HD1 HIS 35 HD1 HIS 35 8.154 3.181 -4.128
235 HD2 HIS 35 HD2 HIS 35 4.090 2.808 -4.905
236 HE1 HIS 35 HE1 HIS 35 7.253 1.706 -2.301
237 H THR 36 H THR 36 4.951 6.877 -7.004
238 HA THR 36 HA THR 36 6.046 7.215 -9.522
239 HB THR 36 HB THR 36 4.470 9.106 -9.812
240 HG1 THR 36 HG1 THR 36 4.427 8.913 -7.024
241 HG21 THR 36 3HG2 THR 36 2.937 7.537 -10.191
242 HG22 THR 36 1HG2 THR 36 2.601 7.422 -8.464
243 HG23 THR 36 2HG2 THR 36 3.854 6.413 -9.187
244 H GLY 37 H GLY 37 6.347 9.282 -6.665
245 HA2 GLY 37 1HA GLY 37 7.839 10.952 -6.162
246 HA3 GLY 37 2HA GLY 37 8.864 10.290 -7.427
247 H GLU 38 H GLU 38 9.183 11.477 -9.200
248 HA GLU 38 HA GLU 38 8.890 13.053 -10.830
249 HB2 GLU 38 1HB GLU 38 6.382 12.294 -10.473
250 HB3 GLU 38 2HB GLU 38 6.235 13.891 -9.754
251 HG2 GLU 38 1HG GLU 38 7.514 13.651 -12.425
252 HG3 GLU 38 2HG GLU 38 5.763 13.486 -12.303
253 H LYS 39 H LYS 39 10.170 13.611 -8.376
254 HA LYS 39 HA LYS 39 10.181 16.473 -8.479
255 HB2 LYS 39 1HB LYS 39 9.623 16.872 -6.130
256 HB3 LYS 39 2HB LYS 39 8.269 16.145 -6.985
257 HG2 LYS 39 1HG LYS 39 8.233 14.901 -5.085
258 HG3 LYS 39 2HG LYS 39 9.329 13.915 -6.056
259 HD2 LYS 39 1HD LYS 39 11.196 14.593 -4.874
260 HD3 LYS 39 2HD LYS 39 10.434 16.087 -4.326
261 HE2 LYS 39 1HE LYS 39 10.616 14.616 -2.450
262 HE3 LYS 39 2HE LYS 39 8.917 14.708 -2.908
263 HZ1 LYS 39 3HZ LYS 39 9.364 12.451 -2.526
264 HZ2 LYS 39 1HZ LYS 39 10.815 12.490 -3.396
265 HZ3 LYS 39 2HZ LYS 39 9.337 12.609 -4.210
266 HA PRO 40 HA PRO 40 14.357 15.750 -7.312
267 HB2 PRO 40 1HB PRO 40 15.003 18.195 -6.323
268 HB3 PRO 40 2HB PRO 40 14.788 17.883 -8.050
269 HG2 PRO 40 1HG PRO 40 12.873 19.089 -6.090
270 HG3 PRO 40 2HG PRO 40 13.239 19.592 -7.751
271 HD2 PRO 40 1HD PRO 40 11.038 18.147 -7.117
272 HD3 PRO 40 2HD PRO 40 11.876 17.978 -8.673
273 H SER 41 H SER 41 15.364 14.893 -5.593
274 HA SER 41 HA SER 41 14.278 15.490 -2.919
275 HB2 SER 41 1HB SER 41 15.512 12.915 -3.926
276 HB3 SER 41 2HB SER 41 14.973 13.204 -2.272
277 HG SER 41 HG SER 41 13.532 12.270 -4.208
278 H GLY 42 H GLY 42 15.831 15.238 -1.124
279 HA2 GLY 42 1HA GLY 42 17.795 15.822 -0.090
280 HA3 GLY 42 2HA GLY 42 18.603 15.075 -1.460
281 HA PRO 43 HA PRO 43 19.086 19.815 -1.343
282 HB2 PRO 43 1HB PRO 43 21.632 19.939 -0.411
283 HB3 PRO 43 2HB PRO 43 20.219 19.978 0.649
284 HG2 PRO 43 1HG PRO 43 22.012 17.680 -0.033
285 HG3 PRO 43 2HG PRO 43 21.345 18.149 1.541
286 HD2 PRO 43 1HD PRO 43 20.289 16.152 0.048
287 HD3 PRO 43 2HD PRO 43 19.299 17.181 1.104
288 H SER 44 H SER 44 20.937 17.072 -2.395
289 HA SER 44 HA SER 44 22.274 18.683 -4.452
290 HB2 SER 44 1HB SER 44 22.792 15.812 -3.641
291 HB3 SER 44 2HB SER 44 23.749 16.761 -4.778
292 HG SER 44 HG SER 44 24.565 17.923 -3.156
293 H SER 45 H SER 45 22.306 17.917 -6.650
294 HA SER 45 HA SER 45 19.725 16.876 -7.451
295 HB2 SER 45 1HB SER 45 20.895 18.832 -8.576
296 HB3 SER 45 2HB SER 45 22.012 17.654 -9.265
297 HG SER 45 HG SER 45 19.216 17.854 -9.670
298 H GLY 46 H GLY 46 23.141 16.000 -7.943
299 HA2 GLY 46 1HA GLY 46 24.076 14.045 -8.754
300 HA3 GLY 46 2HA GLY 46 23.027 13.329 -7.539
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -10.073 9.887 14.138
2 HA2 GLY 1 1HA GLY 1 -8.870 8.315 12.552
3 HA3 GLY 1 2HA GLY 1 -8.666 7.926 14.253
4 H SER 2 H SER 2 -8.792 5.814 14.566
5 HA SER 2 HA SER 2 -10.782 4.288 13.018
6 HB2 SER 2 1HB SER 2 -8.209 3.849 12.744
7 HB3 SER 2 2HB SER 2 -8.390 2.984 14.270
8 HG SER 2 HG SER 2 -9.702 2.475 11.812
9 H SER 3 H SER 3 -12.493 3.987 14.298
10 HA SER 3 HA SER 3 -12.055 3.345 17.130
11 HB2 SER 3 1HB SER 3 -13.581 5.256 16.506
12 HB3 SER 3 2HB SER 3 -14.671 4.066 15.794
13 HG SER 3 HG SER 3 -14.090 4.582 18.468
14 H GLY 4 H GLY 4 -11.338 1.183 16.181
15 HA2 GLY 4 1HA GLY 4 -11.730 -1.064 15.931
16 HA3 GLY 4 2HA GLY 4 -13.234 -0.775 16.793
17 H SER 5 H SER 5 -11.945 -1.897 13.970
18 HA SER 5 HA SER 5 -14.478 -1.444 12.534
19 HB2 SER 5 1HB SER 5 -13.356 -1.171 10.483
20 HB3 SER 5 2HB SER 5 -12.386 -0.238 11.623
21 HG SER 5 HG SER 5 -11.830 -2.712 10.414
22 H SER 6 H SER 6 -14.782 -3.123 10.750
23 HA SER 6 HA SER 6 -13.542 -5.683 11.121
24 HB2 SER 6 1HB SER 6 -15.066 -5.737 13.028
25 HB3 SER 6 2HB SER 6 -16.423 -5.320 11.981
26 HG SER 6 HG SER 6 -15.471 -7.379 10.831
27 H GLY 7 H GLY 7 -13.389 -6.469 9.134
28 HA2 GLY 7 1HA GLY 7 -15.452 -7.084 7.424
29 HA3 GLY 7 2HA GLY 7 -14.973 -5.453 6.980
30 H THR 8 H THR 8 -13.666 -8.713 7.492
31 HA THR 8 HA THR 8 -11.320 -8.126 5.905
32 HB THR 8 HB THR 8 -11.229 -9.660 7.870
33 HG1 THR 8 HG1 THR 8 -10.505 -10.697 5.316
34 HG21 THR 8 3HG2 THR 8 -13.489 -10.747 7.120
35 HG22 THR 8 1HG2 THR 8 -12.262 -11.726 7.924
36 HG23 THR 8 2HG2 THR 8 -12.440 -11.800 6.171
37 H GLY 9 H GLY 9 -11.075 -8.484 3.788
38 HA2 GLY 9 1HA GLY 9 -12.854 -10.386 2.439
39 HA3 GLY 9 2HA GLY 9 -12.837 -8.723 1.871
40 H VAL 10 H VAL 10 -12.199 -9.815 -0.164
41 HA VAL 10 HA VAL 10 -9.573 -10.971 -0.328
42 HB VAL 10 HB VAL 10 -9.940 -11.017 -2.745
43 HG11 VAL 10 1HG1 VAL 10 -12.378 -12.140 -2.515
44 HG12 VAL 10 2HG1 VAL 10 -10.884 -12.927 -2.000
45 HG13 VAL 10 3HG1 VAL 10 -11.895 -12.093 -0.820
46 HG21 VAL 10 3HG2 VAL 10 -11.550 -8.810 -2.292
47 HG22 VAL 10 1HG2 VAL 10 -11.360 -9.674 -3.818
48 HG23 VAL 10 2HG2 VAL 10 -12.687 -10.084 -2.732
49 H LYS 11 H LYS 11 -7.730 -10.084 -1.236
50 HA LYS 11 HA LYS 11 -7.786 -7.173 -1.691
51 HB2 LYS 11 1HB LYS 11 -5.572 -8.754 -0.370
52 HB3 LYS 11 2HB LYS 11 -5.562 -7.022 -0.676
53 HG2 LYS 11 1HG LYS 11 -7.795 -7.141 0.748
54 HG3 LYS 11 2HG LYS 11 -7.003 -8.581 1.391
55 HD2 LYS 11 1HD LYS 11 -5.121 -7.322 2.117
56 HD3 LYS 11 2HD LYS 11 -5.653 -5.893 1.228
57 HE2 LYS 11 1HE LYS 11 -7.534 -5.615 2.700
58 HE3 LYS 11 2HE LYS 11 -7.175 -7.138 3.513
59 HZ1 LYS 11 3HZ LYS 11 -6.432 -5.141 4.742
60 HZ2 LYS 11 1HZ LYS 11 -5.348 -4.799 3.488
61 HZ3 LYS 11 2HZ LYS 11 -5.174 -6.217 4.393
62 HA PRO 12 HA PRO 12 -6.126 -9.285 -5.462
63 HB2 PRO 12 1HB PRO 12 -7.470 -7.702 -7.211
64 HB3 PRO 12 2HB PRO 12 -8.174 -9.157 -6.496
65 HG2 PRO 12 1HG PRO 12 -8.539 -6.292 -5.709
66 HG3 PRO 12 2HG PRO 12 -9.752 -7.579 -5.842
67 HD2 PRO 12 1HD PRO 12 -8.706 -6.801 -3.468
68 HD3 PRO 12 2HD PRO 12 -9.210 -8.473 -3.787
69 H TYR 13 H TYR 13 -6.714 -5.799 -5.005
70 HA TYR 13 HA TYR 13 -4.599 -4.974 -6.708
71 HB2 TYR 13 1HB TYR 13 -5.835 -3.374 -4.464
72 HB3 TYR 13 2HB TYR 13 -5.027 -2.755 -5.900
73 HD1 TYR 13 HD1 TYR 13 -6.120 -3.372 -8.182
74 HD2 TYR 13 HD2 TYR 13 -8.149 -3.569 -4.447
75 HE1 TYR 13 HE1 TYR 13 -8.279 -3.263 -9.355
76 HE2 TYR 13 HE2 TYR 13 -10.313 -3.461 -5.610
77 HH TYR 13 HH TYR 13 -10.487 -3.277 -9.155
78 H MET 14 H MET 14 -2.504 -5.197 -6.336
79 HA MET 14 HA MET 14 -1.498 -4.796 -3.607
80 HB2 MET 14 1HB MET 14 -1.688 -7.271 -4.370
81 HB3 MET 14 2HB MET 14 -0.300 -6.900 -5.384
82 HG2 MET 14 1HG MET 14 0.899 -6.146 -3.329
83 HG3 MET 14 2HG MET 14 -0.461 -6.754 -2.387
84 HE1 MET 14 3HE MET 14 0.251 -8.338 -1.017
85 HE2 MET 14 1HE MET 14 1.035 -9.878 -1.371
86 HE3 MET 14 2HE MET 14 1.999 -8.406 -1.249
87 H CYS 15 H CYS 15 0.487 -3.797 -3.450
88 HA CYS 15 HA CYS 15 1.419 -2.507 -5.899
89 HB2 CYS 15 1HB CYS 15 0.998 -1.005 -4.069
90 HB3 CYS 15 2HB CYS 15 1.983 -1.974 -2.979
91 H ASN 16 H ASN 16 3.107 -3.277 -6.967
92 HA ASN 16 HA ASN 16 4.822 -5.270 -5.751
93 HB2 ASN 16 1HB ASN 16 4.810 -4.119 -8.551
94 HB3 ASN 16 2HB ASN 16 5.793 -5.478 -8.014
95 HD21 ASN 16 1HD2 ASN 16 3.218 -4.804 -9.767
96 HD22 ASN 16 2HD2 ASN 16 2.244 -6.203 -9.484
97 H GLU 17 H GLU 17 4.911 -1.903 -6.541
98 HA GLU 17 HA GLU 17 7.604 -1.386 -6.818
99 HB2 GLU 17 1HB GLU 17 5.584 0.286 -5.313
100 HB3 GLU 17 2HB GLU 17 7.129 0.856 -5.927
101 HG2 GLU 17 1HG GLU 17 5.002 -0.293 -7.706
102 HG3 GLU 17 2HG GLU 17 5.090 1.420 -7.299
103 H CYS 18 H CYS 18 5.744 -1.756 -3.824
104 HA CYS 18 HA CYS 18 8.295 -2.068 -2.382
105 HB2 CYS 18 1HB CYS 18 7.208 -1.067 -0.398
106 HB3 CYS 18 2HB CYS 18 7.299 0.059 -1.749
107 H GLY 19 H GLY 19 4.836 -2.866 -2.431
108 HA2 GLY 19 1HA GLY 19 4.339 -5.293 -2.322
109 HA3 GLY 19 2HA GLY 19 5.509 -5.372 -1.012
110 H LYS 20 H LYS 20 2.647 -3.398 -1.820
111 HA LYS 20 HA LYS 20 1.603 -4.001 0.866
112 HB2 LYS 20 1HB LYS 20 2.010 -1.369 -0.459
113 HB3 LYS 20 2HB LYS 20 0.548 -1.572 0.497
114 HG2 LYS 20 1HG LYS 20 1.728 -1.859 2.474
115 HG3 LYS 20 2HG LYS 20 3.222 -2.281 1.635
116 HD2 LYS 20 1HD LYS 20 3.660 -0.061 1.053
117 HD3 LYS 20 2HD LYS 20 1.992 0.439 1.340
118 HE2 LYS 20 1HE LYS 20 2.264 0.244 3.702
119 HE3 LYS 20 2HE LYS 20 3.836 -0.532 3.515
120 HZ1 LYS 20 3HZ LYS 20 3.622 2.072 2.281
121 HZ2 LYS 20 1HZ LYS 20 4.856 1.426 3.242
122 HZ3 LYS 20 2HZ LYS 20 3.479 2.086 3.967
123 H ALA 21 H ALA 21 -0.370 -4.849 0.850
124 HA ALA 21 HA ALA 21 -1.886 -4.845 -1.646
125 HB1 ALA 21 3HB ALA 21 -3.309 -6.393 0.113
126 HB2 ALA 21 1HB ALA 21 -2.098 -6.980 -1.026
127 HB3 ALA 21 2HB ALA 21 -1.645 -6.635 0.643
128 H PHE 22 H PHE 22 -4.093 -4.270 -1.748
129 HA PHE 22 HA PHE 22 -5.164 -2.757 0.520
130 HB2 PHE 22 1HB PHE 22 -5.258 -1.667 -2.293
131 HB3 PHE 22 2HB PHE 22 -5.710 -0.847 -0.802
132 HD1 PHE 22 HD2 PHE 22 -2.885 -2.070 -2.815
133 HD2 PHE 22 HD1 PHE 22 -4.087 0.229 0.558
134 HE1 PHE 22 HE2 PHE 22 -0.614 -1.138 -2.646
135 HE2 PHE 22 HE1 PHE 22 -1.819 1.166 0.733
136 HZ PHE 22 HZ PHE 22 -0.078 0.481 -0.870
137 H SER 23 H SER 23 -7.484 -2.343 0.344
138 HA SER 23 HA SER 23 -8.823 -4.603 -0.918
139 HB2 SER 23 1HB SER 23 -9.415 -4.286 1.375
140 HB3 SER 23 2HB SER 23 -9.716 -2.566 1.128
141 HG SER 23 HG SER 23 -11.656 -3.778 1.193
142 H VAL 24 H VAL 24 -8.964 -1.064 -0.882
143 HA VAL 24 HA VAL 24 -10.971 -1.046 -2.987
144 HB VAL 24 HB VAL 24 -9.567 1.287 -1.680
145 HG11 VAL 24 1HG1 VAL 24 -10.505 1.818 -3.868
146 HG12 VAL 24 2HG1 VAL 24 -12.068 1.172 -3.363
147 HG13 VAL 24 3HG1 VAL 24 -11.413 2.611 -2.582
148 HG21 VAL 24 3HG2 VAL 24 -11.804 -0.404 -0.822
149 HG22 VAL 24 1HG2 VAL 24 -10.755 0.657 0.119
150 HG23 VAL 24 2HG2 VAL 24 -12.128 1.329 -0.761
151 H TYR 25 H TYR 25 -10.665 -0.110 -5.033
152 HA TYR 25 HA TYR 25 -8.131 -0.631 -6.212
153 HB2 TYR 25 1HB TYR 25 -10.021 -0.975 -7.595
154 HB3 TYR 25 2HB TYR 25 -10.672 0.621 -7.240
155 HD1 TYR 25 HD2 TYR 25 -7.355 -0.610 -8.460
156 HD2 TYR 25 HD1 TYR 25 -10.695 1.940 -9.128
157 HE1 TYR 25 HE2 TYR 25 -6.267 0.277 -10.480
158 HE2 TYR 25 HE1 TYR 25 -9.617 2.833 -11.150
159 HH TYR 25 HH TYR 25 -7.330 1.456 -12.774
160 H SER 26 H SER 26 -9.951 2.382 -5.669
161 HA SER 26 HA SER 26 -8.086 4.165 -6.691
162 HB2 SER 26 1HB SER 26 -10.279 4.367 -4.675
163 HB3 SER 26 2HB SER 26 -9.146 5.712 -4.811
164 HG SER 26 HG SER 26 -9.664 5.404 -7.208
165 H SER 27 H SER 27 -8.296 2.707 -3.488
166 HA SER 27 HA SER 27 -6.418 4.219 -2.126
167 HB2 SER 27 1HB SER 27 -7.042 1.268 -1.893
168 HB3 SER 27 2HB SER 27 -6.051 2.159 -0.738
169 HG SER 27 HG SER 27 -8.024 2.312 0.121
170 H LEU 28 H LEU 28 -5.925 1.448 -4.267
171 HA LEU 28 HA LEU 28 -3.189 1.079 -3.854
172 HB2 LEU 28 1HB LEU 28 -4.232 -0.612 -5.043
173 HB3 LEU 28 2HB LEU 28 -5.045 0.516 -6.127
174 HG LEU 28 HG LEU 28 -2.757 0.991 -7.118
175 HD11 LEU 28 1HD1 LEU 28 -1.143 -0.918 -6.828
176 HD12 LEU 28 2HD1 LEU 28 -2.098 -1.410 -5.430
177 HD13 LEU 28 3HD1 LEU 28 -1.303 0.163 -5.444
178 HD21 LEU 28 3HD2 LEU 28 -2.773 -1.183 -8.407
179 HD22 LEU 28 1HD2 LEU 28 -4.291 -0.285 -8.385
180 HD23 LEU 28 2HD2 LEU 28 -4.087 -1.698 -7.349
181 H THR 29 H THR 29 -4.870 3.100 -6.245
182 HA THR 29 HA THR 29 -2.568 4.093 -7.517
183 HB THR 29 HB THR 29 -3.996 5.874 -8.396
184 HG1 THR 29 HG1 THR 29 -6.058 6.182 -7.607
185 HG21 THR 29 3HG2 THR 29 -4.207 3.818 -9.559
186 HG22 THR 29 1HG2 THR 29 -5.850 4.411 -9.316
187 HG23 THR 29 2HG2 THR 29 -5.217 3.122 -8.292
188 H THR 30 H THR 30 -4.512 5.405 -4.850
189 HA THR 30 HA THR 30 -3.161 7.819 -4.512
190 HB THR 30 HB THR 30 -4.351 6.179 -2.272
191 HG1 THR 30 HG1 THR 30 -5.758 8.124 -3.770
192 HG21 THR 30 3HG2 THR 30 -2.976 8.396 -1.944
193 HG22 THR 30 1HG2 THR 30 -4.470 8.126 -1.047
194 HG23 THR 30 2HG2 THR 30 -4.475 9.153 -2.481
195 H HIS 31 H HIS 31 -2.371 4.587 -3.403
196 HA HIS 31 HA HIS 31 -0.243 5.450 -1.675
197 HB2 HIS 31 1HB HIS 31 -1.152 3.420 -0.988
198 HB3 HIS 31 2HB HIS 31 -1.259 2.796 -2.631
199 HD1 HIS 31 HD1 HIS 31 1.093 3.151 0.244
200 HD2 HIS 31 HD2 HIS 31 1.081 1.592 -3.607
201 HE1 HIS 31 HE1 HIS 31 3.181 1.760 0.076
202 H GLN 32 H GLN 32 -0.368 3.736 -4.798
203 HA GLN 32 HA GLN 32 2.255 3.402 -5.369
204 HB2 GLN 32 1HB GLN 32 0.007 4.271 -7.174
205 HB3 GLN 32 2HB GLN 32 1.616 3.924 -7.795
206 HG2 GLN 32 1HG GLN 32 1.417 1.655 -6.728
207 HG3 GLN 32 2HG GLN 32 -0.278 2.036 -6.429
208 HE21 GLN 32 1HE2 GLN 32 0.256 -0.131 -7.896
209 HE22 GLN 32 2HE2 GLN 32 -0.116 0.139 -9.562
210 H VAL 33 H VAL 33 0.607 6.412 -5.048
211 HA VAL 33 HA VAL 33 2.138 8.151 -6.548
212 HB VAL 33 HB VAL 33 1.001 8.649 -3.793
213 HG11 VAL 33 1HG1 VAL 33 2.788 10.243 -4.942
214 HG12 VAL 33 2HG1 VAL 33 1.350 10.820 -5.785
215 HG13 VAL 33 3HG1 VAL 33 1.422 10.874 -4.024
216 HG21 VAL 33 3HG2 VAL 33 -0.169 9.109 -6.536
217 HG22 VAL 33 1HG2 VAL 33 -0.697 7.907 -5.358
218 HG23 VAL 33 2HG2 VAL 33 -0.900 9.626 -5.016
219 H ILE 34 H ILE 34 2.806 6.843 -3.328
220 HA ILE 34 HA ILE 34 5.057 8.353 -2.697
221 HB ILE 34 HB ILE 34 5.664 6.625 -1.137
222 HG12 ILE 34 1HG1 ILE 34 3.552 4.769 -2.147
223 HG13 ILE 34 2HG1 ILE 34 5.100 4.811 -2.983
224 HG21 ILE 34 1HG2 ILE 34 2.998 6.097 -0.530
225 HG22 ILE 34 2HG2 ILE 34 3.975 7.443 0.054
226 HG23 ILE 34 3HG2 ILE 34 2.975 7.639 -1.386
227 HD11 ILE 34 3HD1 ILE 34 6.003 3.517 -1.441
228 HD12 ILE 34 1HD1 ILE 34 5.550 4.652 -0.170
229 HD13 ILE 34 2HD1 ILE 34 4.424 3.387 -0.666
230 H HIS 35 H HIS 35 4.651 6.131 -5.198
231 HA HIS 35 HA HIS 35 7.556 5.706 -5.428
232 HB2 HIS 35 1HB HIS 35 5.301 4.146 -6.708
233 HB3 HIS 35 2HB HIS 35 7.019 3.804 -6.890
234 HD1 HIS 35 HD1 HIS 35 8.189 3.514 -4.297
235 HD2 HIS 35 HD2 HIS 35 4.201 2.505 -4.882
236 HE1 HIS 35 HE1 HIS 35 7.604 1.961 -2.408
237 H THR 36 H THR 36 4.694 6.911 -7.023
238 HA THR 36 HA THR 36 5.551 7.183 -9.633
239 HB THR 36 HB THR 36 4.043 9.180 -9.763
240 HG1 THR 36 HG1 THR 36 3.217 10.029 -7.967
241 HG21 THR 36 3HG2 THR 36 2.813 6.856 -8.283
242 HG22 THR 36 1HG2 THR 36 3.239 6.823 -9.994
243 HG23 THR 36 2HG2 THR 36 2.012 7.949 -9.411
244 H GLY 37 H GLY 37 5.863 9.618 -7.037
245 HA2 GLY 37 1HA GLY 37 7.836 10.888 -6.663
246 HA3 GLY 37 2HA GLY 37 8.331 10.554 -8.316
247 H GLU 38 H GLU 38 8.248 13.114 -6.971
248 HA GLU 38 HA GLU 38 6.193 14.475 -8.585
249 HB2 GLU 38 1HB GLU 38 7.521 15.436 -6.045
250 HB3 GLU 38 2HB GLU 38 6.305 16.314 -6.963
251 HG2 GLU 38 1HG GLU 38 5.913 13.685 -5.551
252 HG3 GLU 38 2HG GLU 38 5.325 15.259 -5.017
253 H LYS 39 H LYS 39 9.501 14.784 -7.327
254 HA LYS 39 HA LYS 39 10.193 17.000 -8.958
255 HB2 LYS 39 1HB LYS 39 12.452 16.630 -8.221
256 HB3 LYS 39 2HB LYS 39 11.374 16.359 -6.858
257 HG2 LYS 39 1HG LYS 39 11.697 14.057 -6.899
258 HG3 LYS 39 2HG LYS 39 12.311 14.077 -8.554
259 HD2 LYS 39 1HD LYS 39 14.225 13.760 -7.259
260 HD3 LYS 39 2HD LYS 39 14.237 15.492 -7.600
261 HE2 LYS 39 1HE LYS 39 12.913 14.476 -5.122
262 HE3 LYS 39 2HE LYS 39 14.669 14.621 -5.175
263 HZ1 LYS 39 3HZ LYS 39 14.564 16.840 -5.078
264 HZ2 LYS 39 1HZ LYS 39 12.992 16.606 -4.498
265 HZ3 LYS 39 2HZ LYS 39 13.247 16.943 -6.135
266 HA PRO 40 HA PRO 40 10.912 15.044 -12.837
267 HB2 PRO 40 1HB PRO 40 12.619 16.858 -13.918
268 HB3 PRO 40 2HB PRO 40 10.887 17.158 -13.737
269 HG2 PRO 40 1HG PRO 40 13.157 18.063 -12.008
270 HG3 PRO 40 2HG PRO 40 11.738 18.973 -12.558
271 HD2 PRO 40 1HD PRO 40 11.910 17.904 -10.077
272 HD3 PRO 40 2HD PRO 40 10.369 18.060 -10.945
273 H SER 41 H SER 41 13.776 16.284 -11.126
274 HA SER 41 HA SER 41 15.173 13.793 -11.779
275 HB2 SER 41 1HB SER 41 17.134 14.885 -12.559
276 HB3 SER 41 2HB SER 41 15.795 15.658 -13.407
277 HG SER 41 HG SER 41 17.318 16.642 -11.242
278 H GLY 42 H GLY 42 16.706 13.141 -10.269
279 HA2 GLY 42 1HA GLY 42 17.857 14.581 -8.230
280 HA3 GLY 42 2HA GLY 42 16.282 14.109 -7.610
281 HA PRO 43 HA PRO 43 19.051 10.162 -8.344
282 HB2 PRO 43 1HB PRO 43 21.704 10.658 -8.053
283 HB3 PRO 43 2HB PRO 43 20.884 10.707 -9.618
284 HG2 PRO 43 1HG PRO 43 21.638 12.965 -7.802
285 HG3 PRO 43 2HG PRO 43 21.787 12.849 -9.566
286 HD2 PRO 43 1HD PRO 43 19.772 14.197 -8.359
287 HD3 PRO 43 2HD PRO 43 19.567 13.363 -9.913
288 H SER 44 H SER 44 19.138 8.905 -6.585
289 HA SER 44 HA SER 44 19.968 10.137 -4.039
290 HB2 SER 44 1HB SER 44 17.515 9.559 -4.256
291 HB3 SER 44 2HB SER 44 17.997 7.865 -4.343
292 HG SER 44 HG SER 44 18.790 7.992 -2.279
293 H SER 45 H SER 45 19.741 7.040 -5.772
294 HA SER 45 HA SER 45 22.380 6.298 -4.871
295 HB2 SER 45 1HB SER 45 20.888 5.621 -2.974
296 HB3 SER 45 2HB SER 45 20.041 4.545 -4.085
297 HG SER 45 HG SER 45 21.550 3.261 -3.218
298 H GLY 46 H GLY 46 23.228 4.458 -5.979
299 HA2 GLY 46 1HA GLY 46 23.599 3.312 -7.940
300 HA3 GLY 46 2HA GLY 46 21.950 2.752 -7.703
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -16.816 -34.238 3.663
2 HA2 GLY 1 1HA GLY 1 -17.869 -31.606 3.702
3 HA3 GLY 1 2HA GLY 1 -17.723 -32.216 5.344
4 H SER 2 H SER 2 -16.194 -30.452 3.044
5 HA SER 2 HA SER 2 -13.529 -31.116 4.117
6 HB2 SER 2 1HB SER 2 -14.342 -30.141 1.377
7 HB3 SER 2 2HB SER 2 -12.678 -30.059 1.955
8 HG SER 2 HG SER 2 -12.594 -32.023 1.200
9 H SER 3 H SER 3 -13.460 -29.678 5.795
10 HA SER 3 HA SER 3 -13.810 -26.831 5.130
11 HB2 SER 3 1HB SER 3 -13.870 -28.129 7.864
12 HB3 SER 3 2HB SER 3 -14.213 -26.438 7.500
13 HG SER 3 HG SER 3 -16.184 -27.288 7.508
14 H GLY 4 H GLY 4 -12.313 -25.306 6.071
15 HA2 GLY 4 1HA GLY 4 -9.991 -25.964 7.466
16 HA3 GLY 4 2HA GLY 4 -9.614 -26.090 5.754
17 H SER 5 H SER 5 -10.883 -23.886 8.217
18 HA SER 5 HA SER 5 -11.042 -21.537 6.830
19 HB2 SER 5 1HB SER 5 -10.733 -20.382 8.907
20 HB3 SER 5 2HB SER 5 -11.555 -21.897 9.277
21 HG SER 5 HG SER 5 -9.975 -22.118 10.651
22 H SER 6 H SER 6 -9.586 -19.707 6.648
23 HA SER 6 HA SER 6 -6.760 -20.513 6.422
24 HB2 SER 6 1HB SER 6 -6.532 -19.349 4.380
25 HB3 SER 6 2HB SER 6 -8.063 -20.211 4.225
26 HG SER 6 HG SER 6 -7.907 -17.823 3.685
27 H GLY 7 H GLY 7 -5.211 -19.039 7.047
28 HA2 GLY 7 1HA GLY 7 -6.250 -16.628 8.405
29 HA3 GLY 7 2HA GLY 7 -4.876 -17.559 8.982
30 H THR 8 H THR 8 -5.944 -15.808 6.068
31 HA THR 8 HA THR 8 -3.471 -14.307 6.042
32 HB THR 8 HB THR 8 -4.152 -15.993 3.628
33 HG1 THR 8 HG1 THR 8 -3.284 -17.490 4.903
34 HG21 THR 8 3HG2 THR 8 -2.913 -14.333 2.703
35 HG22 THR 8 1HG2 THR 8 -1.574 -15.288 3.337
36 HG23 THR 8 2HG2 THR 8 -2.163 -13.890 4.236
37 H GLY 9 H GLY 9 -4.038 -12.284 5.609
38 HA2 GLY 9 1HA GLY 9 -6.594 -11.681 4.423
39 HA3 GLY 9 2HA GLY 9 -5.406 -10.518 4.993
40 H VAL 10 H VAL 10 -6.435 -12.491 2.295
41 HA VAL 10 HA VAL 10 -4.387 -11.476 0.528
42 HB VAL 10 HB VAL 10 -5.283 -13.759 0.247
43 HG11 VAL 10 1HG1 VAL 10 -7.822 -12.258 -0.020
44 HG12 VAL 10 2HG1 VAL 10 -7.602 -13.663 -1.065
45 HG13 VAL 10 3HG1 VAL 10 -7.510 -13.843 0.687
46 HG21 VAL 10 3HG2 VAL 10 -4.570 -11.996 -1.687
47 HG22 VAL 10 1HG2 VAL 10 -4.896 -13.706 -1.968
48 HG23 VAL 10 2HG2 VAL 10 -6.156 -12.508 -2.264
49 H LYS 11 H LYS 11 -4.691 -10.079 -1.210
50 HA LYS 11 HA LYS 11 -7.265 -8.702 -1.419
51 HB2 LYS 11 1HB LYS 11 -4.629 -7.436 -0.739
52 HB3 LYS 11 2HB LYS 11 -5.857 -6.522 -1.606
53 HG2 LYS 11 1HG LYS 11 -7.264 -6.436 0.193
54 HG3 LYS 11 2HG LYS 11 -6.635 -7.928 0.897
55 HD2 LYS 11 1HD LYS 11 -4.529 -6.722 1.430
56 HD3 LYS 11 2HD LYS 11 -5.275 -5.234 0.844
57 HE2 LYS 11 1HE LYS 11 -7.166 -5.960 2.559
58 HE3 LYS 11 2HE LYS 11 -5.809 -6.791 3.318
59 HZ1 LYS 11 3HZ LYS 11 -4.844 -4.302 2.757
60 HZ2 LYS 11 1HZ LYS 11 -5.362 -4.850 4.271
61 HZ3 LYS 11 2HZ LYS 11 -6.428 -4.002 3.269
62 HA PRO 12 HA PRO 12 -6.455 -9.041 -5.732
63 HB2 PRO 12 1HB PRO 12 -8.120 -7.097 -6.640
64 HB3 PRO 12 2HB PRO 12 -8.700 -8.653 -6.032
65 HG2 PRO 12 1HG PRO 12 -8.562 -6.007 -4.639
66 HG3 PRO 12 2HG PRO 12 -9.866 -7.209 -4.630
67 HD2 PRO 12 1HD PRO 12 -8.092 -6.968 -2.598
68 HD3 PRO 12 2HD PRO 12 -8.811 -8.524 -3.058
69 H TYR 13 H TYR 13 -6.687 -5.665 -4.589
70 HA TYR 13 HA TYR 13 -4.817 -4.773 -6.602
71 HB2 TYR 13 1HB TYR 13 -5.929 -3.191 -4.281
72 HB3 TYR 13 2HB TYR 13 -5.226 -2.559 -5.766
73 HD1 TYR 13 HD1 TYR 13 -6.464 -2.858 -7.927
74 HD2 TYR 13 HD2 TYR 13 -8.224 -3.764 -4.161
75 HE1 TYR 13 HE1 TYR 13 -8.695 -2.785 -8.959
76 HE2 TYR 13 HE2 TYR 13 -10.460 -3.694 -5.183
77 HH TYR 13 HH TYR 13 -11.384 -4.053 -7.616
78 H MET 14 H MET 14 -2.708 -5.053 -6.363
79 HA MET 14 HA MET 14 -1.538 -4.684 -3.686
80 HB2 MET 14 1HB MET 14 -0.598 -6.669 -5.763
81 HB3 MET 14 2HB MET 14 0.084 -6.433 -4.159
82 HG2 MET 14 1HG MET 14 -2.169 -7.087 -3.238
83 HG3 MET 14 2HG MET 14 -2.597 -7.574 -4.876
84 HE1 MET 14 3HE MET 14 -1.778 -10.214 -1.995
85 HE2 MET 14 1HE MET 14 -0.334 -9.268 -1.634
86 HE3 MET 14 2HE MET 14 -1.897 -8.467 -1.787
87 H CYS 15 H CYS 15 0.517 -3.728 -3.600
88 HA CYS 15 HA CYS 15 1.110 -2.036 -5.895
89 HB2 CYS 15 1HB CYS 15 0.969 -1.022 -3.651
90 HB3 CYS 15 2HB CYS 15 2.300 -2.042 -3.113
91 H ASN 16 H ASN 16 2.664 -2.476 -7.305
92 HA ASN 16 HA ASN 16 4.567 -4.610 -6.689
93 HB2 ASN 16 1HB ASN 16 3.097 -4.411 -8.857
94 HB3 ASN 16 2HB ASN 16 4.364 -3.304 -9.378
95 HD21 ASN 16 1HD2 ASN 16 3.392 -6.266 -9.848
96 HD22 ASN 16 2HD2 ASN 16 4.892 -7.110 -10.000
97 H GLU 17 H GLU 17 5.085 -2.277 -5.325
98 HA GLU 17 HA GLU 17 7.575 -1.401 -6.617
99 HB2 GLU 17 1HB GLU 17 5.509 0.339 -5.275
100 HB3 GLU 17 2HB GLU 17 7.160 0.870 -5.559
101 HG2 GLU 17 1HG GLU 17 5.555 -0.178 -7.838
102 HG3 GLU 17 2HG GLU 17 5.262 1.457 -7.246
103 H CYS 18 H CYS 18 5.735 -1.789 -3.632
104 HA CYS 18 HA CYS 18 8.288 -2.024 -2.179
105 HB2 CYS 18 1HB CYS 18 7.120 -1.152 -0.177
106 HB3 CYS 18 2HB CYS 18 7.172 0.021 -1.490
107 H GLY 19 H GLY 19 4.917 -3.073 -2.401
108 HA2 GLY 19 1HA GLY 19 4.610 -5.532 -2.338
109 HA3 GLY 19 2HA GLY 19 5.693 -5.531 -0.954
110 H LYS 20 H LYS 20 2.973 -3.384 -1.719
111 HA LYS 20 HA LYS 20 1.765 -4.167 0.849
112 HB2 LYS 20 1HB LYS 20 2.515 -1.722 0.325
113 HB3 LYS 20 2HB LYS 20 1.040 -1.660 -0.630
114 HG2 LYS 20 1HG LYS 20 -0.317 -1.732 1.198
115 HG3 LYS 20 2HG LYS 20 0.848 -2.641 2.165
116 HD2 LYS 20 1HD LYS 20 2.257 -0.587 2.274
117 HD3 LYS 20 2HD LYS 20 0.960 0.290 1.458
118 HE2 LYS 20 1HE LYS 20 0.643 0.718 3.745
119 HE3 LYS 20 2HE LYS 20 -0.551 -0.514 3.340
120 HZ1 LYS 20 3HZ LYS 20 1.825 -1.781 4.130
121 HZ2 LYS 20 1HZ LYS 20 0.311 -1.820 4.885
122 HZ3 LYS 20 2HZ LYS 20 1.432 -0.622 5.298
123 H ALA 21 H ALA 21 -0.723 -3.640 0.796
124 HA ALA 21 HA ALA 21 -1.968 -4.336 -1.737
125 HB1 ALA 21 3HB ALA 21 -1.610 -6.244 0.450
126 HB2 ALA 21 1HB ALA 21 -3.275 -6.101 -0.115
127 HB3 ALA 21 2HB ALA 21 -1.991 -6.521 -1.250
128 H PHE 22 H PHE 22 -4.262 -4.024 -1.746
129 HA PHE 22 HA PHE 22 -5.432 -2.745 0.600
130 HB2 PHE 22 1HB PHE 22 -5.655 -1.381 -2.073
131 HB3 PHE 22 2HB PHE 22 -6.024 -0.735 -0.478
132 HD1 PHE 22 HD2 PHE 22 -3.112 -2.163 -2.327
133 HD2 PHE 22 HD1 PHE 22 -4.542 0.765 0.412
134 HE1 PHE 22 HE2 PHE 22 -0.861 -1.177 -2.210
135 HE2 PHE 22 HE1 PHE 22 -2.293 1.756 0.532
136 HZ PHE 22 HZ PHE 22 -0.449 0.784 -0.779
137 H SER 23 H SER 23 -7.764 -2.509 0.449
138 HA SER 23 HA SER 23 -8.934 -4.740 -0.985
139 HB2 SER 23 1HB SER 23 -10.949 -4.257 0.328
140 HB3 SER 23 2HB SER 23 -9.532 -4.339 1.374
141 HG SER 23 HG SER 23 -10.303 -1.856 0.332
142 H VAL 24 H VAL 24 -8.867 -1.263 -1.148
143 HA VAL 24 HA VAL 24 -10.926 -1.263 -3.239
144 HB VAL 24 HB VAL 24 -9.626 1.131 -1.939
145 HG11 VAL 24 1HG1 VAL 24 -12.005 2.007 -2.754
146 HG12 VAL 24 2HG1 VAL 24 -10.583 2.023 -3.799
147 HG13 VAL 24 3HG1 VAL 24 -11.771 0.727 -3.944
148 HG21 VAL 24 3HG2 VAL 24 -11.574 -0.705 -0.884
149 HG22 VAL 24 1HG2 VAL 24 -10.808 0.682 -0.110
150 HG23 VAL 24 2HG2 VAL 24 -12.275 0.903 -1.064
151 H TYR 25 H TYR 25 -10.551 -0.131 -5.226
152 HA TYR 25 HA TYR 25 -7.988 -0.688 -6.344
153 HB2 TYR 25 1HB TYR 25 -9.854 -0.930 -7.793
154 HB3 TYR 25 2HB TYR 25 -10.454 0.680 -7.414
155 HD1 TYR 25 HD2 TYR 25 -7.060 -0.498 -8.431
156 HD2 TYR 25 HD1 TYR 25 -10.442 1.903 -9.381
157 HE1 TYR 25 HE2 TYR 25 -5.866 0.402 -10.384
158 HE2 TYR 25 HE1 TYR 25 -9.258 2.808 -11.337
159 HH TYR 25 HH TYR 25 -7.138 3.052 -12.256
160 H SER 26 H SER 26 -9.768 2.342 -5.757
161 HA SER 26 HA SER 26 -7.842 4.129 -6.635
162 HB2 SER 26 1HB SER 26 -10.102 4.839 -6.051
163 HB3 SER 26 2HB SER 26 -9.807 4.459 -4.354
164 HG SER 26 HG SER 26 -8.181 6.078 -4.367
165 H SER 27 H SER 27 -8.294 2.815 -3.362
166 HA SER 27 HA SER 27 -6.362 4.144 -1.971
167 HB2 SER 27 1HB SER 27 -6.080 1.985 -0.650
168 HB3 SER 27 2HB SER 27 -7.730 2.588 -0.798
169 HG SER 27 HG SER 27 -7.788 0.429 -1.272
170 H LEU 28 H LEU 28 -5.884 1.290 -4.025
171 HA LEU 28 HA LEU 28 -3.168 0.895 -3.558
172 HB2 LEU 28 1HB LEU 28 -4.376 -0.771 -4.721
173 HB3 LEU 28 2HB LEU 28 -4.889 0.368 -5.964
174 HG LEU 28 HG LEU 28 -2.595 0.472 -6.815
175 HD11 LEU 28 1HD1 LEU 28 -0.872 -0.157 -5.574
176 HD12 LEU 28 2HD1 LEU 28 -1.475 -1.814 -5.557
177 HD13 LEU 28 3HD1 LEU 28 -1.975 -0.681 -4.302
178 HD21 LEU 28 3HD2 LEU 28 -2.709 -1.494 -8.004
179 HD22 LEU 28 1HD2 LEU 28 -4.364 -1.356 -7.410
180 HD23 LEU 28 2HD2 LEU 28 -3.227 -2.438 -6.606
181 H THR 29 H THR 29 -4.741 2.833 -6.094
182 HA THR 29 HA THR 29 -2.370 3.765 -7.290
183 HB THR 29 HB THR 29 -3.766 5.531 -8.297
184 HG1 THR 29 HG1 THR 29 -5.849 4.465 -6.665
185 HG21 THR 29 3HG2 THR 29 -3.886 3.579 -9.544
186 HG22 THR 29 1HG2 THR 29 -5.586 3.908 -9.210
187 HG23 THR 29 2HG2 THR 29 -4.721 2.693 -8.269
188 H THR 30 H THR 30 -4.482 5.235 -4.838
189 HA THR 30 HA THR 30 -3.246 7.673 -4.523
190 HB THR 30 HB THR 30 -4.328 6.001 -2.249
191 HG1 THR 30 HG1 THR 30 -6.322 6.720 -2.834
192 HG21 THR 30 3HG2 THR 30 -3.088 8.049 -1.605
193 HG22 THR 30 1HG2 THR 30 -4.799 8.125 -1.187
194 HG23 THR 30 2HG2 THR 30 -4.196 8.998 -2.595
195 H HIS 31 H HIS 31 -2.273 4.541 -3.241
196 HA HIS 31 HA HIS 31 -0.146 5.626 -1.638
197 HB2 HIS 31 1HB HIS 31 -0.908 3.631 -0.746
198 HB3 HIS 31 2HB HIS 31 -1.114 2.881 -2.326
199 HD1 HIS 31 HD1 HIS 31 1.542 3.694 0.216
200 HD2 HIS 31 HD2 HIS 31 1.060 1.450 -3.247
201 HE1 HIS 31 HE1 HIS 31 3.615 2.282 0.037
202 H GLN 32 H GLN 32 -0.217 3.559 -4.547
203 HA GLN 32 HA GLN 32 2.390 3.328 -5.168
204 HB2 GLN 32 1HB GLN 32 0.090 3.943 -7.018
205 HB3 GLN 32 2HB GLN 32 1.698 3.543 -7.607
206 HG2 GLN 32 1HG GLN 32 1.368 1.464 -6.006
207 HG3 GLN 32 2HG GLN 32 -0.332 1.822 -6.304
208 HE21 GLN 32 1HE2 GLN 32 -1.216 0.973 -8.049
209 HE22 GLN 32 2HE2 GLN 32 -0.364 0.336 -9.410
210 H VAL 33 H VAL 33 0.567 6.272 -5.176
211 HA VAL 33 HA VAL 33 2.001 7.923 -6.844
212 HB VAL 33 HB VAL 33 0.800 8.592 -4.155
213 HG11 VAL 33 1HG1 VAL 33 2.537 10.220 -4.921
214 HG12 VAL 33 2HG1 VAL 33 1.550 10.512 -6.354
215 HG13 VAL 33 3HG1 VAL 33 0.920 10.902 -4.752
216 HG21 VAL 33 3HG2 VAL 33 -0.546 9.610 -6.503
217 HG22 VAL 33 1HG2 VAL 33 -0.402 7.853 -6.551
218 HG23 VAL 33 2HG2 VAL 33 -1.180 8.637 -5.175
219 H ILE 34 H ILE 34 2.716 7.134 -3.454
220 HA ILE 34 HA ILE 34 4.891 8.765 -3.020
221 HB ILE 34 HB ILE 34 5.631 7.215 -1.328
222 HG12 ILE 34 1HG1 ILE 34 3.614 5.161 -2.117
223 HG13 ILE 34 2HG1 ILE 34 5.132 5.220 -3.007
224 HG21 ILE 34 1HG2 ILE 34 2.870 8.027 -1.622
225 HG22 ILE 34 2HG2 ILE 34 3.026 6.596 -0.604
226 HG23 ILE 34 3HG2 ILE 34 3.911 8.066 -0.200
227 HD11 ILE 34 3HD1 ILE 34 5.763 3.775 -1.403
228 HD12 ILE 34 1HD1 ILE 34 6.088 5.262 -0.513
229 HD13 ILE 34 2HD1 ILE 34 4.586 4.380 -0.238
230 H HIS 35 H HIS 35 4.652 6.014 -5.084
231 HA HIS 35 HA HIS 35 7.537 5.704 -5.308
232 HB2 HIS 35 1HB HIS 35 5.253 4.265 -6.672
233 HB3 HIS 35 2HB HIS 35 6.956 3.887 -6.916
234 HD1 HIS 35 HD1 HIS 35 8.156 3.554 -4.302
235 HD2 HIS 35 HD2 HIS 35 4.193 2.489 -4.952
236 HE1 HIS 35 HE1 HIS 35 7.592 1.918 -2.477
237 H THR 36 H THR 36 4.863 7.127 -7.022
238 HA THR 36 HA THR 36 6.737 8.034 -9.110
239 HB THR 36 HB THR 36 5.222 6.536 -10.188
240 HG1 THR 36 HG1 THR 36 5.569 8.797 -11.063
241 HG21 THR 36 3HG2 THR 36 2.864 6.573 -9.974
242 HG22 THR 36 1HG2 THR 36 2.889 8.121 -9.130
243 HG23 THR 36 2HG2 THR 36 3.497 6.671 -8.331
244 H GLY 37 H GLY 37 7.132 9.877 -7.712
245 HA2 GLY 37 1HA GLY 37 5.223 12.008 -8.250
246 HA3 GLY 37 2HA GLY 37 5.524 11.659 -6.554
247 H GLU 38 H GLU 38 7.636 11.850 -9.419
248 HA GLU 38 HA GLU 38 9.379 13.653 -7.882
249 HB2 GLU 38 1HB GLU 38 10.008 11.902 -10.265
250 HB3 GLU 38 2HB GLU 38 11.153 12.980 -9.479
251 HG2 GLU 38 1HG GLU 38 9.753 10.743 -8.045
252 HG3 GLU 38 2HG GLU 38 11.313 10.558 -8.845
253 H LYS 39 H LYS 39 10.622 15.238 -9.268
254 HA LYS 39 HA LYS 39 9.166 17.227 -10.265
255 HB2 LYS 39 1HB LYS 39 11.610 17.315 -10.114
256 HB3 LYS 39 2HB LYS 39 11.745 16.253 -11.509
257 HG2 LYS 39 1HG LYS 39 12.058 18.248 -12.537
258 HG3 LYS 39 2HG LYS 39 10.298 18.158 -12.640
259 HD2 LYS 39 1HD LYS 39 11.496 19.401 -10.219
260 HD3 LYS 39 2HD LYS 39 11.539 20.315 -11.728
261 HE2 LYS 39 1HE LYS 39 9.069 19.899 -11.929
262 HE3 LYS 39 2HE LYS 39 9.117 19.237 -10.296
263 HZ1 LYS 39 3HZ LYS 39 8.890 21.907 -11.052
264 HZ2 LYS 39 1HZ LYS 39 10.403 21.736 -10.313
265 HZ3 LYS 39 2HZ LYS 39 9.001 21.278 -9.485
266 HA PRO 40 HA PRO 40 7.057 15.011 -13.624
267 HB2 PRO 40 1HB PRO 40 4.947 16.717 -13.700
268 HB3 PRO 40 2HB PRO 40 5.072 15.394 -12.534
269 HG2 PRO 40 1HG PRO 40 5.681 18.303 -12.171
270 HG3 PRO 40 2HG PRO 40 4.829 17.193 -11.081
271 HD2 PRO 40 1HD PRO 40 7.423 17.882 -10.722
272 HD3 PRO 40 2HD PRO 40 6.786 16.288 -10.268
273 H SER 41 H SER 41 8.555 18.011 -13.375
274 HA SER 41 HA SER 41 8.098 18.562 -16.235
275 HB2 SER 41 1HB SER 41 7.246 20.272 -14.499
276 HB3 SER 41 2HB SER 41 8.948 20.662 -14.251
277 HG SER 41 HG SER 41 7.469 21.723 -16.027
278 H GLY 42 H GLY 42 9.952 19.827 -17.233
279 HA2 GLY 42 1HA GLY 42 12.454 18.506 -16.439
280 HA3 GLY 42 2HA GLY 42 12.109 19.182 -18.024
281 HA PRO 43 HA PRO 43 14.477 22.703 -16.887
282 HB2 PRO 43 1HB PRO 43 13.475 24.498 -18.660
283 HB3 PRO 43 2HB PRO 43 14.562 23.187 -19.131
284 HG2 PRO 43 1HG PRO 43 11.581 23.343 -19.345
285 HG3 PRO 43 2HG PRO 43 12.756 22.736 -20.525
286 HD2 PRO 43 1HD PRO 43 11.311 21.092 -18.931
287 HD3 PRO 43 2HD PRO 43 12.958 20.699 -19.465
288 H SER 44 H SER 44 14.338 24.402 -15.509
289 HA SER 44 HA SER 44 11.633 25.280 -14.736
290 HB2 SER 44 1HB SER 44 14.136 25.116 -13.040
291 HB3 SER 44 2HB SER 44 12.582 25.746 -12.495
292 HG SER 44 HG SER 44 11.773 23.577 -13.187
293 H SER 45 H SER 45 15.008 26.333 -15.050
294 HA SER 45 HA SER 45 15.920 28.441 -15.154
295 HB2 SER 45 1HB SER 45 15.275 29.610 -17.133
296 HB3 SER 45 2HB SER 45 15.036 27.896 -17.471
297 HG SER 45 HG SER 45 12.786 28.296 -16.816
298 H GLY 46 H GLY 46 14.292 28.298 -12.931
299 HA2 GLY 46 1HA GLY 46 13.133 31.014 -12.892
300 HA3 GLY 46 2HA GLY 46 12.322 29.662 -12.116
Start of MODEL 19
1 H1 GLY 1 H GLY 1 9.219 -23.753 4.646
2 HA2 GLY 1 1HA GLY 1 9.022 -22.067 7.056
3 HA3 GLY 1 2HA GLY 1 9.296 -21.335 5.482
4 H SER 2 H SER 2 6.997 -22.985 7.527
5 HA SER 2 HA SER 2 4.859 -22.228 5.643
6 HB2 SER 2 1HB SER 2 3.537 -24.100 6.569
7 HB3 SER 2 2HB SER 2 5.041 -24.660 5.838
8 HG SER 2 HG SER 2 4.918 -25.673 7.780
9 H SER 3 H SER 3 4.514 -20.199 6.549
10 HA SER 3 HA SER 3 4.253 -19.657 9.288
11 HB2 SER 3 1HB SER 3 4.562 -17.946 7.479
12 HB3 SER 3 2HB SER 3 2.874 -18.188 7.030
13 HG SER 3 HG SER 3 3.658 -16.476 8.719
14 H GLY 4 H GLY 4 1.673 -20.030 6.845
15 HA2 GLY 4 1HA GLY 4 -0.452 -20.893 7.040
16 HA3 GLY 4 2HA GLY 4 0.039 -21.589 8.577
17 H SER 5 H SER 5 -0.431 -18.287 7.308
18 HA SER 5 HA SER 5 -1.430 -17.355 9.824
19 HB2 SER 5 1HB SER 5 -1.734 -15.221 8.698
20 HB3 SER 5 2HB SER 5 -0.173 -15.903 8.243
21 HG SER 5 HG SER 5 -1.612 -16.825 6.415
22 H SER 6 H SER 6 -3.542 -16.432 10.175
23 HA SER 6 HA SER 6 -5.642 -17.658 8.510
24 HB2 SER 6 1HB SER 6 -5.650 -17.334 11.521
25 HB3 SER 6 2HB SER 6 -6.987 -17.962 10.558
26 HG SER 6 HG SER 6 -5.388 -19.579 9.817
27 H GLY 7 H GLY 7 -7.208 -16.335 7.806
28 HA2 GLY 7 1HA GLY 7 -8.331 -14.166 9.093
29 HA3 GLY 7 2HA GLY 7 -6.960 -13.522 8.202
30 H THR 8 H THR 8 -10.016 -13.367 7.960
31 HA THR 8 HA THR 8 -10.337 -14.353 5.222
32 HB THR 8 HB THR 8 -12.735 -13.690 5.519
33 HG1 THR 8 HG1 THR 8 -13.371 -13.243 7.713
34 HG21 THR 8 3HG2 THR 8 -12.025 -15.989 5.920
35 HG22 THR 8 1HG2 THR 8 -13.291 -15.528 7.057
36 HG23 THR 8 2HG2 THR 8 -11.609 -15.585 7.585
37 H GLY 9 H GLY 9 -10.120 -13.040 3.534
38 HA2 GLY 9 1HA GLY 9 -11.164 -10.513 3.212
39 HA3 GLY 9 2HA GLY 9 -9.560 -10.259 3.883
40 H VAL 10 H VAL 10 -10.812 -9.705 1.190
41 HA VAL 10 HA VAL 10 -8.966 -11.254 -0.497
42 HB VAL 10 HB VAL 10 -11.254 -9.542 -1.461
43 HG11 VAL 10 1HG1 VAL 10 -10.301 -11.886 -2.974
44 HG12 VAL 10 2HG1 VAL 10 -10.788 -10.287 -3.540
45 HG13 VAL 10 3HG1 VAL 10 -9.177 -10.532 -2.863
46 HG21 VAL 10 3HG2 VAL 10 -12.236 -11.977 -1.814
47 HG22 VAL 10 1HG2 VAL 10 -11.232 -12.318 -0.405
48 HG23 VAL 10 2HG2 VAL 10 -12.488 -11.083 -0.315
49 H LYS 11 H LYS 11 -7.310 -10.287 -1.498
50 HA LYS 11 HA LYS 11 -7.239 -7.344 -1.560
51 HB2 LYS 11 1HB LYS 11 -4.955 -9.203 -0.876
52 HB3 LYS 11 2HB LYS 11 -4.801 -7.467 -1.113
53 HG2 LYS 11 1HG LYS 11 -5.769 -6.965 0.884
54 HG3 LYS 11 2HG LYS 11 -6.774 -8.417 0.888
55 HD2 LYS 11 1HD LYS 11 -4.662 -9.740 1.265
56 HD3 LYS 11 2HD LYS 11 -3.835 -8.201 1.519
57 HE2 LYS 11 1HE LYS 11 -6.212 -9.182 3.096
58 HE3 LYS 11 2HE LYS 11 -4.534 -9.270 3.630
59 HZ1 LYS 11 3HZ LYS 11 -5.010 -6.640 2.876
60 HZ2 LYS 11 1HZ LYS 11 -4.764 -7.238 4.440
61 HZ3 LYS 11 2HZ LYS 11 -6.333 -7.109 3.821
62 HA PRO 12 HA PRO 12 -6.589 -9.038 -5.814
63 HB2 PRO 12 1HB PRO 12 -8.133 -7.167 -7.034
64 HB3 PRO 12 2HB PRO 12 -8.791 -8.658 -6.349
65 HG2 PRO 12 1HG PRO 12 -8.734 -5.901 -5.183
66 HG3 PRO 12 2HG PRO 12 -10.053 -7.086 -5.189
67 HD2 PRO 12 1HD PRO 12 -8.465 -6.684 -3.033
68 HD3 PRO 12 2HD PRO 12 -9.166 -8.268 -3.419
69 H TYR 13 H TYR 13 -6.617 -5.683 -4.662
70 HA TYR 13 HA TYR 13 -4.665 -4.921 -6.690
71 HB2 TYR 13 1HB TYR 13 -5.810 -3.147 -4.536
72 HB3 TYR 13 2HB TYR 13 -5.083 -2.666 -6.065
73 HD1 TYR 13 HD1 TYR 13 -6.325 -3.000 -8.184
74 HD2 TYR 13 HD2 TYR 13 -8.113 -3.762 -4.399
75 HE1 TYR 13 HE1 TYR 13 -8.550 -2.955 -9.233
76 HE2 TYR 13 HE2 TYR 13 -10.342 -3.721 -5.437
77 HH TYR 13 HH TYR 13 -11.353 -2.615 -7.582
78 H MET 14 H MET 14 -2.566 -5.085 -6.310
79 HA MET 14 HA MET 14 -1.564 -4.593 -3.597
80 HB2 MET 14 1HB MET 14 -0.794 -6.931 -5.352
81 HB3 MET 14 2HB MET 14 0.042 -6.478 -3.872
82 HG2 MET 14 1HG MET 14 -1.921 -6.936 -2.563
83 HG3 MET 14 2HG MET 14 -2.863 -7.243 -4.020
84 HE1 MET 14 3HE MET 14 0.909 -9.081 -2.970
85 HE2 MET 14 1HE MET 14 -0.007 -8.041 -1.878
86 HE3 MET 14 2HE MET 14 -0.070 -9.793 -1.686
87 H CYS 15 H CYS 15 0.568 -3.799 -3.486
88 HA CYS 15 HA CYS 15 1.477 -2.569 -5.988
89 HB2 CYS 15 1HB CYS 15 1.040 -1.042 -4.120
90 HB3 CYS 15 2HB CYS 15 2.189 -1.923 -3.119
91 H ASN 16 H ASN 16 3.152 -3.418 -7.016
92 HA ASN 16 HA ASN 16 4.788 -5.434 -5.752
93 HB2 ASN 16 1HB ASN 16 3.946 -5.506 -8.159
94 HB3 ASN 16 2HB ASN 16 5.164 -4.286 -8.517
95 HD21 ASN 16 1HD2 ASN 16 4.602 -7.584 -7.558
96 HD22 ASN 16 2HD2 ASN 16 6.193 -8.164 -7.899
97 H GLU 17 H GLU 17 4.997 -2.064 -6.466
98 HA GLU 17 HA GLU 17 7.736 -1.660 -6.643
99 HB2 GLU 17 1HB GLU 17 5.756 0.144 -5.241
100 HB3 GLU 17 2HB GLU 17 7.315 0.616 -5.905
101 HG2 GLU 17 1HG GLU 17 5.243 -0.595 -7.679
102 HG3 GLU 17 2HG GLU 17 5.143 1.106 -7.227
103 H CYS 18 H CYS 18 5.708 -1.592 -3.713
104 HA CYS 18 HA CYS 18 8.153 -2.001 -2.121
105 HB2 CYS 18 1HB CYS 18 6.996 -0.949 -0.255
106 HB3 CYS 18 2HB CYS 18 6.975 0.121 -1.653
107 H GLY 19 H GLY 19 4.708 -2.856 -2.332
108 HA2 GLY 19 1HA GLY 19 4.240 -5.290 -2.241
109 HA3 GLY 19 2HA GLY 19 5.358 -5.351 -0.886
110 H LYS 20 H LYS 20 2.610 -3.243 -1.731
111 HA LYS 20 HA LYS 20 1.487 -3.832 0.930
112 HB2 LYS 20 1HB LYS 20 2.322 -1.426 0.267
113 HB3 LYS 20 2HB LYS 20 0.782 -1.346 -0.579
114 HG2 LYS 20 1HG LYS 20 -0.448 -1.456 1.379
115 HG3 LYS 20 2HG LYS 20 0.885 -2.162 2.295
116 HD2 LYS 20 1HD LYS 20 1.174 0.581 1.147
117 HD3 LYS 20 2HD LYS 20 0.241 0.351 2.628
118 HE2 LYS 20 1HE LYS 20 3.011 -0.765 2.321
119 HE3 LYS 20 2HE LYS 20 2.740 0.897 2.844
120 HZ1 LYS 20 3HZ LYS 20 2.217 0.210 4.875
121 HZ2 LYS 20 1HZ LYS 20 2.765 -1.330 4.438
122 HZ3 LYS 20 2HZ LYS 20 1.124 -0.946 4.300
123 H ALA 21 H ALA 21 -0.512 -4.652 1.031
124 HA ALA 21 HA ALA 21 -1.983 -4.968 -1.490
125 HB1 ALA 21 3HB ALA 21 -1.293 -6.910 0.141
126 HB2 ALA 21 1HB ALA 21 -2.758 -6.418 0.992
127 HB3 ALA 21 2HB ALA 21 -2.847 -6.933 -0.692
128 H PHE 22 H PHE 22 -3.971 -4.127 -1.794
129 HA PHE 22 HA PHE 22 -5.244 -2.766 0.487
130 HB2 PHE 22 1HB PHE 22 -5.266 -1.773 -2.368
131 HB3 PHE 22 2HB PHE 22 -5.908 -0.948 -0.951
132 HD1 PHE 22 HD2 PHE 22 -2.741 -2.251 -2.394
133 HD2 PHE 22 HD1 PHE 22 -4.590 0.561 0.212
134 HE1 PHE 22 HE2 PHE 22 -0.575 -1.128 -2.075
135 HE2 PHE 22 HE1 PHE 22 -2.427 1.689 0.535
136 HZ PHE 22 HZ PHE 22 -0.416 0.844 -0.608
137 H SER 23 H SER 23 -7.574 -2.478 0.285
138 HA SER 23 HA SER 23 -8.789 -4.814 -0.973
139 HB2 SER 23 1HB SER 23 -9.266 -4.344 1.411
140 HB3 SER 23 2HB SER 23 -9.996 -2.807 0.947
141 HG SER 23 HG SER 23 -11.384 -4.799 1.240
142 H VAL 24 H VAL 24 -8.502 -1.433 -1.421
143 HA VAL 24 HA VAL 24 -10.672 -1.483 -3.417
144 HB VAL 24 HB VAL 24 -9.573 1.060 -2.266
145 HG11 VAL 24 1HG1 VAL 24 -12.140 1.553 -2.714
146 HG12 VAL 24 2HG1 VAL 24 -10.933 1.651 -3.998
147 HG13 VAL 24 3HG1 VAL 24 -11.942 0.213 -3.842
148 HG21 VAL 24 3HG2 VAL 24 -11.106 -0.954 -0.849
149 HG22 VAL 24 1HG2 VAL 24 -10.324 0.505 -0.242
150 HG23 VAL 24 2HG2 VAL 24 -11.949 0.593 -0.922
151 H TYR 25 H TYR 25 -10.326 -0.288 -5.378
152 HA TYR 25 HA TYR 25 -7.715 -0.680 -6.452
153 HB2 TYR 25 1HB TYR 25 -9.611 -0.987 -7.897
154 HB3 TYR 25 2HB TYR 25 -10.187 0.645 -7.576
155 HD1 TYR 25 HD2 TYR 25 -7.066 -1.007 -8.818
156 HD2 TYR 25 HD1 TYR 25 -9.839 2.191 -9.244
157 HE1 TYR 25 HE2 TYR 25 -5.813 -0.189 -10.770
158 HE2 TYR 25 HE1 TYR 25 -8.595 3.018 -11.198
159 HH TYR 25 HH TYR 25 -5.932 1.201 -12.583
160 H SER 26 H SER 26 -9.660 2.223 -5.780
161 HA SER 26 HA SER 26 -7.777 4.119 -6.591
162 HB2 SER 26 1HB SER 26 -10.295 4.349 -5.825
163 HB3 SER 26 2HB SER 26 -9.561 4.702 -4.261
164 HG SER 26 HG SER 26 -8.513 6.441 -5.156
165 H SER 27 H SER 27 -8.333 2.676 -3.397
166 HA SER 27 HA SER 27 -6.546 4.123 -1.883
167 HB2 SER 27 1HB SER 27 -7.617 1.348 -1.738
168 HB3 SER 27 2HB SER 27 -6.237 1.742 -0.712
169 HG SER 27 HG SER 27 -8.791 2.963 -0.757
170 H LEU 28 H LEU 28 -5.905 1.564 -4.183
171 HA LEU 28 HA LEU 28 -3.181 1.161 -3.444
172 HB2 LEU 28 1HB LEU 28 -4.200 -0.621 -4.571
173 HB3 LEU 28 2HB LEU 28 -4.835 0.429 -5.836
174 HG LEU 28 HG LEU 28 -2.456 0.759 -6.601
175 HD11 LEU 28 1HD1 LEU 28 -0.989 -1.250 -5.881
176 HD12 LEU 28 2HD1 LEU 28 -2.033 -1.285 -4.461
177 HD13 LEU 28 3HD1 LEU 28 -1.096 0.162 -4.829
178 HD21 LEU 28 3HD2 LEU 28 -4.260 -1.016 -7.378
179 HD22 LEU 28 1HD2 LEU 28 -3.054 -2.146 -6.761
180 HD23 LEU 28 2HD2 LEU 28 -2.622 -1.005 -8.035
181 H THR 29 H THR 29 -4.810 3.073 -5.938
182 HA THR 29 HA THR 29 -2.459 4.008 -7.202
183 HB THR 29 HB THR 29 -3.890 5.729 -8.219
184 HG1 THR 29 HG1 THR 29 -6.262 5.348 -7.539
185 HG21 THR 29 3HG2 THR 29 -5.357 4.265 -9.425
186 HG22 THR 29 1HG2 THR 29 -5.339 3.084 -8.116
187 HG23 THR 29 2HG2 THR 29 -3.880 3.372 -9.064
188 H THR 30 H THR 30 -4.524 5.387 -4.669
189 HA THR 30 HA THR 30 -3.258 7.861 -4.414
190 HB THR 30 HB THR 30 -4.446 6.329 -2.101
191 HG1 THR 30 HG1 THR 30 -6.435 6.902 -2.829
192 HG21 THR 30 3HG2 THR 30 -4.485 9.284 -2.703
193 HG22 THR 30 1HG2 THR 30 -3.269 8.512 -1.686
194 HG23 THR 30 2HG2 THR 30 -4.967 8.484 -1.208
195 H HIS 31 H HIS 31 -2.245 4.711 -3.433
196 HA HIS 31 HA HIS 31 -0.232 5.739 -1.596
197 HB2 HIS 31 1HB HIS 31 -1.027 3.766 -0.717
198 HB3 HIS 31 2HB HIS 31 -1.287 3.039 -2.300
199 HD1 HIS 31 HD1 HIS 31 1.437 3.708 0.214
200 HD2 HIS 31 HD2 HIS 31 0.804 1.511 -3.256
201 HE1 HIS 31 HE1 HIS 31 3.437 2.199 -0.001
202 H GLN 32 H GLN 32 -0.397 4.013 -4.691
203 HA GLN 32 HA GLN 32 2.294 3.632 -5.170
204 HB2 GLN 32 1HB GLN 32 -0.079 4.043 -6.933
205 HB3 GLN 32 2HB GLN 32 1.521 4.056 -7.664
206 HG2 GLN 32 1HG GLN 32 1.958 1.833 -6.765
207 HG3 GLN 32 2HG GLN 32 0.363 1.820 -6.015
208 HE21 GLN 32 1HE2 GLN 32 0.335 -0.208 -7.352
209 HE22 GLN 32 2HE2 GLN 32 -0.271 -0.074 -8.964
210 H VAL 33 H VAL 33 0.613 6.569 -4.906
211 HA VAL 33 HA VAL 33 2.022 8.237 -6.654
212 HB VAL 33 HB VAL 33 -0.052 8.770 -5.217
213 HG11 VAL 33 1HG1 VAL 33 1.764 10.061 -3.280
214 HG12 VAL 33 2HG1 VAL 33 0.155 9.374 -3.047
215 HG13 VAL 33 3HG1 VAL 33 1.565 8.316 -3.123
216 HG21 VAL 33 3HG2 VAL 33 1.818 10.348 -6.527
217 HG22 VAL 33 1HG2 VAL 33 0.196 10.830 -6.029
218 HG23 VAL 33 2HG2 VAL 33 1.574 11.154 -4.978
219 H ILE 34 H ILE 34 3.133 6.545 -3.960
220 HA ILE 34 HA ILE 34 5.226 8.435 -3.267
221 HB ILE 34 HB ILE 34 5.882 6.893 -1.558
222 HG12 ILE 34 1HG1 ILE 34 3.834 4.886 -2.442
223 HG13 ILE 34 2HG1 ILE 34 5.438 4.881 -3.167
224 HG21 ILE 34 1HG2 ILE 34 4.106 8.052 -0.699
225 HG22 ILE 34 2HG2 ILE 34 2.974 7.418 -1.892
226 HG23 ILE 34 3HG2 ILE 34 3.500 6.402 -0.550
227 HD11 ILE 34 3HD1 ILE 34 6.121 3.635 -1.476
228 HD12 ILE 34 1HD1 ILE 34 5.855 5.013 -0.407
229 HD13 ILE 34 2HD1 ILE 34 4.574 3.825 -0.651
230 H HIS 35 H HIS 35 4.757 6.061 -5.583
231 HA HIS 35 HA HIS 35 7.651 5.579 -5.841
232 HB2 HIS 35 1HB HIS 35 5.392 3.958 -7.030
233 HB3 HIS 35 2HB HIS 35 7.108 3.564 -7.083
234 HD1 HIS 35 HD1 HIS 35 8.159 3.373 -4.474
235 HD2 HIS 35 HD2 HIS 35 4.117 2.619 -5.071
236 HE1 HIS 35 HE1 HIS 35 7.423 2.035 -2.476
237 H THR 36 H THR 36 4.945 7.099 -7.235
238 HA THR 36 HA THR 36 6.187 7.267 -9.880
239 HB THR 36 HB THR 36 4.043 8.529 -10.453
240 HG1 THR 36 HG1 THR 36 2.944 7.301 -8.168
241 HG21 THR 36 3HG2 THR 36 2.744 6.479 -10.681
242 HG22 THR 36 1HG2 THR 36 3.782 5.671 -9.506
243 HG23 THR 36 2HG2 THR 36 4.439 6.177 -11.063
244 H GLY 37 H GLY 37 7.559 8.581 -7.816
245 HA2 GLY 37 1HA GLY 37 7.225 11.377 -8.690
246 HA3 GLY 37 2HA GLY 37 7.419 10.999 -6.985
247 H GLU 38 H GLU 38 9.348 8.883 -7.408
248 HA GLU 38 HA GLU 38 11.648 10.483 -8.321
249 HB2 GLU 38 1HB GLU 38 11.488 10.175 -5.827
250 HB3 GLU 38 2HB GLU 38 11.692 8.449 -6.091
251 HG2 GLU 38 1HG GLU 38 13.869 8.877 -7.134
252 HG3 GLU 38 2HG GLU 38 13.667 10.600 -6.820
253 H LYS 39 H LYS 39 13.539 9.184 -8.981
254 HA LYS 39 HA LYS 39 12.691 6.663 -10.250
255 HB2 LYS 39 1HB LYS 39 14.631 7.231 -11.867
256 HB3 LYS 39 2HB LYS 39 13.110 8.098 -12.037
257 HG2 LYS 39 1HG LYS 39 14.027 10.003 -10.859
258 HG3 LYS 39 2HG LYS 39 15.537 9.131 -10.583
259 HD2 LYS 39 1HD LYS 39 14.403 9.841 -13.289
260 HD3 LYS 39 2HD LYS 39 15.693 10.718 -12.464
261 HE2 LYS 39 1HE LYS 39 16.993 8.572 -12.427
262 HE3 LYS 39 2HE LYS 39 15.749 7.876 -13.464
263 HZ1 LYS 39 3HZ LYS 39 16.703 10.368 -14.473
264 HZ2 LYS 39 1HZ LYS 39 16.621 8.860 -15.236
265 HZ3 LYS 39 2HZ LYS 39 17.963 9.256 -14.286
266 HA PRO 40 HA PRO 40 15.994 5.554 -7.225
267 HB2 PRO 40 1HB PRO 40 14.843 3.204 -6.503
268 HB3 PRO 40 2HB PRO 40 14.418 4.750 -5.759
269 HG2 PRO 40 1HG PRO 40 12.999 3.231 -7.913
270 HG3 PRO 40 2HG PRO 40 12.323 4.070 -6.504
271 HD2 PRO 40 1HD PRO 40 12.315 5.153 -8.986
272 HD3 PRO 40 2HD PRO 40 12.452 6.137 -7.515
273 H SER 41 H SER 41 14.349 3.599 -9.676
274 HA SER 41 HA SER 41 16.182 1.524 -9.912
275 HB2 SER 41 1HB SER 41 14.027 1.443 -11.031
276 HB3 SER 41 2HB SER 41 14.470 2.811 -12.053
277 HG SER 41 HG SER 41 15.685 0.245 -12.029
278 H GLY 42 H GLY 42 17.872 1.129 -11.432
279 HA2 GLY 42 1HA GLY 42 19.179 2.210 -13.304
280 HA3 GLY 42 2HA GLY 42 19.266 3.605 -12.239
281 HA PRO 43 HA PRO 43 22.606 0.219 -11.394
282 HB2 PRO 43 1HB PRO 43 24.516 0.839 -13.220
283 HB3 PRO 43 2HB PRO 43 23.256 -0.364 -13.519
284 HG2 PRO 43 1HG PRO 43 23.395 2.493 -14.402
285 HG3 PRO 43 2HG PRO 43 22.890 1.062 -15.319
286 HD2 PRO 43 1HD PRO 43 21.117 2.787 -14.220
287 HD3 PRO 43 2HD PRO 43 20.783 1.052 -14.386
288 H SER 44 H SER 44 22.742 3.608 -12.290
289 HA SER 44 HA SER 44 24.563 4.079 -10.037
290 HB2 SER 44 1HB SER 44 24.932 4.939 -12.886
291 HB3 SER 44 2HB SER 44 25.541 5.961 -11.584
292 HG SER 44 HG SER 44 26.644 4.028 -10.815
293 H SER 45 H SER 45 23.452 5.278 -8.652
294 HA SER 45 HA SER 45 21.122 6.616 -8.977
295 HB2 SER 45 1HB SER 45 23.434 7.032 -7.135
296 HB3 SER 45 2HB SER 45 22.152 8.243 -7.148
297 HG SER 45 HG SER 45 21.865 5.461 -6.663
298 H GLY 46 H GLY 46 20.407 8.564 -9.710
299 HA2 GLY 46 1HA GLY 46 22.283 10.642 -10.466
300 HA3 GLY 46 2HA GLY 46 21.471 9.858 -11.813
Start of MODEL 20
1 H1 GLY 1 H GLY 1 8.428 0.026 15.264
2 HA2 GLY 1 1HA GLY 1 11.254 0.183 14.445
3 HA3 GLY 1 2HA GLY 1 10.843 -0.048 16.138
4 H SER 2 H SER 2 9.109 -1.920 16.372
5 HA SER 2 HA SER 2 9.986 -4.175 14.693
6 HB2 SER 2 1HB SER 2 11.027 -4.067 17.045
7 HB3 SER 2 2HB SER 2 9.416 -4.472 17.639
8 HG SER 2 HG SER 2 11.237 -6.136 16.787
9 H SER 3 H SER 3 8.061 -3.972 13.486
10 HA SER 3 HA SER 3 5.663 -4.910 14.918
11 HB2 SER 3 1HB SER 3 5.940 -2.745 12.856
12 HB3 SER 3 2HB SER 3 4.425 -3.637 13.001
13 HG SER 3 HG SER 3 5.647 -2.512 15.275
14 H GLY 4 H GLY 4 4.201 -6.222 13.681
15 HA2 GLY 4 1HA GLY 4 5.630 -7.871 11.739
16 HA3 GLY 4 2HA GLY 4 4.124 -8.284 12.545
17 H SER 5 H SER 5 3.271 -8.924 10.504
18 HA SER 5 HA SER 5 2.372 -6.632 8.891
19 HB2 SER 5 1HB SER 5 2.561 -8.029 6.863
20 HB3 SER 5 2HB SER 5 4.125 -7.801 7.645
21 HG SER 5 HG SER 5 4.247 -9.878 7.846
22 H SER 6 H SER 6 0.270 -6.674 8.209
23 HA SER 6 HA SER 6 -1.425 -8.697 9.460
24 HB2 SER 6 1HB SER 6 -2.178 -6.508 9.948
25 HB3 SER 6 2HB SER 6 -1.969 -5.976 8.280
26 HG SER 6 HG SER 6 -3.709 -7.309 7.698
27 H GLY 7 H GLY 7 -1.072 -10.439 8.044
28 HA2 GLY 7 1HA GLY 7 -1.860 -10.062 5.244
29 HA3 GLY 7 2HA GLY 7 -1.039 -11.469 5.905
30 H THR 8 H THR 8 -4.126 -9.818 5.626
31 HA THR 8 HA THR 8 -5.498 -12.244 6.557
32 HB THR 8 HB THR 8 -7.529 -10.822 6.685
33 HG1 THR 8 HG1 THR 8 -6.352 -9.235 5.115
34 HG21 THR 8 3HG2 THR 8 -6.689 -9.357 8.580
35 HG22 THR 8 1HG2 THR 8 -5.076 -9.965 8.209
36 HG23 THR 8 2HG2 THR 8 -6.343 -11.080 8.720
37 H GLY 9 H GLY 9 -6.302 -13.580 5.083
38 HA2 GLY 9 1HA GLY 9 -7.068 -14.403 3.080
39 HA3 GLY 9 2HA GLY 9 -7.929 -12.877 2.947
40 H VAL 10 H VAL 10 -7.639 -12.767 0.713
41 HA VAL 10 HA VAL 10 -4.937 -11.944 -0.090
42 HB VAL 10 HB VAL 10 -5.254 -14.270 -0.842
43 HG11 VAL 10 1HG1 VAL 10 -7.724 -14.148 -1.058
44 HG12 VAL 10 2HG1 VAL 10 -7.511 -13.193 -2.526
45 HG13 VAL 10 3HG1 VAL 10 -6.929 -14.857 -2.463
46 HG21 VAL 10 3HG2 VAL 10 -4.465 -13.951 -3.039
47 HG22 VAL 10 1HG2 VAL 10 -5.367 -12.447 -3.229
48 HG23 VAL 10 2HG2 VAL 10 -3.971 -12.508 -2.153
49 H LYS 11 H LYS 11 -4.909 -10.087 -1.183
50 HA LYS 11 HA LYS 11 -7.460 -9.082 -2.264
51 HB2 LYS 11 1HB LYS 11 -5.102 -7.515 -1.199
52 HB3 LYS 11 2HB LYS 11 -6.566 -6.814 -1.877
53 HG2 LYS 11 1HG LYS 11 -7.800 -8.119 -0.044
54 HG3 LYS 11 2HG LYS 11 -6.211 -8.289 0.704
55 HD2 LYS 11 1HD LYS 11 -6.110 -5.689 0.295
56 HD3 LYS 11 2HD LYS 11 -7.868 -5.847 0.285
57 HE2 LYS 11 1HE LYS 11 -6.195 -7.019 2.483
58 HE3 LYS 11 2HE LYS 11 -6.710 -5.334 2.518
59 HZ1 LYS 11 3HZ LYS 11 -8.142 -7.263 3.581
60 HZ2 LYS 11 1HZ LYS 11 -8.761 -7.347 2.008
61 HZ3 LYS 11 2HZ LYS 11 -8.858 -5.900 2.879
62 HA PRO 12 HA PRO 12 -5.619 -9.086 -6.267
63 HB2 PRO 12 1HB PRO 12 -7.248 -7.281 -7.474
64 HB3 PRO 12 2HB PRO 12 -7.760 -8.927 -7.083
65 HG2 PRO 12 1HG PRO 12 -8.277 -6.379 -5.598
66 HG3 PRO 12 2HG PRO 12 -9.389 -7.715 -5.949
67 HD2 PRO 12 1HD PRO 12 -8.185 -7.416 -3.543
68 HD3 PRO 12 2HD PRO 12 -8.581 -9.008 -4.221
69 H TYR 13 H TYR 13 -6.528 -5.836 -5.099
70 HA TYR 13 HA TYR 13 -4.516 -4.520 -6.626
71 HB2 TYR 13 1HB TYR 13 -5.755 -3.294 -4.188
72 HB3 TYR 13 2HB TYR 13 -5.319 -2.535 -5.715
73 HD1 TYR 13 HD1 TYR 13 -6.687 -3.374 -7.803
74 HD2 TYR 13 HD2 TYR 13 -7.984 -3.751 -3.768
75 HE1 TYR 13 HE1 TYR 13 -9.013 -3.583 -8.577
76 HE2 TYR 13 HE2 TYR 13 -10.313 -3.962 -4.531
77 HH TYR 13 HH TYR 13 -11.320 -3.165 -7.605
78 H MET 14 H MET 14 -2.521 -5.410 -6.148
79 HA MET 14 HA MET 14 -1.478 -4.748 -3.477
80 HB2 MET 14 1HB MET 14 -1.781 -7.158 -3.583
81 HB3 MET 14 2HB MET 14 -0.889 -7.232 -5.097
82 HG2 MET 14 1HG MET 14 1.141 -6.575 -3.990
83 HG3 MET 14 2HG MET 14 0.275 -6.326 -2.476
84 HE1 MET 14 3HE MET 14 -1.332 -8.334 -1.583
85 HE2 MET 14 1HE MET 14 -0.453 -9.799 -1.145
86 HE3 MET 14 2HE MET 14 0.152 -8.223 -0.635
87 H CYS 15 H CYS 15 0.179 -3.389 -3.554
88 HA CYS 15 HA CYS 15 1.309 -2.507 -5.992
89 HB2 CYS 15 1HB CYS 15 1.233 -0.961 -4.182
90 HB3 CYS 15 2HB CYS 15 2.081 -2.069 -3.109
91 H ASN 16 H ASN 16 3.347 -2.822 -6.874
92 HA ASN 16 HA ASN 16 4.702 -5.270 -5.974
93 HB2 ASN 16 1HB ASN 16 3.786 -5.181 -8.318
94 HB3 ASN 16 2HB ASN 16 4.956 -3.910 -8.662
95 HD21 ASN 16 1HD2 ASN 16 4.388 -7.127 -8.889
96 HD22 ASN 16 2HD2 ASN 16 6.013 -7.704 -9.003
97 H GLU 17 H GLU 17 5.091 -1.872 -6.449
98 HA GLU 17 HA GLU 17 7.860 -1.653 -6.680
99 HB2 GLU 17 1HB GLU 17 5.863 0.181 -5.349
100 HB3 GLU 17 2HB GLU 17 7.546 0.609 -5.626
101 HG2 GLU 17 1HG GLU 17 6.487 1.577 -7.422
102 HG3 GLU 17 2HG GLU 17 7.037 0.043 -8.094
103 H CYS 18 H CYS 18 5.874 -1.537 -3.722
104 HA CYS 18 HA CYS 18 8.293 -2.226 -2.186
105 HB2 CYS 18 1HB CYS 18 7.324 -1.086 -0.282
106 HB3 CYS 18 2HB CYS 18 7.331 0.006 -1.664
107 H GLY 19 H GLY 19 4.803 -2.763 -2.480
108 HA2 GLY 19 1HA GLY 19 4.031 -5.082 -2.391
109 HA3 GLY 19 2HA GLY 19 5.195 -5.345 -1.101
110 H LYS 20 H LYS 20 2.213 -3.648 -1.938
111 HA LYS 20 HA LYS 20 1.342 -3.953 0.841
112 HB2 LYS 20 1HB LYS 20 2.278 -1.599 0.310
113 HB3 LYS 20 2HB LYS 20 0.807 -1.386 -0.631
114 HG2 LYS 20 1HG LYS 20 -0.561 -1.635 1.294
115 HG3 LYS 20 2HG LYS 20 0.809 -2.165 2.274
116 HD2 LYS 20 1HD LYS 20 0.886 0.516 0.955
117 HD3 LYS 20 2HD LYS 20 -0.053 0.299 2.434
118 HE2 LYS 20 1HE LYS 20 2.048 -0.723 3.434
119 HE3 LYS 20 2HE LYS 20 2.900 -0.097 2.023
120 HZ1 LYS 20 3HZ LYS 20 2.890 1.949 2.862
121 HZ2 LYS 20 1HZ LYS 20 2.424 1.258 4.335
122 HZ3 LYS 20 2HZ LYS 20 1.253 1.877 3.283
123 H ALA 21 H ALA 21 -0.619 -4.823 0.946
124 HA ALA 21 HA ALA 21 -2.222 -4.978 -1.492
125 HB1 ALA 21 3HB ALA 21 -3.053 -6.931 -0.718
126 HB2 ALA 21 1HB ALA 21 -1.592 -6.902 0.269
127 HB3 ALA 21 2HB ALA 21 -3.128 -6.366 0.951
128 H PHE 22 H PHE 22 -4.254 -4.151 -1.698
129 HA PHE 22 HA PHE 22 -5.331 -2.640 0.587
130 HB2 PHE 22 1HB PHE 22 -5.445 -1.731 -2.294
131 HB3 PHE 22 2HB PHE 22 -5.994 -0.839 -0.880
132 HD1 PHE 22 HD2 PHE 22 -2.994 -2.167 -2.583
133 HD2 PHE 22 HD1 PHE 22 -4.521 0.509 0.354
134 HE1 PHE 22 HE2 PHE 22 -0.776 -1.121 -2.388
135 HE2 PHE 22 HE1 PHE 22 -2.305 1.560 0.553
136 HZ PHE 22 HZ PHE 22 -0.429 0.745 -0.818
137 H SER 23 H SER 23 -7.660 -2.225 0.453
138 HA SER 23 HA SER 23 -9.032 -4.529 -0.725
139 HB2 SER 23 1HB SER 23 -10.847 -4.030 0.831
140 HB3 SER 23 2HB SER 23 -9.316 -4.122 1.702
141 HG SER 23 HG SER 23 -10.058 -1.618 0.760
142 H VAL 24 H VAL 24 -8.452 -1.314 -1.387
143 HA VAL 24 HA VAL 24 -10.800 -1.194 -3.159
144 HB VAL 24 HB VAL 24 -9.633 1.164 -1.673
145 HG11 VAL 24 1HG1 VAL 24 -10.558 1.654 -3.923
146 HG12 VAL 24 2HG1 VAL 24 -12.108 1.002 -3.388
147 HG13 VAL 24 3HG1 VAL 24 -11.441 2.440 -2.615
148 HG21 VAL 24 3HG2 VAL 24 -11.168 0.914 -0.053
149 HG22 VAL 24 1HG2 VAL 24 -12.423 0.414 -1.186
150 HG23 VAL 24 2HG2 VAL 24 -11.243 -0.760 -0.603
151 H TYR 25 H TYR 25 -10.439 -0.468 -5.205
152 HA TYR 25 HA TYR 25 -7.918 -0.676 -6.336
153 HB2 TYR 25 1HB TYR 25 -9.988 -0.824 -7.640
154 HB3 TYR 25 2HB TYR 25 -10.294 0.888 -7.368
155 HD1 TYR 25 HD2 TYR 25 -7.370 -1.146 -8.525
156 HD2 TYR 25 HD1 TYR 25 -9.933 2.175 -9.238
157 HE1 TYR 25 HE2 TYR 25 -6.090 -0.601 -10.553
158 HE2 TYR 25 HE1 TYR 25 -8.661 2.728 -11.269
159 HH TYR 25 HH TYR 25 -6.052 2.186 -12.011
160 H SER 26 H SER 26 -9.735 2.320 -5.669
161 HA SER 26 HA SER 26 -7.821 4.152 -6.445
162 HB2 SER 26 1HB SER 26 -10.277 4.441 -5.505
163 HB3 SER 26 2HB SER 26 -9.426 4.726 -3.987
164 HG SER 26 HG SER 26 -9.475 6.248 -6.323
165 H SER 27 H SER 27 -8.239 2.639 -3.260
166 HA SER 27 HA SER 27 -6.347 3.948 -1.785
167 HB2 SER 27 1HB SER 27 -7.893 2.027 -1.078
168 HB3 SER 27 2HB SER 27 -6.626 0.947 -1.659
169 HG SER 27 HG SER 27 -5.294 2.505 -0.197
170 H LEU 28 H LEU 28 -5.827 1.414 -4.177
171 HA LEU 28 HA LEU 28 -3.049 1.089 -3.660
172 HB2 LEU 28 1HB LEU 28 -4.106 -0.705 -4.733
173 HB3 LEU 28 2HB LEU 28 -4.855 0.344 -5.935
174 HG LEU 28 HG LEU 28 -2.609 0.717 -6.930
175 HD11 LEU 28 1HD1 LEU 28 -1.314 -1.580 -5.829
176 HD12 LEU 28 2HD1 LEU 28 -1.734 -0.463 -4.532
177 HD13 LEU 28 3HD1 LEU 28 -0.756 0.092 -5.890
178 HD21 LEU 28 3HD2 LEU 28 -3.616 -2.116 -6.729
179 HD22 LEU 28 1HD2 LEU 28 -2.409 -1.574 -7.895
180 HD23 LEU 28 2HD2 LEU 28 -4.041 -0.908 -7.943
181 H THR 29 H THR 29 -4.895 2.970 -6.027
182 HA THR 29 HA THR 29 -2.709 3.967 -7.483
183 HB THR 29 HB THR 29 -4.202 5.630 -8.371
184 HG1 THR 29 HG1 THR 29 -5.796 6.425 -7.221
185 HG21 THR 29 3HG2 THR 29 -5.648 4.215 -9.427
186 HG22 THR 29 1HG2 THR 29 -6.146 3.430 -7.929
187 HG23 THR 29 2HG2 THR 29 -4.602 3.013 -8.672
188 H THR 30 H THR 30 -4.549 5.441 -4.812
189 HA THR 30 HA THR 30 -3.079 7.807 -4.622
190 HB THR 30 HB THR 30 -4.350 6.375 -2.286
191 HG1 THR 30 HG1 THR 30 -5.465 7.601 -4.517
192 HG21 THR 30 3HG2 THR 30 -2.900 8.682 -2.313
193 HG22 THR 30 1HG2 THR 30 -4.162 8.306 -1.140
194 HG23 THR 30 2HG2 THR 30 -4.537 9.294 -2.552
195 H HIS 31 H HIS 31 -2.277 4.595 -3.675
196 HA HIS 31 HA HIS 31 -0.228 5.380 -1.795
197 HB2 HIS 31 1HB HIS 31 -1.176 3.319 -1.238
198 HB3 HIS 31 2HB HIS 31 -1.189 2.763 -2.908
199 HD1 HIS 31 HD1 HIS 31 1.314 3.487 -0.146
200 HD2 HIS 31 HD2 HIS 31 0.904 1.158 -3.562
201 HE1 HIS 31 HE1 HIS 31 3.347 2.007 -0.199
202 H GLN 32 H GLN 32 -0.364 4.067 -5.086
203 HA GLN 32 HA GLN 32 2.331 3.706 -5.567
204 HB2 GLN 32 1HB GLN 32 0.054 4.494 -7.363
205 HB3 GLN 32 2HB GLN 32 1.686 4.323 -7.995
206 HG2 GLN 32 1HG GLN 32 1.572 1.991 -6.815
207 HG3 GLN 32 2HG GLN 32 -0.167 2.248 -6.943
208 HE21 GLN 32 1HE2 GLN 32 1.711 0.342 -8.263
209 HE22 GLN 32 2HE2 GLN 32 1.412 0.527 -9.954
210 H VAL 33 H VAL 33 0.682 6.610 -4.962
211 HA VAL 33 HA VAL 33 2.050 8.498 -6.459
212 HB VAL 33 HB VAL 33 1.139 8.808 -3.595
213 HG11 VAL 33 1HG1 VAL 33 2.703 10.537 -4.862
214 HG12 VAL 33 2HG1 VAL 33 1.156 11.051 -5.538
215 HG13 VAL 33 3HG1 VAL 33 1.404 11.062 -3.791
216 HG21 VAL 33 3HG2 VAL 33 -0.613 7.986 -5.170
217 HG22 VAL 33 1HG2 VAL 33 -0.962 9.564 -4.463
218 HG23 VAL 33 2HG2 VAL 33 -0.374 9.451 -6.122
219 H ILE 34 H ILE 34 2.982 6.941 -3.427
220 HA ILE 34 HA ILE 34 5.327 8.506 -3.029
221 HB ILE 34 HB ILE 34 5.925 6.922 -1.312
222 HG12 ILE 34 1HG1 ILE 34 3.589 5.164 -1.908
223 HG13 ILE 34 2HG1 ILE 34 5.042 4.968 -2.881
224 HG21 ILE 34 1HG2 ILE 34 3.152 7.917 -1.521
225 HG22 ILE 34 2HG2 ILE 34 3.472 6.741 -0.247
226 HG23 ILE 34 3HG2 ILE 34 4.390 8.245 -0.308
227 HD11 ILE 34 3HD1 ILE 34 4.486 3.931 -0.317
228 HD12 ILE 34 1HD1 ILE 34 5.948 3.743 -1.285
229 HD13 ILE 34 2HD1 ILE 34 5.807 5.087 -0.151
230 H HIS 35 H HIS 35 4.613 6.281 -5.357
231 HA HIS 35 HA HIS 35 7.430 5.464 -5.637
232 HB2 HIS 35 1HB HIS 35 4.921 4.076 -6.596
233 HB3 HIS 35 2HB HIS 35 6.554 3.569 -7.015
234 HD1 HIS 35 HD1 HIS 35 7.936 3.707 -4.313
235 HD2 HIS 35 HD2 HIS 35 4.115 2.165 -4.851
236 HE1 HIS 35 HE1 HIS 35 7.550 2.170 -2.360
237 H THR 36 H THR 36 5.724 7.854 -6.619
238 HA THR 36 HA THR 36 6.243 7.569 -9.498
239 HB THR 36 HB THR 36 4.818 9.590 -9.761
240 HG1 THR 36 HG1 THR 36 3.893 9.274 -7.131
241 HG21 THR 36 3HG2 THR 36 3.573 7.270 -8.284
242 HG22 THR 36 1HG2 THR 36 3.804 7.408 -10.026
243 HG23 THR 36 2HG2 THR 36 2.674 8.479 -9.199
244 H GLY 37 H GLY 37 7.200 9.280 -6.643
245 HA2 GLY 37 1HA GLY 37 8.626 11.332 -8.138
246 HA3 GLY 37 2HA GLY 37 8.526 11.195 -6.389
247 H GLU 38 H GLU 38 9.558 8.780 -8.773
248 HA GLU 38 HA GLU 38 12.328 9.055 -7.953
249 HB2 GLU 38 1HB GLU 38 10.597 6.747 -7.184
250 HB3 GLU 38 2HB GLU 38 12.274 6.433 -7.605
251 HG2 GLU 38 1HG GLU 38 12.775 8.336 -5.907
252 HG3 GLU 38 2HG GLU 38 11.156 7.974 -5.312
253 H LYS 39 H LYS 39 13.493 8.946 -9.742
254 HA LYS 39 HA LYS 39 12.391 7.774 -12.148
255 HB2 LYS 39 1HB LYS 39 15.006 9.196 -11.621
256 HB3 LYS 39 2HB LYS 39 14.479 8.642 -13.205
257 HG2 LYS 39 1HG LYS 39 12.350 10.092 -12.599
258 HG3 LYS 39 2HG LYS 39 13.521 10.924 -11.573
259 HD2 LYS 39 1HD LYS 39 14.807 11.609 -13.378
260 HD3 LYS 39 2HD LYS 39 14.171 10.348 -14.437
261 HE2 LYS 39 1HE LYS 39 13.202 12.370 -15.177
262 HE3 LYS 39 2HE LYS 39 11.939 11.528 -14.281
263 HZ1 LYS 39 3HZ LYS 39 13.660 13.551 -12.986
264 HZ2 LYS 39 1HZ LYS 39 12.152 12.970 -12.483
265 HZ3 LYS 39 2HZ LYS 39 12.259 13.993 -13.826
266 HA PRO 40 HA PRO 40 14.349 3.848 -11.488
267 HB2 PRO 40 1HB PRO 40 13.795 2.807 -13.933
268 HB3 PRO 40 2HB PRO 40 12.583 2.954 -12.655
269 HG2 PRO 40 1HG PRO 40 13.072 4.731 -15.013
270 HG3 PRO 40 2HG PRO 40 11.533 4.154 -14.347
271 HD2 PRO 40 1HD PRO 40 12.495 6.636 -13.852
272 HD3 PRO 40 2HD PRO 40 11.520 5.737 -12.672
273 H SER 41 H SER 41 15.916 2.430 -12.754
274 HA SER 41 HA SER 41 18.253 3.879 -13.304
275 HB2 SER 41 1HB SER 41 17.581 1.033 -14.088
276 HB3 SER 41 2HB SER 41 19.199 1.731 -14.036
277 HG SER 41 HG SER 41 17.441 1.486 -11.819
278 H GLY 42 H GLY 42 15.691 2.714 -15.381
279 HA2 GLY 42 1HA GLY 42 17.094 3.080 -17.842
280 HA3 GLY 42 2HA GLY 42 15.359 2.874 -17.655
281 HA PRO 43 HA PRO 43 16.763 7.426 -18.405
282 HB2 PRO 43 1HB PRO 43 16.857 7.524 -21.117
283 HB3 PRO 43 2HB PRO 43 18.272 7.170 -20.119
284 HG2 PRO 43 1HG PRO 43 16.475 5.285 -21.595
285 HG3 PRO 43 2HG PRO 43 18.244 5.277 -21.470
286 HD2 PRO 43 1HD PRO 43 16.671 3.646 -19.987
287 HD3 PRO 43 2HD PRO 43 18.218 4.282 -19.391
288 H SER 44 H SER 44 14.360 5.243 -19.249
289 HA SER 44 HA SER 44 12.605 6.698 -20.839
290 HB2 SER 44 1HB SER 44 11.951 4.732 -18.631
291 HB3 SER 44 2HB SER 44 10.822 5.276 -19.872
292 HG SER 44 HG SER 44 13.298 4.083 -20.527
293 H SER 45 H SER 45 12.793 8.884 -20.134
294 HA SER 45 HA SER 45 11.374 9.478 -17.623
295 HB2 SER 45 1HB SER 45 12.540 11.618 -17.597
296 HB3 SER 45 2HB SER 45 13.711 10.306 -17.740
297 HG SER 45 HG SER 45 13.432 12.374 -19.333
298 H GLY 46 H GLY 46 10.201 11.646 -17.691
299 HA2 GLY 46 1HA GLY 46 8.544 11.662 -20.113
300 HA3 GLY 46 2HA GLY 46 8.089 12.326 -18.550